data_6gc3_residue ############################ # Computer software used # ############################ 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 6gc3 _Structure_validation_residue.Date_analyzed 2020-01-31 loop_ _Residue_analysis_software.Software_ID _Residue_analysis_software.Software_label _Residue_analysis_software.Method_ID _Residue_analysis_software.Method_label _Residue_analysis_software.Entry_ID _Residue_analysis_software.Structure_validation_oneline_list_ID 1 MolProbity . . ? 1 2 CYRANGE . . ? 1 stop_ loop_ _Residue_analysis.ID _Residue_analysis.PDB_model_num _Residue_analysis.Hydrogen_positions _Residue_analysis.MolProbity_flips _Residue_analysis.Cyrange_core_flag _Residue_analysis.Two_letter_chain_ID _Residue_analysis.PDB_strand_ID _Residue_analysis.PDB_residue_no _Residue_analysis.PDB_ins_code _Residue_analysis.PDB_residue_name _Residue_analysis.Assembly_ID _Residue_analysis.Entity_assembly_ID _Residue_analysis.Entity_ID _Residue_analysis.Comp_ID _Residue_analysis.Comp_index_ID _Residue_analysis.Clash_value _Residue_analysis.Clash_source_PDB_atom_name _Residue_analysis.Clash_destination_PDB_atom_name _Residue_analysis.Clash_destination_PDB_strand_ID _Residue_analysis.Clash_destination_PDB_residue_no _Residue_analysis.Clash_destination_PDB_ins_code _Residue_analysis.Clash_destination_PDB_residue_name _Residue_analysis.Cbeta_deviation_value _Residue_analysis.Rotamer_score _Residue_analysis.Rotamer_name _Residue_analysis.Ramachandran_phi _Residue_analysis.Ramachandran_psi _Residue_analysis.Ramachandran_score _Residue_analysis.Ramachandran_evaluation _Residue_analysis.Ramachandran_type _Residue_analysis.Bond_outlier_count _Residue_analysis.Worst_bond _Residue_analysis.Worst_bond_value _Residue_analysis.Worst_bond_sigma _Residue_analysis.Angle_outlier_count _Residue_analysis.Worst_angle _Residue_analysis.Worst_angle_value _Residue_analysis.Worst_angle_sigma _Residue_analysis.RNA_phosphate_perpendicular_outlier _Residue_analysis.RNA_suitness_score _Residue_analysis.RNA_suite_conformer _Residue_analysis.RNA_suite_triage _Residue_analysis.Max_b_factor _Residue_analysis.Tau_angle _Residue_analysis.Omega_dihedral _Residue_analysis.Disulfide_chi1 _Residue_analysis.Disulfide_chi2 _Residue_analysis.Disulfide_chi3 _Residue_analysis.Disulfide_ss_angle _Residue_analysis.Disulfide_ss _Residue_analysis.Disulfide_ss_angle_prime _Residue_analysis.Disulfide_chi2prime _Residue_analysis.Disulfide_chi1prime _Residue_analysis.Outlier_count_separate_geometry _Residue_analysis.Outlier_count _Residue_analysis.Entry_ID _Residue_analysis.Structure_validation_residue_list_ID . 001 nuclear orig core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 30.6 p-10 . . . . . 0 N--CA 1.453 -0.289 0 N-CA-C 108.762 -0.829 . . . . 0.0 108.762 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 7' ' ' PHE . . . . . 0.66 ' HB2' ' HZ2' ' A' ' 45' ' ' LYS . 1.2 t80 -53.0 -36.37 60.38 Favored 'General case' 0 N--CA 1.447 -0.594 0 C-N-CA 124.982 1.313 . . . . 0.0 110.833 -178.263 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 51.5 tp60 -51.89 -35.27 44.67 Favored 'General case' 0 N--CA 1.454 -0.246 0 C-N-CA 123.978 0.911 . . . . 0.0 112.063 -176.947 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 31.1 m-80 -73.74 -33.48 64.34 Favored 'General case' 0 N--CA 1.453 -0.308 0 N-CA-C 110.076 -0.342 . . . . 0.0 110.076 -179.106 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 10' ' ' PHE . . . . . 0.423 ' CZ ' HG12 ' A' ' 46' ' ' ILE . 2.2 t80 -72.24 -36.45 69.1 Favored 'General case' 0 N--CA 1.452 -0.362 0 N-CA-C 108.896 -0.779 . . . . 0.0 108.896 177.298 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 95.7 t -68.0 -54.64 20.96 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.251 0 N-CA-C 108.81 -0.811 . . . . 0.0 108.81 178.157 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -58.67 -28.87 66.14 Favored 'General case' 0 N--CA 1.452 -0.329 0 N-CA-C 112.196 0.443 . . . . 0.0 112.196 -178.961 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 96.1 m -72.29 -41.99 66.02 Favored 'General case' 0 CA--C 1.532 0.268 0 N-CA-C 109.445 -0.576 . . . . 0.0 109.445 176.188 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . 0.477 ' HA ' ' CD1' ' A' ' 17' ' ' PHE . 12.6 tp -62.98 -44.82 94.99 Favored 'General case' 0 N--CA 1.452 -0.329 0 N-CA-C 109.811 -0.44 . . . . 0.0 109.811 178.035 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 76.0 mm-40 -62.37 -32.1 72.84 Favored 'General case' 0 N--CA 1.45 -0.431 0 C-N-CA 124.588 1.155 . . . . 0.0 109.969 178.446 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 70.2 m -67.03 -29.58 69.43 Favored 'General case' 0 N--CA 1.453 -0.276 0 N-CA-C 109.726 -0.472 . . . . 0.0 109.726 177.473 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 17' ' ' PHE . . . . . 0.477 ' CD1' ' HA ' ' A' ' 14' ' ' LEU . 14.0 m-85 -69.11 -42.31 76.25 Favored 'General case' 0 N--CA 1.457 -0.109 0 C-N-CA 120.126 -0.629 . . . . 0.0 110.492 172.31 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 71.3 mttt -61.16 -27.6 68.52 Favored 'General case' 0 C--N 1.339 0.146 0 CA-C-O 120.583 0.23 . . . . 0.0 110.654 -177.389 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 42.3 t0 -73.56 -23.69 60.0 Favored 'General case' 0 CA--C 1.531 0.23 0 CA-C-N 115.866 -0.606 . . . . 0.0 112.245 -178.722 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . 0.41 ' C ' ' HE3' ' A' ' 21' ' ' LYS . 94.8 mt -79.16 159.86 27.23 Favored 'General case' 0 CA--C 1.528 0.126 0 O-C-N 121.836 -0.54 . . . . 0.0 110.858 -178.789 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . 0.469 ' HE3' ' CA ' ' A' ' 21' ' ' LYS . 0.0 OUTLIER -84.47 -34.95 23.3 Favored 'General case' 0 C--N 1.34 0.163 0 N-CA-C 109.415 -0.587 . . . . 0.0 109.415 176.027 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 83.9 p -82.02 -22.17 36.62 Favored 'General case' 0 C--N 1.34 0.187 0 C-N-CA 122.788 0.435 . . . . 0.0 111.017 177.937 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 71.59 -8.54 5.54 Favored Glycine 0 CA--C 1.529 0.921 0 C-N-CA 123.804 0.716 . . . . 0.0 112.889 179.282 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 44.9 mt -93.22 148.42 4.78 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.177 0 CA-C-N 117.751 0.776 . . . . 0.0 110.36 176.641 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 8.6 t -162.22 83.03 0.56 Allowed 'General case' 0 C--N 1.339 0.131 0 N-CA-C 109.543 -0.54 . . . . 0.0 109.543 -179.004 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -50.79 -44.9 49.13 Favored Glycine 0 CA--C 1.524 0.645 0 CA-C-O 118.725 -1.041 . . . . 0.0 115.067 -169.466 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 31.7 t -71.35 -42.05 68.98 Favored 'General case' 0 N--CA 1.455 -0.211 0 CA-C-N 119.945 1.872 . . . . 0.0 110.529 -177.469 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 80.4 mtt85 -66.68 -39.87 88.33 Favored 'General case' 0 N--CA 1.455 -0.208 0 N-CA-C 110.203 -0.295 . . . . 0.0 110.203 179.496 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 40.8 mt -55.98 -47.13 80.54 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.505 0 N-CA-C 108.254 -1.017 . . . . 0.0 108.254 174.815 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 78.8 mttt -65.7 -24.86 67.09 Favored 'General case' 0 C--N 1.34 0.172 0 CA-C-O 118.474 -0.774 . . . . 0.0 112.584 177.055 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . 0.463 ' HA ' ' HE3' ' A' ' 31' ' ' LYS . 0.0 OUTLIER -67.7 -56.1 10.61 Favored 'General case' 0 C--N 1.343 0.298 0 CA-C-N 119.704 1.138 . . . . 0.0 110.015 -179.915 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 2.4 pp -74.69 -19.18 60.36 Favored 'General case' 0 N--CA 1.455 -0.208 0 C-N-CA 119.201 -0.999 . . . . 0.0 111.101 -178.233 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 46.2 m -72.74 -37.38 67.74 Favored 'General case' 0 N--CA 1.456 -0.163 0 N-CA-C 109.239 -0.652 . . . . 0.0 109.239 176.404 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 96.0 m -74.69 -37.8 62.55 Favored 'General case' 0 N--CA 1.452 -0.344 0 CA-C-N 116.784 -0.189 . . . . 0.0 110.53 -178.398 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 57.7 t80 -69.93 -30.93 68.44 Favored 'General case' 0 N--CA 1.456 -0.162 0 C-N-CA 120.458 -0.497 . . . . 0.0 109.886 177.927 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -69.67 -33.26 72.32 Favored 'General case' 0 N--CA 1.45 -0.434 0 N-CA-C 110.097 -0.334 . . . . 0.0 110.097 176.293 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 20.6 mt -73.55 -40.77 63.7 Favored 'General case' 0 CA--C 1.52 -0.19 0 C-N-CA 122.743 0.417 . . . . 0.0 110.657 177.685 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 42.4 t0 -63.08 -24.54 67.95 Favored 'General case' 0 N--CA 1.455 -0.202 0 C-N-CA 122.814 0.446 . . . . 0.0 110.64 176.825 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 94.8 m-70 -149.75 95.63 2.35 Favored 'General case' 0 N--CA 1.454 -0.239 0 C-N-CA 122.896 0.479 . . . . 0.0 111.622 -177.52 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 40' ' ' ILE . . . . . 0.576 HD11 ' H ' ' A' ' 40' ' ' ILE . 0.0 OUTLIER -72.21 -13.44 16.62 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.345 0 N-CA-C 109.958 -0.386 . . . . 0.0 109.958 174.25 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 18.6 m-20 -58.45 -19.94 40.93 Favored 'General case' 0 CA--C 1.529 0.172 0 C-N-CA 123.24 0.616 . . . . 0.0 112.409 -176.316 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -107.57 15.07 7.8 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.186 0 N-CA-C 112.109 0.411 . . . . 0.0 112.109 176.78 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 3.0 pp20? -51.46 -33.38 30.79 Favored 'General case' 0 C--O 1.224 -0.241 0 CA-C-N 118.864 0.757 . . . . 0.0 110.69 178.479 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 29.8 t -58.11 -50.28 74.02 Favored 'General case' 0 CA--C 1.534 0.357 0 O-C-N 122.366 -0.209 . . . . 0.0 111.257 -177.245 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . 0.66 ' HZ2' ' HB2' ' A' ' 7' ' ' PHE . 18.6 ptpt -73.81 -27.87 61.34 Favored 'General case' 0 C--N 1.34 0.161 0 O-C-N 122.034 -0.416 . . . . 0.0 110.658 -179.906 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 46' ' ' ILE . . . . . 0.423 HG12 ' CZ ' ' A' ' 10' ' ' PHE . 86.5 mt -69.55 -48.13 67.82 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.377 0 C-N-CA 122.48 0.312 . . . . 0.0 110.181 -178.85 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 40.6 mm -64.14 -34.69 70.41 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.385 0 N-CA-C 108.95 -0.759 . . . . 0.0 108.95 179.18 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 28.4 t -63.73 -36.65 84.56 Favored 'General case' 0 N--CA 1.451 -0.401 0 C-N-CA 120.397 -0.521 . . . . 0.0 111.085 177.98 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 16.0 mt -73.4 -36.1 65.98 Favored 'General case' 0 N--CA 1.451 -0.387 0 N-CA-C 113.11 0.781 . . . . 0.0 113.11 -179.416 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 7.7 pt -71.0 -41.25 76.87 Favored 'Isoleucine or valine' 0 C--O 1.226 -0.152 0 CA-C-N 119.311 0.96 . . . . 0.0 110.68 -178.244 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 20.0 pt -68.71 -38.67 79.21 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.191 0 C-N-CA 120.155 -0.618 . . . . 0.0 110.374 179.403 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 92.0 m-20 -72.26 -39.14 68.63 Favored 'General case' 0 N--CA 1.454 -0.245 0 O-C-N 121.944 -0.472 . . . . 0.0 111.586 178.893 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 29.0 t80 -65.32 -51.18 62.34 Favored 'General case' 0 N--CA 1.454 -0.253 0 N-CA-C 108.844 -0.798 . . . . 0.0 108.844 176.533 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 24.0 t -62.29 -31.92 72.57 Favored 'General case' 0 N--CA 1.455 -0.214 0 C-N-CA 122.427 0.291 . . . . 0.0 111.731 -173.988 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 74.3 mtm180 -79.93 -43.56 21.92 Favored 'General case' 0 N--CA 1.453 -0.297 0 O-C-N 121.92 -0.488 . . . . 0.0 112.197 -178.703 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 56.4 mt -81.93 -42.77 19.01 Favored 'General case' 0 N--CA 1.461 0.08 0 N-CA-C 113.163 0.801 . . . . 0.0 113.163 -175.159 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 57' ' ' CYS . . . . . 0.465 ' O ' ' HE2' ' A' ' 62' ' ' LYS . 14.0 p -60.48 159.19 25.32 Favored Pre-proline 0 CA--C 1.534 0.358 0 N-CA-C 114.064 1.135 . . . . 0.0 114.064 -172.529 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 31.3 Cg_exo -59.7 172.77 1.94 Allowed 'Trans proline' 0 N--CA 1.456 -0.709 1 C-N-CA 125.56 4.174 . . . . 0.0 113.198 175.751 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 27.6 p-10 -60.85 -42.37 97.67 Favored 'General case' 0 C--N 1.329 -0.305 0 C-N-CA 124.068 0.947 . . . . 0.0 112.535 -173.039 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 95.1 p -70.06 -36.44 74.99 Favored 'General case' 0 N--CA 1.455 -0.22 0 N-CA-C 109.541 -0.54 . . . . 0.0 109.541 179.345 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 71.4 m80 -69.98 -28.03 65.2 Favored 'General case' 0 N--CA 1.451 -0.413 0 N-CA-C 110.114 -0.328 . . . . 0.0 110.114 177.707 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . 0.465 ' HE2' ' O ' ' A' ' 57' ' ' CYS . 64.6 mttm -64.39 -41.51 96.62 Favored 'General case' 0 C--N 1.339 0.142 0 N-CA-C 109.151 -0.685 . . . . 0.0 109.151 173.069 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -59.68 -45.41 92.15 Favored 'General case' 0 CA--C 1.533 0.319 0 N-CA-C 108.693 -0.854 . . . . 0.0 108.693 176.423 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -69.09 -28.29 73.03 Favored Glycine 0 C--N 1.337 0.635 0 N-CA-C 111.755 -0.538 . . . . 0.0 111.755 -179.425 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 38.0 p -67.15 -36.27 81.46 Favored 'General case' 0 N--CA 1.453 -0.324 0 CA-C-N 117.837 0.819 . . . . 0.0 109.151 177.672 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 81.6 mt -75.42 -26.54 58.43 Favored 'General case' 0 N--CA 1.45 -0.464 0 CA-C-O 119.398 -0.334 . . . . 0.0 110.756 -179.242 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 6.9 m-30 -67.39 -39.14 85.59 Favored 'General case' 0 C--O 1.233 0.189 0 CA-C-N 118.055 0.389 . . . . 0.0 110.686 172.098 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 68' ' ' ILE . . . . . . . . . . . . . 19.7 mt -68.32 -50.85 53.51 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.643 0 N-CA-C 108.761 -0.829 . . . . 0.0 108.761 179.474 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 88.5 mt -56.93 -34.87 45.37 Favored 'Isoleucine or valine' 0 C--N 1.34 0.156 0 C-N-CA 124.103 0.961 . . . . 0.0 111.328 178.223 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 11.9 t70 -69.44 -41.5 76.21 Favored 'General case' 0 N--CA 1.451 -0.407 0 CA-C-N 118.146 0.43 . . . . 0.0 110.588 177.377 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 19.4 m -71.65 -52.88 15.67 Favored 'General case' 0 N--CA 1.452 -0.356 0 CA-C-N 116.603 -0.271 . . . . 0.0 110.423 -175.893 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -75.17 -31.61 24.87 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.244 0 N-CA-C 110.165 -0.309 . . . . 0.0 110.165 -178.136 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -68.74 -56.01 10.34 Favored Glycine 0 C--N 1.336 0.565 0 N-CA-C 110.811 -0.916 . . . . 0.0 110.811 -176.379 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 39.6 mtm105 -65.62 -42.87 91.06 Favored 'General case' 0 N--CA 1.449 -0.511 0 C-N-CA 120.345 -0.542 . . . . 0.0 110.154 -179.475 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -64.17 -28.8 70.0 Favored 'General case' 0 N--CA 1.449 -0.484 0 C-N-CA 119.969 -0.692 . . . . 0.0 110.614 -177.139 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 2.0 m-30 -68.89 -47.31 66.18 Favored 'General case' 0 CA--C 1.518 -0.253 0 CA-C-N 118.738 0.699 . . . . 0.0 110.523 175.527 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 7.3 tt -67.29 -44.61 78.86 Favored 'General case' 0 N--CA 1.449 -0.491 0 C-N-CA 118.041 -1.464 . . . . 0.0 108.726 -179.336 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 72.3 m-20 -57.86 -48.51 79.59 Favored 'General case' 0 CA--C 1.53 0.177 0 N-CA-C 112.353 0.501 . . . . 0.0 112.353 178.922 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 15.4 tm-20 -62.98 -47.02 84.96 Favored 'General case' 0 N--CA 1.452 -0.353 0 CA-C-N 118.343 0.52 . . . . 0.0 110.886 -178.368 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 69.7 p -67.72 -32.78 73.65 Favored 'General case' 0 N--CA 1.454 -0.23 0 N-CA-C 110.152 -0.314 . . . . 0.0 110.152 179.523 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 33.9 ttp180 -66.56 -24.0 66.29 Favored 'General case' 0 N--CA 1.45 -0.447 0 C-N-CA 123.434 0.694 . . . . 0.0 110.939 174.891 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 35.1 t . . . . . 0 CA--C 1.53 0.179 0 C-N-CA 123.63 0.772 . . . . 0.0 113.015 179.089 . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 73.1 Cg_endo . . . . . 0 N--CA 1.449 -1.143 0 N-CA-C 107.716 -1.686 . . . . 0.0 107.716 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 90.46 21.39 37.82 Favored Glycine 0 CA--C 1.523 0.563 0 CA-C-O 119.57 -0.572 . . . . 0.0 111.795 -179.091 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 41.5 p -151.62 173.84 14.18 Favored 'General case' 0 N--CA 1.454 -0.259 0 C-N-CA 123.884 0.873 . . . . 0.0 110.112 176.632 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 94' ' ' CYS . . . . . 0.429 ' HB2' HD11 ' A' ' 98' ' ' ILE . 17.4 p -62.81 -21.65 66.06 Favored 'General case' 0 N--CA 1.448 -0.559 0 CA-C-N 115.741 -0.663 . . . . 0.0 109.526 175.737 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -59.92 -58.59 7.87 Favored 'General case' 0 N--CA 1.447 -0.596 0 N-CA-C 109.373 -0.603 . . . . 0.0 109.373 -176.916 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 75.0 t60 -74.58 -28.05 60.75 Favored 'General case' 0 N--CA 1.45 -0.451 0 N-CA-C 111.583 0.216 . . . . 0.0 111.583 -179.405 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -68.45 -52.52 31.63 Favored 'General case' 0 N--CA 1.452 -0.339 0 CA-C-N 116.662 -0.245 . . . . 0.0 110.785 -178.154 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 98' ' ' ILE . . . . . 0.429 HD11 ' HB2' ' A' ' 94' ' ' CYS . 2.3 mp -69.49 -27.64 34.89 Favored 'Isoleucine or valine' 0 C--N 1.339 0.141 0 C-N-CA 120.266 -0.573 . . . . 0.0 109.889 177.749 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 99' ' ' ASN . . . . . 0.401 HD22 ' C ' ' A' ' 99' ' ' ASN . 0.3 OUTLIER -65.99 -42.81 89.32 Favored 'General case' 0 N--CA 1.452 -0.347 0 CA-C-N 118.03 0.377 . . . . 0.0 110.822 176.554 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 86.5 m -66.53 -43.72 84.42 Favored 'General case' 0 CA--C 1.518 -0.272 0 N-CA-C 110.16 -0.311 . . . . 0.0 110.16 -176.818 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 90.6 mt -69.24 -30.6 68.77 Favored 'General case' 0 N--CA 1.45 -0.431 0 C-N-CA 120.903 -0.319 . . . . 0.0 110.408 179.293 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -61.46 -14.82 43.59 Favored Glycine 0 CA--C 1.528 0.852 0 CA-C-O 119.132 -0.816 . . . . 0.0 112.749 -177.31 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 22.8 mt-10 -107.65 -12.78 15.18 Favored 'General case' 0 C--N 1.339 0.145 0 CA-C-N 118.359 1.079 . . . . 0.0 112.701 -177.981 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 13.2 m -130.03 -4.0 2.72 Favored 'Isoleucine or valine' 0 N--CA 1.461 0.118 0 N-CA-C 113.203 0.816 . . . . 0.0 113.203 -175.311 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 105' ' ' ILE . . . . . . . . . . . . . 10.5 tp -59.14 -23.44 24.59 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.173 0 CA-C-N 119.159 0.89 . . . . 0.0 109.991 178.828 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 25.4 pt20 -65.96 -30.74 71.36 Favored 'General case' 0 N--CA 1.453 -0.3 0 C-N-CA 123.059 0.543 . . . . 0.0 110.27 177.088 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 69.7 mt-10 -75.03 -44.65 46.69 Favored 'General case' 0 N--CA 1.451 -0.403 0 N-CA-C 109.638 -0.505 . . . . 0.0 109.638 -179.563 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 8.3 mp -66.36 -49.53 66.58 Favored 'General case' 0 N--CA 1.452 -0.353 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.624 -176.438 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 8.8 mp -70.13 -54.23 13.85 Favored 'General case' 0 N--CA 1.45 -0.459 0 CA-C-O 119.22 -0.419 . . . . 0.0 110.595 -176.741 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 32.3 t -55.9 -41.84 75.1 Favored 'General case' 0 N--CA 1.455 -0.192 0 CA-C-N 118.461 0.573 . . . . 0.0 111.464 -175.626 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 45.8 t0 -68.58 -41.02 80.27 Favored 'General case' 0 N--CA 1.451 -0.396 0 N-CA-C 109.495 -0.557 . . . . 0.0 109.495 178.013 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -65.33 -35.02 79.71 Favored 'General case' 0 N--CA 1.446 -0.634 0 CA-C-O 119.345 -0.36 . . . . 0.0 110.849 -177.298 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 113' ' ' ILE . . . . . 0.449 ' O ' ' HE3' ' A' ' 121' ' ' LYS . 21.1 mm -68.4 -43.13 84.34 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.32 0 CA-C-N 118.714 0.688 . . . . 0.0 109.17 177.81 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -69.07 -32.76 72.45 Favored 'General case' 0 N--CA 1.451 -0.388 0 N-CA-C 112.178 0.436 . . . . 0.0 112.178 -179.845 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 115' ' ' LYS . . . . . 0.483 ' N ' ' HZ3' ' A' ' 115' ' ' LYS . 0.0 OUTLIER -85.12 -39.6 17.72 Favored 'General case' 0 C--N 1.34 0.153 0 N-CA-C 112.619 0.6 . . . . 0.0 112.619 -178.258 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 116' ' ' SER . . . . . 0.449 ' HB2' ' CB ' ' A' ' 120' ' ' HIS . 49.5 p -85.31 157.16 20.63 Favored 'General case' 0 N--CA 1.455 -0.221 0 N-CA-C 112.257 0.466 . . . . 0.0 112.257 -171.556 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 50.8 t30 -79.97 170.69 16.11 Favored 'General case' 0 N--CA 1.454 -0.237 0 C-N-CA 123.243 0.617 . . . . 0.0 111.102 -178.226 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 118' ' ' GLN . . . . . . . . . . . . . 16.0 mm100 -56.92 -35.98 69.66 Favored 'General case' 0 CA--C 1.527 0.064 0 C-N-CA 123.199 0.6 . . . . 0.0 112.542 -173.634 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 10.0 p-10 -68.93 -40.1 79.22 Favored 'General case' 0 N--CA 1.454 -0.242 0 N-CA-C 109.358 -0.608 . . . . 0.0 109.358 178.299 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 120' ' ' HIS . . . . . 0.449 ' CB ' ' HB2' ' A' ' 116' ' ' SER . 27.8 m170 -66.47 -39.38 88.76 Favored 'General case' 0 N--CA 1.452 -0.352 0 CA-C-N 116.376 -0.375 . . . . 0.0 110.091 176.819 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 121' ' ' LYS . . . . . 0.449 ' HE3' ' O ' ' A' ' 113' ' ' ILE . 64.6 mttp -57.88 -36.18 72.03 Favored 'General case' 0 C--N 1.34 0.158 0 N-CA-C 109.537 -0.542 . . . . 0.0 109.537 176.795 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 40.3 tp10 -72.63 -36.56 68.05 Favored 'General case' 0 N--CA 1.452 -0.349 0 CA-C-O 119.746 -0.168 . . . . 0.0 111.448 -179.902 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 35.6 mmtp -63.43 -39.42 94.43 Favored 'General case' 0 N--CA 1.457 -0.103 0 N-CA-C 109.23 -0.656 . . . . 0.0 109.23 177.738 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 124' ' ' ILE . . . . . . . . . . . . . 65.7 mt -66.9 -34.93 73.18 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.37 0 N-CA-C 108.62 -0.881 . . . . 0.0 108.62 178.211 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 125' ' ' ARG . . . . . 0.425 ' HD2' ' HA ' ' A' ' 125' ' ' ARG . 20.5 tpt85 -68.18 -41.76 80.95 Favored 'General case' 0 N--CA 1.441 -0.877 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.988 -174.993 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 126' ' ' MET . . . . . . . . . . . . . 26.8 ptm -66.7 -32.4 73.68 Favored 'General case' 0 N--CA 1.453 -0.291 0 N-CA-C 108.811 -0.811 . . . . 0.0 108.811 174.809 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 4.7 mp -63.13 -33.83 76.32 Favored 'General case' 0 CA--C 1.531 0.239 0 CA-C-O 118.75 -0.643 . . . . 0.0 110.683 174.852 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 39.5 mt -68.77 -40.94 79.44 Favored 'General case' 0 C--N 1.34 0.162 0 CA-C-N 119.507 1.048 . . . . 0.0 110.148 179.007 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 51.9 m-20 -63.7 -39.2 93.73 Favored 'General case' 0 CA--C 1.522 -0.116 0 C-N-CA 120.353 -0.539 . . . . 0.0 109.911 176.322 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 58.3 mt -64.24 -33.31 61.72 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.256 0 C-N-CA 123.029 0.531 . . . . 0.0 109.959 178.178 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 131' ' ' TRP . . . . . . . . . . . . . 45.9 m0 . . . . . 0 N--CA 1.455 -0.188 0 N-CA-C 112.055 0.391 . . . . 0.0 112.055 176.379 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 16.0 p-10 . . . . . 0 N--CA 1.456 -0.141 0 N-CA-C 106.692 -1.596 . . . . 0.0 106.692 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 7' ' ' PHE . . . . . 0.599 ' HB2' ' HZ3' ' A' ' 45' ' ' LYS . 1.1 t80 -63.01 -32.45 73.82 Favored 'General case' 0 N--CA 1.444 -0.764 0 C-N-CA 125.063 1.345 . . . . 0.0 110.141 -179.662 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 58.2 tp60 -48.38 -39.49 22.52 Favored 'General case' 0 N--CA 1.454 -0.229 0 C-N-CA 124.322 1.049 . . . . 0.0 111.765 -177.948 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 16.2 m-80 -71.75 -35.17 70.02 Favored 'General case' 0 N--CA 1.455 -0.177 0 N-CA-C 110.145 -0.317 . . . . 0.0 110.145 -178.261 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 1.7 t80 -72.29 -38.97 68.64 Favored 'General case' 0 N--CA 1.449 -0.483 0 C-N-CA 123.731 0.812 . . . . 0.0 109.514 178.148 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 93.0 t -66.24 -52.1 51.52 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.271 0 N-CA-C 108.608 -0.886 . . . . 0.0 108.608 178.601 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -60.36 -29.27 68.8 Favored 'General case' 0 N--CA 1.452 -0.367 0 C-N-CA 122.665 0.386 . . . . 0.0 111.848 179.902 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 59.8 m -73.96 -36.62 64.61 Favored 'General case' 0 CA--C 1.53 0.207 0 N-CA-C 109.055 -0.72 . . . . 0.0 109.055 176.484 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . 0.52 ' HA ' ' CD1' ' A' ' 17' ' ' PHE . 4.8 tp -66.57 -46.53 75.71 Favored 'General case' 0 N--CA 1.453 -0.287 0 CA-C-O 121.284 0.564 . . . . 0.0 109.776 177.899 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 67.8 mm-40 -62.01 -28.09 69.33 Favored 'General case' 0 N--CA 1.447 -0.579 0 C-N-CA 124.167 0.987 . . . . 0.0 109.189 178.485 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 48.2 t -70.99 -28.5 64.48 Favored 'General case' 0 N--CA 1.449 -0.517 0 CA-C-N 116.109 -0.496 . . . . 0.0 109.856 177.31 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 17' ' ' PHE . . . . . 0.52 ' CD1' ' HA ' ' A' ' 14' ' ' LEU . 19.4 m-85 -72.42 -35.55 68.39 Favored 'General case' 0 N--CA 1.455 -0.19 0 CA-C-N 118.584 0.629 . . . . 0.0 110.951 171.161 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . 0.468 ' HA ' ' CE1' ' A' ' 61' ' ' HIS . 84.7 mttt -62.93 -26.47 68.83 Favored 'General case' 0 C--N 1.339 0.132 0 N-CA-C 109.643 -0.503 . . . . 0.0 109.643 177.521 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 43.6 t0 -76.71 -15.28 59.82 Favored 'General case' 0 CA--C 1.537 0.478 0 CA-C-N 115.17 -0.923 . . . . 0.0 111.837 176.348 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . 0.408 ' C ' ' H ' ' A' ' 22' ' ' SER . 87.8 mt -86.06 144.68 27.43 Favored 'General case' 0 N--CA 1.45 -0.432 0 O-C-N 121.243 -0.91 . . . . 0.0 111.276 -179.143 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . 0.566 ' H ' ' HE2' ' A' ' 21' ' ' LYS . 1.6 mppt? -83.51 15.04 3.29 Favored 'General case' 0 CA--C 1.531 0.219 0 CA-C-N 115.116 -0.947 . . . . 0.0 108.849 177.316 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 22' ' ' SER . . . . . 0.408 ' H ' ' C ' ' A' ' 20' ' ' LEU . 86.0 p -141.73 -26.05 0.68 Allowed 'General case' 0 N--CA 1.454 -0.263 0 C-N-CA 124.735 1.214 . . . . 0.0 111.796 -175.416 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 75.83 -15.46 4.98 Favored Glycine 0 CA--C 1.526 0.731 0 C-N-CA 123.804 0.716 . . . . 0.0 113.141 175.965 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 81.5 mt -97.07 147.07 6.63 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.383 0 C-N-CA 123.395 0.678 . . . . 0.0 109.904 176.948 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 41.4 t -166.03 99.1 0.64 Allowed 'General case' 0 N--CA 1.455 -0.213 0 N-CA-C 109.055 -0.721 . . . . 0.0 109.055 171.296 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -55.2 -48.71 66.93 Favored Glycine 0 CA--C 1.523 0.544 0 CA-C-O 119.428 -0.651 . . . . 0.0 112.591 -172.65 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 27' ' ' SER . . . . . 0.426 ' HA ' ' HE3' ' A' ' 30' ' ' LYS . 16.5 m -63.05 -43.17 99.37 Favored 'General case' 0 N--CA 1.454 -0.251 0 CA-C-N 118.546 1.173 . . . . 0.0 111.08 -177.346 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 81.2 mtt180 -69.55 -42.31 74.77 Favored 'General case' 0 N--CA 1.457 -0.11 0 C-N-CA 122.509 0.324 . . . . 0.0 110.507 -179.888 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 62.6 mt -58.11 -41.78 81.47 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.616 0 N-CA-C 108.467 -0.938 . . . . 0.0 108.467 175.29 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . 0.426 ' HE3' ' HA ' ' A' ' 27' ' ' SER . 46.9 mtmt -69.37 -22.11 63.75 Favored 'General case' 0 N--CA 1.456 -0.171 0 CA-C-O 118.427 -0.797 . . . . 0.0 111.979 177.853 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . 0.51 ' HA ' ' HE2' ' A' ' 31' ' ' LYS . 8.3 mmpt? -67.1 -56.6 9.34 Favored 'General case' 0 C--N 1.34 0.172 0 CA-C-N 119.621 1.1 . . . . 0.0 109.295 175.352 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 4.6 pp -70.88 -25.73 62.92 Favored 'General case' 0 CA--C 1.528 0.107 0 C-N-CA 120.121 -0.632 . . . . 0.0 110.914 -177.603 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 60.4 m -71.72 -35.61 70.24 Favored 'General case' 0 N--CA 1.457 -0.103 0 N-CA-C 109.94 -0.392 . . . . 0.0 109.94 178.855 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 76.2 m -73.41 -37.33 65.97 Favored 'General case' 0 N--CA 1.454 -0.236 0 N-CA-C 110.414 -0.217 . . . . 0.0 110.414 -178.251 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 42.8 t80 -68.43 -33.22 73.81 Favored 'General case' 0 N--CA 1.457 -0.089 0 C-N-CA 119.852 -0.739 . . . . 0.0 110.087 176.619 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -69.4 -33.6 73.25 Favored 'General case' 0 N--CA 1.448 -0.567 0 CA-C-O 119.775 -0.155 . . . . 0.0 110.617 177.951 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 16.7 mt -73.14 -39.48 65.66 Favored 'General case' 0 N--CA 1.455 -0.209 0 C-N-CA 122.513 0.325 . . . . 0.0 110.684 177.919 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 44.3 t0 -63.61 -26.24 68.59 Favored 'General case' 0 N--CA 1.452 -0.356 0 C-N-CA 122.267 0.227 . . . . 0.0 110.78 176.39 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 97.1 m-70 -149.38 99.84 2.95 Favored 'General case' 0 N--CA 1.454 -0.261 0 C-N-CA 122.658 0.383 . . . . 0.0 111.476 -177.028 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 40' ' ' ILE . . . . . 0.552 ' H ' HD11 ' A' ' 40' ' ' ILE . 0.0 OUTLIER -75.39 -19.26 15.97 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.485 0 CA-C-O 118.844 -0.598 . . . . 0.0 110.79 178.0 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 71.1 m-20 -62.21 -9.16 6.97 Favored 'General case' 0 CA--C 1.531 0.212 0 N-CA-C 113.455 0.909 . . . . 0.0 113.455 -175.567 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -110.4 13.9 8.52 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.168 0 CA-C-N 118.187 0.449 . . . . 0.0 111.655 173.447 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 3.1 pp20? -52.89 -33.4 49.95 Favored 'General case' 0 CA--C 1.529 0.143 0 O-C-N 121.507 -0.746 . . . . 0.0 111.306 177.61 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 3.3 m -64.9 -40.69 95.47 Favored 'General case' 0 CA--C 1.533 0.304 0 CA-C-O 119.053 -0.499 . . . . 0.0 111.911 -176.369 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . 0.599 ' HZ3' ' HB2' ' A' ' 7' ' ' PHE . 15.3 ptpt -73.17 -27.06 61.43 Favored 'General case' 0 C--N 1.341 0.236 0 CA-C-N 119.346 0.975 . . . . 0.0 109.51 176.803 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 78.7 mt -72.34 -47.15 54.03 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.396 0 C-N-CA 122.715 0.406 . . . . 0.0 110.036 -177.427 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 42.2 mm -65.24 -38.16 81.93 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.203 0 N-CA-C 109.658 -0.497 . . . . 0.0 109.658 179.41 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 37.6 t -65.7 -32.49 74.07 Favored 'General case' 0 N--CA 1.455 -0.192 0 C-N-CA 120.38 -0.528 . . . . 0.0 110.478 177.513 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 29.4 tp -75.87 -32.71 59.84 Favored 'General case' 0 N--CA 1.452 -0.364 0 N-CA-C 112.691 0.626 . . . . 0.0 112.691 -177.061 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 11.6 pt -73.97 -38.5 49.74 Favored 'Isoleucine or valine' 0 C--N 1.338 0.098 0 CA-C-N 118.995 0.816 . . . . 0.0 110.956 177.819 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 46.9 pt -66.31 -37.06 78.86 Favored 'Isoleucine or valine' 0 C--O 1.227 -0.084 0 C-N-CA 119.484 -0.886 . . . . 0.0 109.991 178.351 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 95.1 m-20 -67.39 -36.91 82.27 Favored 'General case' 0 N--CA 1.454 -0.263 0 CA-C-N 117.559 0.163 . . . . 0.0 111.113 176.415 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 53' ' ' TYR . . . . . 0.411 ' CE1' ' HB3' ' A' ' 61' ' ' HIS . 18.5 t80 -67.67 -36.55 80.91 Favored 'General case' 0 C--O 1.226 -0.154 0 N-CA-C 109.908 -0.404 . . . . 0.0 109.908 176.172 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 15.2 m -75.59 -22.3 57.06 Favored 'General case' 0 N--CA 1.452 -0.352 0 C-N-CA 122.503 0.321 . . . . 0.0 111.532 -178.464 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 28.9 ttp-105 -86.69 -47.01 9.51 Favored 'General case' 0 N--CA 1.455 -0.199 0 N-CA-C 112.666 0.617 . . . . 0.0 112.666 -177.354 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 46.7 mt -84.95 -47.19 10.52 Favored 'General case' 0 N--CA 1.455 -0.196 0 N-CA-C 112.728 0.64 . . . . 0.0 112.728 -174.242 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 57' ' ' CYS . . . . . 0.512 ' HB3' ' HD2' ' A' ' 58' ' ' PRO . 59.5 m -74.62 160.01 81.99 Favored Pre-proline 0 CA--C 1.534 0.338 0 C-N-CA 122.97 0.508 . . . . 0.0 112.176 -173.573 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 58' ' ' PRO . . . . . 0.512 ' HD2' ' HB3' ' A' ' 57' ' ' CYS . 68.0 Cg_endo -79.01 -176.17 3.14 Favored 'Trans proline' 0 N--CA 1.455 -0.775 0 C-N-CA 125.174 3.916 . . . . 0.0 112.252 -170.073 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 59' ' ' ASP . . . . . 0.433 ' HB2' ' HA ' ' A' ' 116' ' ' SER . 26.0 p-10 -51.15 -50.13 59.5 Favored 'General case' 0 N--CA 1.457 -0.083 0 C-N-CA 124.605 1.162 . . . . 0.0 113.439 -172.837 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 24.5 m -66.18 -33.75 76.48 Favored 'General case' 0 N--CA 1.453 -0.309 0 N-CA-C 109.881 -0.415 . . . . 0.0 109.881 -175.405 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 61' ' ' HIS . . . . . 0.468 ' CE1' ' HA ' ' A' ' 18' ' ' LYS . 33.6 m170 -75.92 -27.44 57.64 Favored 'General case' 0 N--CA 1.451 -0.42 0 N-CA-C 110.051 -0.351 . . . . 0.0 110.051 179.283 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . 0.416 ' HB3' ' HE3' ' A' ' 62' ' ' LYS . 29.4 mtpp -73.58 -34.83 65.29 Favored 'General case' 0 C--N 1.339 0.115 0 N-CA-C 110.008 -0.367 . . . . 0.0 110.008 174.48 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -62.85 -43.77 97.91 Favored 'General case' 0 CA--C 1.535 0.402 0 N-CA-C 107.733 -1.21 . . . . 0.0 107.733 175.894 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -70.01 -24.74 76.31 Favored Glycine 0 C--N 1.34 0.751 0 CA-C-N 116.032 -0.531 . . . . 0.0 111.78 179.071 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 42.9 t -69.29 -37.44 77.83 Favored 'General case' 0 N--CA 1.452 -0.348 0 CA-C-N 117.972 0.886 . . . . 0.0 109.707 175.546 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 77.0 mt -72.96 -25.05 60.88 Favored 'General case' 0 N--CA 1.451 -0.412 0 CA-C-O 119.41 -0.329 . . . . 0.0 110.341 178.789 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 3.1 m-30 -70.23 -37.43 74.98 Favored 'General case' 0 CA--C 1.52 -0.204 0 CA-C-N 118.078 0.399 . . . . 0.0 110.5 171.016 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 68' ' ' ILE . . . . . 0.422 HD13 ' CE1' ' A' ' 17' ' ' PHE . 32.2 mt -67.4 -52.94 36.73 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.6 0 N-CA-C 108.389 -0.967 . . . . 0.0 108.389 178.189 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 71.6 mt -52.86 -35.42 21.78 Favored 'Isoleucine or valine' 0 C--N 1.339 0.145 0 C-N-CA 123.6 0.76 . . . . 0.0 111.6 175.88 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 18.4 t70 -69.61 -41.2 76.0 Favored 'General case' 0 C--N 1.333 -0.113 0 CA-C-N 118.538 0.608 . . . . 0.0 110.73 177.907 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 20.2 m -70.66 -56.5 6.29 Favored 'General case' 0 N--CA 1.45 -0.439 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.251 -176.509 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 72' ' ' ILE . . . . . 0.436 HD11 ' CZ ' ' A' ' 76' ' ' TYR . 0.0 OUTLIER -75.01 -29.89 22.73 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.247 0 N-CA-C 110.077 -0.342 . . . . 0.0 110.077 -176.85 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -69.72 -56.72 7.97 Favored Glycine 0 C--N 1.336 0.562 0 N-CA-C 111.533 -0.627 . . . . 0.0 111.533 -176.421 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 39.7 mtm105 -68.94 -38.46 79.5 Favored 'General case' 0 N--CA 1.453 -0.288 0 CA-C-N 117.48 0.64 . . . . 0.0 110.309 -179.395 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -64.36 -29.47 70.54 Favored 'General case' 0 N--CA 1.45 -0.449 0 C-N-CA 119.6 -0.84 . . . . 0.0 110.468 -179.219 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 76' ' ' TYR . . . . . 0.436 ' CZ ' HD11 ' A' ' 72' ' ' ILE . 2.1 m-30 -71.78 -46.36 58.57 Favored 'General case' 0 N--CA 1.455 -0.203 0 CA-C-N 118.427 0.558 . . . . 0.0 110.847 176.65 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -65.07 -41.21 95.3 Favored 'General case' 0 N--CA 1.45 -0.432 0 C-N-CA 118.427 -1.309 . . . . 0.0 107.896 -178.357 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 94.3 m-20 -65.55 -42.54 91.76 Favored 'General case' 0 C--O 1.23 0.064 0 N-CA-C 113.377 0.88 . . . . 0.0 113.377 178.161 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 15.5 tm-20 -64.29 -41.86 96.68 Favored 'General case' 0 N--CA 1.448 -0.541 0 CA-C-N 118.45 0.568 . . . . 0.0 110.746 178.322 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 71.5 p -74.36 -21.34 59.72 Favored 'General case' 0 N--CA 1.456 -0.146 0 CA-C-O 119.783 -0.151 . . . . 0.0 111.057 -179.737 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 64.6 mtt180 -68.35 -36.81 79.8 Favored 'General case' 0 CA--C 1.526 0.054 0 N-CA-C 109.835 -0.432 . . . . 0.0 109.835 169.124 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 35.4 t . . . . . 0 N--CA 1.457 -0.105 0 C-N-CA 123.958 0.903 . . . . 0.0 113.226 -176.19 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 71.9 Cg_endo . . . . . 0 N--CA 1.451 -1.012 0 N-CA-C 106.435 -2.179 . . . . 0.0 106.435 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 92' ' ' GLY . . . . . 0.442 ' HA2' ' O ' ' A' ' 40' ' ' ILE . . . 105.98 24.98 6.66 Favored Glycine 0 CA--C 1.527 0.81 0 C-N-CA 120.386 -0.911 . . . . 0.0 112.436 -172.902 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 37.9 p -153.94 171.93 18.22 Favored 'General case' 0 CA--C 1.522 -0.121 0 CA-C-N 117.908 0.854 . . . . 0.0 109.951 177.09 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 94' ' ' CYS . . . . . 0.425 ' HB2' HD11 ' A' ' 98' ' ' ILE . 19.6 p -62.24 -22.46 65.99 Favored 'General case' 0 N--CA 1.448 -0.541 0 N-CA-C 109.183 -0.673 . . . . 0.0 109.183 176.381 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -63.16 -58.03 8.59 Favored 'General case' 0 N--CA 1.445 -0.691 0 N-CA-C 109.352 -0.61 . . . . 0.0 109.352 -175.609 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 65.2 t60 -71.51 -33.38 69.16 Favored 'General case' 0 N--CA 1.45 -0.459 0 N-CA-C 110.228 -0.286 . . . . 0.0 110.228 -179.973 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -65.88 -53.95 32.96 Favored 'General case' 0 N--CA 1.448 -0.537 0 CA-C-O 119.831 -0.128 . . . . 0.0 111.104 -176.741 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 98' ' ' ILE . . . . . 0.425 HD11 ' HB2' ' A' ' 94' ' ' CYS . 2.5 mp -70.29 -29.57 39.78 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.336 0 C-N-CA 120.474 -0.49 . . . . 0.0 110.926 -178.375 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 13.4 m-80 -70.45 -38.15 74.44 Favored 'General case' 0 N--CA 1.456 -0.165 0 CA-C-N 118.737 0.698 . . . . 0.0 111.522 176.53 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 89.2 m -67.18 -31.93 72.66 Favored 'General case' 0 CA--C 1.519 -0.221 0 N-CA-C 109.577 -0.527 . . . . 0.0 109.577 179.528 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 83.5 mt -72.22 -42.15 66.05 Favored 'General case' 0 N--CA 1.446 -0.656 0 N-CA-C 109.124 -0.695 . . . . 0.0 109.124 174.874 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -59.38 -14.66 28.0 Favored Glycine 0 CA--C 1.526 0.76 0 CA-C-O 119.155 -0.803 . . . . 0.0 112.849 -177.392 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 21.6 pt-20 -104.28 -2.93 24.91 Favored 'General case' 0 CA--C 1.533 0.289 0 CA-C-N 118.557 1.178 . . . . 0.0 113.502 -177.56 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 34.9 m -143.58 -7.6 0.27 Allowed 'Isoleucine or valine' 0 N--CA 1.466 0.325 0 CA-C-N 118.977 0.808 . . . . 0.0 113.133 176.557 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 105' ' ' ILE . . . . . . . . . . . . . 10.8 tp -64.39 -24.87 36.64 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.169 0 CA-C-N 118.741 0.7 . . . . 0.0 111.018 -176.339 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 23.0 pt20 -69.72 -40.36 76.28 Favored 'General case' 0 N--CA 1.452 -0.33 0 CA-C-O 119.557 -0.258 . . . . 0.0 111.299 -175.591 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 76.4 mm-40 -80.1 -24.97 40.2 Favored 'General case' 0 N--CA 1.453 -0.313 0 CA-C-N 118.401 0.546 . . . . 0.0 110.8 175.958 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 9.1 tt -68.2 -41.62 81.1 Favored 'General case' 0 N--CA 1.452 -0.337 0 N-CA-C 108.908 -0.775 . . . . 0.0 108.908 177.195 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 55.6 mt -68.91 -52.25 31.42 Favored 'General case' 0 N--CA 1.453 -0.298 0 N-CA-C 109.016 -0.735 . . . . 0.0 109.016 174.893 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 34.5 t -42.28 -48.67 5.02 Favored 'General case' 0 C--O 1.234 0.24 0 C-N-CA 123.455 0.702 . . . . 0.0 112.527 175.333 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 35.6 t0 -67.8 -41.25 83.46 Favored 'General case' 0 N--CA 1.455 -0.224 0 N-CA-C 109.937 -0.394 . . . . 0.0 109.937 179.26 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -67.69 -32.94 73.95 Favored 'General case' 0 N--CA 1.446 -0.674 0 C-N-CA 120.848 -0.341 . . . . 0.0 110.794 -176.981 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 113' ' ' ILE . . . . . . . . . . . . . 40.9 mm -70.21 -38.82 75.8 Favored 'Isoleucine or valine' 0 C--N 1.339 0.144 0 CA-C-N 118.474 0.579 . . . . 0.0 109.941 178.766 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -74.27 -47.73 33.09 Favored 'General case' 0 N--CA 1.453 -0.322 0 N-CA-C 111.469 0.174 . . . . 0.0 111.469 179.792 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 115' ' ' LYS . . . . . 0.411 ' HE3' ' HB2' ' A' ' 115' ' ' LYS . 30.4 ttmt -76.98 -30.83 56.14 Favored 'General case' 0 N--CA 1.452 -0.331 0 C-N-CA 124.262 1.025 . . . . 0.0 113.619 -172.492 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 116' ' ' SER . . . . . 0.433 ' HA ' ' HB2' ' A' ' 59' ' ' ASP . 1.5 m -90.05 150.57 22.04 Favored 'General case' 0 CA--C 1.528 0.134 0 CA-C-N 118.177 0.444 . . . . 0.0 111.383 -174.185 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 19.1 t30 -71.21 169.31 15.42 Favored 'General case' 0 C--O 1.225 -0.213 0 C-N-CA 122.802 0.441 . . . . 0.0 110.685 -174.2 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 118' ' ' GLN . . . . . . . . . . . . . 17.1 mt-30 -55.39 -36.23 66.17 Favored 'General case' 0 CA--C 1.528 0.103 0 N-CA-C 111.947 0.351 . . . . 0.0 111.947 -173.616 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -66.59 -34.29 77.56 Favored 'General case' 0 N--CA 1.456 -0.14 0 N-CA-C 109.64 -0.504 . . . . 0.0 109.64 178.331 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 120' ' ' HIS . . . . . 0.411 ' CB ' ' HB3' ' A' ' 116' ' ' SER . 19.4 m170 -75.48 -41.3 55.86 Favored 'General case' 0 N--CA 1.448 -0.549 0 N-CA-C 109.178 -0.675 . . . . 0.0 109.178 179.07 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 49.4 mttm -54.75 -43.6 72.86 Favored 'General case' 0 N--CA 1.456 -0.165 0 N-CA-C 108.824 -0.806 . . . . 0.0 108.824 177.2 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 39.1 tp10 -66.17 -41.81 89.82 Favored 'General case' 0 N--CA 1.454 -0.266 0 CA-C-O 119.62 -0.228 . . . . 0.0 110.633 -179.269 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 88.9 mttt -66.6 -28.64 68.66 Favored 'General case' 0 N--CA 1.452 -0.342 0 C-N-CA 119.721 -0.792 . . . . 0.0 111.112 178.801 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 124' ' ' ILE . . . . . . . . . . . . . 58.1 mt -72.27 -38.22 61.1 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.198 0 CA-C-N 118.52 0.6 . . . . 0.0 109.897 177.906 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 27.9 mmt180 -64.62 -40.37 95.36 Favored 'General case' 0 N--CA 1.455 -0.216 0 O-C-N 121.887 -0.508 . . . . 0.0 110.819 -179.744 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 126' ' ' MET . . . . . . . . . . . . . 28.3 ptm -71.8 -30.69 65.79 Favored 'General case' 0 CA--C 1.528 0.117 0 C-N-CA 120.181 -0.608 . . . . 0.0 110.827 -179.648 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 66.7 mt -64.74 -35.85 82.4 Favored 'General case' 0 N--CA 1.456 -0.128 0 CA-C-N 118.392 0.542 . . . . 0.0 110.103 175.347 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 95.4 mt -69.4 -35.74 76.07 Favored 'General case' 0 CA--C 1.529 0.159 0 CA-C-N 118.193 0.451 . . . . 0.0 110.64 178.12 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 14.9 t0 -63.29 -44.52 94.8 Favored 'General case' 0 N--CA 1.456 -0.172 0 N-CA-C 109.367 -0.605 . . . . 0.0 109.367 176.368 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 65.4 mt -60.93 -34.27 58.95 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.251 0 N-CA-C 109.993 -0.373 . . . . 0.0 109.993 -179.981 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 131' ' ' TRP . . . . . . . . . . . . . 43.4 m0 . . . . . 0 N--CA 1.452 -0.334 0 C-N-CA 120.057 -0.657 . . . . 0.0 112.617 -179.271 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 20.7 p-10 . . . . . 0 N--CA 1.449 -0.488 0 N-CA-C 108.928 -0.767 . . . . 0.0 108.928 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 7' ' ' PHE . . . . . 0.497 ' HB2' ' HZ1' ' A' ' 45' ' ' LYS . 1.5 t80 -49.73 -39.6 37.87 Favored 'General case' 0 N--CA 1.456 -0.145 0 C-N-CA 124.028 0.931 . . . . 0.0 110.089 177.416 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 50.8 tp60 -51.79 -34.63 40.67 Favored 'General case' 0 N--CA 1.455 -0.189 0 C-N-CA 124.061 0.944 . . . . 0.0 111.919 -177.183 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 30.7 m-80 -74.2 -30.7 62.33 Favored 'General case' 0 N--CA 1.451 -0.394 0 N-CA-C 109.916 -0.401 . . . . 0.0 109.916 -179.175 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 10' ' ' PHE . . . . . 0.415 ' CE2' ' HB2' ' A' ' 32' ' ' LEU . 3.2 t80 -71.04 -38.99 72.53 Favored 'General case' 0 N--CA 1.451 -0.414 0 N-CA-C 109.125 -0.695 . . . . 0.0 109.125 176.221 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 65.2 t -64.69 -56.47 15.85 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.307 0 N-CA-C 108.948 -0.76 . . . . 0.0 108.948 178.409 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -59.49 -27.17 65.89 Favored 'General case' 0 N--CA 1.451 -0.393 0 C-N-CA 123.109 0.564 . . . . 0.0 112.247 -179.933 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 81.8 m -73.38 -41.4 63.42 Favored 'General case' 0 N--CA 1.456 -0.162 0 CA-C-N 118.785 0.721 . . . . 0.0 109.262 177.163 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . 0.488 ' HA ' ' CD1' ' A' ' 17' ' ' PHE . 11.8 tp -64.06 -48.0 77.94 Favored 'General case' 0 N--CA 1.452 -0.345 0 CA-C-O 121.357 0.599 . . . . 0.0 109.643 177.728 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 61.7 mm-40 -62.33 -30.48 71.19 Favored 'General case' 0 N--CA 1.452 -0.359 0 C-N-CA 124.209 1.003 . . . . 0.0 109.886 179.303 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 31.4 t -67.84 -31.42 71.24 Favored 'General case' 0 N--CA 1.45 -0.458 0 CA-C-O 119.011 -0.519 . . . . 0.0 110.033 177.476 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 17' ' ' PHE . . . . . 0.488 ' CD1' ' HA ' ' A' ' 14' ' ' LEU . 13.8 m-85 -67.85 -39.91 83.74 Favored 'General case' 0 C--N 1.339 0.132 0 CA-C-N 118.495 0.589 . . . . 0.0 110.439 172.999 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . 0.438 ' HG2' ' CE1' ' A' ' 53' ' ' TYR . 65.8 mttt -64.8 -27.88 69.19 Favored 'General case' 0 C--N 1.338 0.106 0 CA-C-O 120.468 0.175 . . . . 0.0 110.864 -178.008 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 36.3 t0 -75.29 -14.72 60.52 Favored 'General case' 0 CA--C 1.533 0.293 0 C-N-CA 123.634 0.774 . . . . 0.0 112.186 179.865 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 48.7 mt -77.12 168.84 19.39 Favored 'General case' 0 N--CA 1.457 -0.124 0 O-C-N 121.714 -0.616 . . . . 0.0 111.758 -178.992 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 8.3 mtmp? -99.41 -27.19 13.86 Favored 'General case' 0 N--CA 1.455 -0.215 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.049 174.698 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 80.7 p -90.56 -25.33 20.27 Favored 'General case' 0 CA--C 1.529 0.167 0 C-N-CA 122.913 0.485 . . . . 0.0 110.597 176.03 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 77.47 -22.28 2.7 Favored Glycine 0 CA--C 1.529 0.93 0 C-N-CA 123.631 0.634 . . . . 0.0 113.793 176.155 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 66.6 mt -84.72 151.86 3.76 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.215 0 CA-C-N 118.086 0.943 . . . . 0.0 108.912 172.927 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 5.1 t -159.09 79.84 0.76 Allowed 'General case' 0 N--CA 1.453 -0.312 0 CA-C-N 118.46 0.573 . . . . 0.0 110.895 -179.52 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . 0.413 ' O ' ' HE2' ' A' ' 30' ' ' LYS . . . -47.11 -51.22 14.56 Favored Glycine 0 CA--C 1.524 0.606 0 CA-C-O 118.932 -0.927 . . . . 0.0 114.059 -171.954 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 14.6 m -63.98 -49.04 74.04 Favored 'General case' 0 CA--C 1.52 -0.19 0 CA-C-N 119.044 1.422 . . . . 0.0 110.647 -175.511 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 15.2 mtm180 -70.38 -34.04 72.11 Favored 'General case' 0 C--O 1.234 0.26 0 CA-C-O 119.704 -0.189 . . . . 0.0 111.128 -176.737 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 29' ' ' ILE . . . . . 0.4 HG12 ' CG1' ' A' ' 68' ' ' ILE . 54.4 mt -58.73 -45.84 90.89 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.592 0 N-CA-C 108.006 -1.109 . . . . 0.0 108.006 173.133 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . 0.413 ' HE2' ' O ' ' A' ' 26' ' ' GLY . 53.1 mtmt -67.25 -23.6 65.72 Favored 'General case' 0 CA--C 1.529 0.166 0 CA-C-O 118.776 -0.63 . . . . 0.0 111.592 178.579 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . 0.541 ' HE2' ' HA ' ' A' ' 31' ' ' LYS . 8.4 mmpt? -67.85 -58.39 4.66 Favored 'General case' 0 C--N 1.342 0.25 0 CA-C-N 119.218 0.917 . . . . 0.0 110.595 178.047 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . 0.415 ' HB2' ' CE2' ' A' ' 10' ' ' PHE . 1.8 pp -74.94 -17.32 60.58 Favored 'General case' 0 CA--C 1.531 0.247 0 C-N-CA 119.286 -0.966 . . . . 0.0 111.552 -177.329 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 54.2 m -74.44 -38.13 63.1 Favored 'General case' 0 N--CA 1.455 -0.225 0 N-CA-C 109.509 -0.552 . . . . 0.0 109.509 177.211 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 98.4 m -73.15 -38.07 66.37 Favored 'General case' 0 N--CA 1.45 -0.46 0 N-CA-C 110.153 -0.314 . . . . 0.0 110.153 -178.555 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 27.3 t80 -64.23 -37.08 86.21 Favored 'General case' 0 N--CA 1.456 -0.149 0 N-CA-C 109.942 -0.392 . . . . 0.0 109.942 175.997 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -72.03 -38.63 69.51 Favored 'General case' 0 N--CA 1.448 -0.529 0 CA-C-O 119.462 -0.304 . . . . 0.0 111.429 178.081 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 9.9 mt -67.71 -36.1 80.0 Favored 'General case' 0 C--O 1.231 0.1 0 CA-C-N 118.217 0.462 . . . . 0.0 110.796 -179.757 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 42.6 t0 -71.0 -20.03 62.46 Favored 'General case' 0 N--CA 1.453 -0.291 0 C-N-CA 122.451 0.3 . . . . 0.0 111.358 177.199 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 97.9 m-70 -148.69 97.74 2.77 Favored 'General case' 0 C--N 1.339 0.125 0 C-N-CA 122.852 0.461 . . . . 0.0 111.34 -175.036 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 40' ' ' ILE . . . . . 0.563 ' H ' HD13 ' A' ' 40' ' ' ILE . 0.0 OUTLIER -76.02 -12.29 14.42 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.454 0 C-N-CA 123.205 0.602 . . . . 0.0 110.866 176.551 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 19.7 m-20 -58.56 -21.11 51.73 Favored 'General case' 0 C--N 1.339 0.111 0 C-N-CA 122.925 0.49 . . . . 0.0 112.295 -176.793 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -104.1 12.93 7.61 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.208 0 C-N-CA 123.104 0.562 . . . . 0.0 112.211 178.353 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 2.9 pp20? -50.37 -33.32 20.09 Favored 'General case' 0 CA--C 1.53 0.21 0 CA-C-N 118.587 0.631 . . . . 0.0 111.766 -179.764 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 39.5 t -62.05 -49.93 74.01 Favored 'General case' 0 C--O 1.233 0.184 0 N-CA-C 111.912 0.338 . . . . 0.0 111.912 -178.047 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . 0.497 ' HZ1' ' HB2' ' A' ' 7' ' ' PHE . 18.8 ptpt -70.98 -28.18 64.26 Favored 'General case' 0 C--N 1.339 0.128 0 O-C-N 121.85 -0.531 . . . . 0.0 109.778 -179.531 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 46' ' ' ILE . . . . . 0.412 HG12 ' CZ ' ' A' ' 10' ' ' PHE . 88.1 mt -68.7 -45.03 81.92 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.205 0 N-CA-C 110.049 -0.352 . . . . 0.0 110.049 -178.559 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 30.5 mm -62.72 -36.58 75.97 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.257 0 N-CA-C 109.024 -0.732 . . . . 0.0 109.024 177.309 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 39.4 t -64.63 -31.74 73.1 Favored 'General case' 0 CA--C 1.531 0.224 0 C-N-CA 120.984 -0.286 . . . . 0.0 111.729 179.023 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 6.7 mp -80.04 -31.97 39.5 Favored 'General case' 0 N--CA 1.451 -0.409 0 N-CA-C 113.265 0.839 . . . . 0.0 113.265 -179.698 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 12.5 pt -72.32 -38.46 61.45 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.207 0 CA-C-N 119.874 1.215 . . . . 0.0 110.708 177.558 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 24.4 pt -68.62 -35.22 69.13 Favored 'Isoleucine or valine' 0 CA--C 1.528 0.115 0 C-N-CA 120.336 -0.545 . . . . 0.0 110.032 176.981 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 21.0 t70 -59.3 -53.25 60.39 Favored 'General case' 0 C--N 1.339 0.134 0 CA-C-N 118.417 0.553 . . . . 0.0 110.053 174.858 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 53' ' ' TYR . . . . . 0.438 ' CE1' ' HG2' ' A' ' 18' ' ' LYS . 8.5 t80 -61.63 -44.53 96.81 Favored 'General case' 0 N--CA 1.451 -0.422 0 N-CA-C 109.836 -0.431 . . . . 0.0 109.836 -177.323 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 15.5 m -71.14 -23.03 62.0 Favored 'General case' 0 N--CA 1.453 -0.305 0 N-CA-C 112.196 0.443 . . . . 0.0 112.196 -175.264 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 18.4 tpp180 -84.11 -38.33 20.88 Favored 'General case' 0 N--CA 1.455 -0.216 0 CA-C-N 118.219 0.463 . . . . 0.0 110.642 179.359 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 95.9 mt -85.01 -50.01 7.82 Favored 'General case' 0 N--CA 1.452 -0.333 0 N-CA-C 113.188 0.81 . . . . 0.0 113.188 -175.884 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 5.8 p -66.33 153.87 91.71 Favored Pre-proline 0 CA--C 1.534 0.358 0 N-CA-C 113.647 0.981 . . . . 0.0 113.647 -170.39 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 67.8 Cg_endo -76.87 -170.72 0.96 Allowed 'Trans proline' 0 N--CA 1.455 -0.741 0 C-N-CA 124.837 3.691 . . . . 0.0 111.474 178.866 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 23.6 p-10 -53.82 -60.0 3.89 Favored 'General case' 0 CA--C 1.53 0.189 0 N-CA-C 114.55 1.315 . . . . 0.0 114.55 -170.732 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 22.6 t -67.64 -32.48 73.21 Favored 'General case' 0 N--CA 1.456 -0.134 0 CA-C-N 118.038 0.381 . . . . 0.0 110.947 -173.679 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 39.4 m80 -72.46 -26.55 61.86 Favored 'General case' 0 N--CA 1.453 -0.279 0 N-CA-C 110.035 -0.357 . . . . 0.0 110.035 177.131 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 17.1 ttmt -75.59 -28.52 58.96 Favored 'General case' 0 N--CA 1.451 -0.391 0 N-CA-C 110.113 -0.328 . . . . 0.0 110.113 177.041 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -65.05 -44.36 89.3 Favored 'General case' 0 N--CA 1.454 -0.227 0 N-CA-C 107.479 -1.304 . . . . 0.0 107.479 172.312 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -68.93 -25.3 75.42 Favored Glycine 0 C--N 1.34 0.758 0 N-CA-C 111.398 -0.681 . . . . 0.0 111.398 178.532 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 22.8 t -72.97 -40.32 65.42 Favored 'General case' 0 N--CA 1.452 -0.352 0 CA-C-N 117.782 0.791 . . . . 0.0 109.977 175.843 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 60.0 mt -68.57 -27.39 66.03 Favored 'General case' 0 N--CA 1.452 -0.342 0 N-CA-C 109.813 -0.44 . . . . 0.0 109.813 177.892 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 3.0 m-30 -66.01 -41.39 91.05 Favored 'General case' 0 CA--C 1.518 -0.269 0 N-CA-C 109.918 -0.401 . . . . 0.0 109.918 171.839 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 68' ' ' ILE . . . . . 0.4 ' CG1' HG12 ' A' ' 29' ' ' ILE . 21.0 mt -67.24 -45.32 86.49 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.585 0 N-CA-C 109.261 -0.644 . . . . 0.0 109.261 178.539 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 86.9 mt -58.87 -36.01 59.2 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.321 0 C-N-CA 123.273 0.629 . . . . 0.0 111.62 178.595 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 28.2 t70 -72.58 -40.82 66.29 Favored 'General case' 0 CA--C 1.517 -0.302 0 CA-C-N 119.015 0.825 . . . . 0.0 109.309 174.007 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 42.3 m -59.58 -66.63 0.48 Allowed 'General case' 0 N--CA 1.448 -0.547 0 N-CA-C 108.926 -0.768 . . . . 0.0 108.926 -178.36 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -73.98 -44.4 50.86 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.363 0 CA-C-N 117.845 0.293 . . . . 0.0 111.014 -176.372 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -72.22 -49.8 19.55 Favored Glycine 0 CA--C 1.521 0.446 0 N-CA-C 112.418 -0.273 . . . . 0.0 112.418 -171.207 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 7.8 tmm_? -79.38 -30.26 42.46 Favored 'General case' 0 N--CA 1.445 -0.711 0 C-N-CA 119.814 -0.754 . . . . 0.0 110.256 -176.95 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -70.36 -25.54 63.32 Favored 'General case' 0 C--N 1.342 0.268 0 C-N-CA 118.646 -1.222 . . . . 0.0 109.795 173.458 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 1.4 m-30 -64.84 -49.3 71.15 Favored 'General case' 0 CA--C 1.515 -0.373 0 CA-C-N 118.75 0.704 . . . . 0.0 109.811 175.023 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 2.2 tm? -66.2 -43.95 85.33 Favored 'General case' 0 N--CA 1.447 -0.587 0 C-N-CA 118.219 -1.393 . . . . 0.0 108.711 -178.892 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 88.2 m-20 -59.3 -46.27 89.02 Favored 'General case' 0 CA--C 1.529 0.171 0 N-CA-C 112.318 0.488 . . . . 0.0 112.318 178.895 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 15.1 tm-20 -67.44 -48.89 65.91 Favored 'General case' 0 N--CA 1.45 -0.428 0 CA-C-N 118.34 0.518 . . . . 0.0 112.034 -178.081 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 64.4 p -64.57 -26.98 68.65 Favored 'General case' 0 N--CA 1.456 -0.147 0 CA-C-N 117.709 0.232 . . . . 0.0 111.312 179.965 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 11.9 ttm105 -75.5 -30.73 59.94 Favored 'General case' 0 N--CA 1.451 -0.392 0 CA-C-N 117.757 0.253 . . . . 0.0 110.341 175.383 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 35.3 t . . . . . 0 N--CA 1.455 -0.207 0 N-CA-C 112.408 0.521 . . . . 0.0 112.408 179.702 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 73.5 Cg_endo . . . . . 0 N--CA 1.455 -0.775 0 N-CA-C 110.237 -0.716 . . . . 0.0 110.237 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 89.7 19.48 47.98 Favored Glycine 0 CA--C 1.527 0.79 0 CA-C-O 119.362 -0.688 . . . . 0.0 112.242 179.925 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 20.3 p -153.16 168.87 24.49 Favored 'General case' 0 CA--C 1.521 -0.162 0 CA-C-N 117.89 0.845 . . . . 0.0 110.75 178.052 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 94' ' ' CYS . . . . . . . . . . . . . 29.5 p -57.94 -23.67 54.56 Favored 'General case' 0 N--CA 1.449 -0.515 0 CA-C-N 115.698 -0.683 . . . . 0.0 110.176 174.402 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -58.95 -57.85 11.23 Favored 'General case' 0 N--CA 1.451 -0.42 0 N-CA-C 109.361 -0.607 . . . . 0.0 109.361 -177.339 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 62.2 t60 -75.74 -32.01 59.81 Favored 'General case' 0 N--CA 1.451 -0.376 0 C-N-CA 121.094 -0.242 . . . . 0.0 111.639 -179.506 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -65.36 -48.88 71.42 Favored 'General case' 0 N--CA 1.45 -0.457 0 O-C-N 122.959 0.162 . . . . 0.0 111.053 -178.895 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 1.8 mp -74.44 -27.71 21.63 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.162 0 CA-C-O 119.507 -0.282 . . . . 0.0 110.583 -179.886 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 3.9 m120 -64.23 -48.9 74.05 Favored 'General case' 0 N--CA 1.452 -0.339 0 CA-C-N 118.605 0.639 . . . . 0.0 110.163 173.902 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 26.4 m -74.64 -27.52 60.48 Favored 'General case' 0 N--CA 1.456 -0.164 0 N-CA-C 110.553 -0.166 . . . . 0.0 110.553 -175.947 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 57.0 tp -75.46 -47.97 24.79 Favored 'General case' 0 N--CA 1.448 -0.534 0 N-CA-C 110.272 -0.27 . . . . 0.0 110.272 177.027 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -65.81 -14.48 60.84 Favored Glycine 0 CA--C 1.528 0.846 0 CA-C-O 119.521 -0.6 . . . . 0.0 113.063 -173.33 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 24.2 pt-20 -95.98 -7.51 36.25 Favored 'General case' 0 CA--C 1.531 0.229 0 CA-C-N 118.297 1.049 . . . . 0.0 112.5 -178.482 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 27.3 m -129.97 -14.3 2.12 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.147 0 CA-C-N 118.542 0.61 . . . . 0.0 112.264 176.911 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 105' ' ' ILE . . . . . . . . . . . . . 9.7 tp -61.24 -22.62 27.86 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.137 0 CA-C-N 118.473 0.579 . . . . 0.0 110.7 -179.938 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 22.9 pt20 -64.79 -33.06 75.08 Favored 'General case' 0 N--CA 1.452 -0.359 0 C-N-CA 122.912 0.485 . . . . 0.0 110.445 177.145 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 82.9 mt-10 -75.61 -36.04 60.37 Favored 'General case' 0 N--CA 1.455 -0.218 0 CA-C-O 120.769 0.319 . . . . 0.0 110.171 177.991 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 50.2 mt -75.37 -37.42 60.61 Favored 'General case' 0 N--CA 1.448 -0.549 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.925 -177.359 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 67.0 mt -69.55 -57.13 5.59 Favored 'General case' 0 N--CA 1.452 -0.361 0 N-CA-C 109.909 -0.404 . . . . 0.0 109.909 177.377 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 6.4 p -46.07 -53.35 10.39 Favored 'General case' 0 CA--C 1.522 -0.121 0 C-N-CA 122.606 0.362 . . . . 0.0 111.434 179.294 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 34.4 t0 -61.66 -43.74 98.29 Favored 'General case' 0 N--CA 1.443 -0.784 0 N-CA-C 109.987 -0.375 . . . . 0.0 109.987 -179.954 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -65.6 -32.92 74.76 Favored 'General case' 0 N--CA 1.446 -0.636 0 C-N-CA 120.038 -0.665 . . . . 0.0 110.895 -176.984 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 113' ' ' ILE . . . . . . . . . . . . . 27.8 mm -68.28 -41.55 83.83 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.115 0 CA-C-N 118.984 0.811 . . . . 0.0 109.944 179.931 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -75.95 -39.39 56.15 Favored 'General case' 0 N--CA 1.454 -0.268 0 N-CA-C 112.033 0.383 . . . . 0.0 112.033 -179.711 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 1.3 tppp? -77.13 -33.03 56.8 Favored 'General case' 0 N--CA 1.449 -0.477 0 C-N-CA 123.966 0.906 . . . . 0.0 113.148 -175.086 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 116' ' ' SER . . . . . 0.466 ' HB2' ' CB ' ' A' ' 120' ' ' HIS . 51.7 p -84.89 160.68 20.1 Favored 'General case' 0 CA--C 1.53 0.2 0 N-CA-C 111.952 0.353 . . . . 0.0 111.952 -174.082 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 48.9 t30 -80.03 167.71 20.09 Favored 'General case' 0 CA--C 1.534 0.349 0 C-N-CA 122.901 0.48 . . . . 0.0 110.445 -179.618 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 118' ' ' GLN . . . . . . . . . . . . . 24.6 mm100 -52.64 -42.83 65.01 Favored 'General case' 0 CA--C 1.529 0.144 0 N-CA-C 112.954 0.724 . . . . 0.0 112.954 -173.047 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 11.1 p-10 -66.39 -35.71 81.01 Favored 'General case' 0 N--CA 1.456 -0.165 0 N-CA-C 110.223 -0.288 . . . . 0.0 110.223 179.296 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 120' ' ' HIS . . . . . 0.466 ' CB ' ' HB2' ' A' ' 116' ' ' SER . 25.6 m170 -68.98 -41.65 77.6 Favored 'General case' 0 N--CA 1.451 -0.423 0 CA-C-N 116.416 -0.357 . . . . 0.0 110.092 177.351 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 45.9 mttm -58.57 -39.24 79.74 Favored 'General case' 0 C--N 1.34 0.184 0 N-CA-C 109.371 -0.603 . . . . 0.0 109.371 178.813 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 1.8 tm-20 -65.51 -46.0 81.34 Favored 'General case' 0 N--CA 1.452 -0.331 0 C-N-CA 122.885 0.474 . . . . 0.0 110.756 -179.115 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 62.8 mttp -66.3 -31.45 72.25 Favored 'General case' 0 N--CA 1.455 -0.215 0 CA-C-N 117.741 0.246 . . . . 0.0 111.31 -179.782 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 124' ' ' ILE . . . . . . . . . . . . . 61.7 mt -74.59 -32.94 30.77 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.239 0 O-C-N 121.952 -0.468 . . . . 0.0 109.9 176.473 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -71.7 -36.86 70.68 Favored 'General case' 0 N--CA 1.455 -0.209 0 CA-C-O 119.163 -0.446 . . . . 0.0 111.492 179.032 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 126' ' ' MET . . . . . . . . . . . . . 28.2 ptm -68.14 -32.68 73.12 Favored 'General case' 0 CA--C 1.53 0.184 0 C-N-CA 119.148 -1.021 . . . . 0.0 109.243 174.648 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 4.0 mp -65.24 -32.73 74.55 Favored 'General case' 0 C--N 1.342 0.247 0 CA-C-O 119.474 -0.298 . . . . 0.0 110.321 171.926 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 44.2 tp -68.24 -43.09 78.68 Favored 'General case' 0 N--CA 1.455 -0.208 0 CA-C-N 118.165 0.439 . . . . 0.0 109.83 179.098 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 35.6 m-20 -60.06 -41.54 92.57 Favored 'General case' 0 N--CA 1.455 -0.208 0 N-CA-C 109.889 -0.411 . . . . 0.0 109.889 176.511 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 65.0 mt -63.26 -36.7 77.12 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.273 0 N-CA-C 109.989 -0.374 . . . . 0.0 109.989 179.116 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 131' ' ' TRP . . . . . . . . . . . . . 42.2 m0 . . . . . 0 N--CA 1.451 -0.406 0 N-CA-C 112.589 0.589 . . . . 0.0 112.589 -179.382 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 3.8 p30 . . . . . 0 N--CA 1.447 -0.607 0 N-CA-C 107.13 -1.433 . . . . 0.0 107.13 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 7' ' ' PHE . . . . . 0.657 ' HB2' ' HZ2' ' A' ' 45' ' ' LYS . 1.3 t80 -62.55 -34.21 76.49 Favored 'General case' 0 N--CA 1.45 -0.475 0 C-N-CA 124.482 1.113 . . . . 0.0 108.998 172.657 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 51.5 tp60 -49.64 -36.37 24.33 Favored 'General case' 0 N--CA 1.453 -0.281 0 C-N-CA 124.953 1.301 . . . . 0.0 112.167 -177.481 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 22.9 m-80 -71.8 -34.48 69.41 Favored 'General case' 0 N--CA 1.454 -0.264 0 CA-C-O 120.801 0.334 . . . . 0.0 110.176 -179.524 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 10' ' ' PHE . . . . . 0.438 ' CZ ' HG12 ' A' ' 46' ' ' ILE . 1.6 t80 -70.98 -39.57 72.43 Favored 'General case' 0 N--CA 1.45 -0.45 0 C-N-CA 123.787 0.835 . . . . 0.0 109.107 177.451 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 95.2 t -66.42 -52.21 49.3 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.353 0 N-CA-C 109.164 -0.68 . . . . 0.0 109.164 178.666 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -59.12 -31.16 68.68 Favored 'General case' 0 N--CA 1.451 -0.389 0 C-N-CA 122.428 0.291 . . . . 0.0 111.486 -178.86 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 78.6 m -69.88 -37.45 76.05 Favored 'General case' 0 CA--C 1.531 0.214 0 N-CA-C 108.753 -0.832 . . . . 0.0 108.753 176.061 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . 0.476 ' HA ' ' CD1' ' A' ' 17' ' ' PHE . 6.2 tp -66.73 -41.43 87.89 Favored 'General case' 0 N--CA 1.455 -0.203 0 CA-C-O 121.485 0.66 . . . . 0.0 110.488 178.742 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . 0.419 ' CD ' ' HZ2' ' A' ' 18' ' ' LYS . 63.3 mm-40 -64.82 -27.79 69.12 Favored 'General case' 0 N--CA 1.451 -0.417 0 C-N-CA 123.698 0.799 . . . . 0.0 109.08 178.027 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 5.3 p -71.75 -29.3 64.35 Favored 'General case' 0 N--CA 1.452 -0.346 0 N-CA-C 109.966 -0.383 . . . . 0.0 109.966 177.596 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 17' ' ' PHE . . . . . 0.476 ' CD1' ' HA ' ' A' ' 14' ' ' LEU . 24.3 m-85 -68.85 -34.32 75.27 Favored 'General case' 0 N--CA 1.457 -0.124 0 C-N-CA 119.718 -0.793 . . . . 0.0 110.395 171.536 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . 0.433 ' HA ' ' CE1' ' A' ' 61' ' ' HIS . 55.1 mttt -65.76 -26.3 67.66 Favored 'General case' 0 C--N 1.338 0.103 0 C-N-CA 120.395 -0.522 . . . . 0.0 110.153 176.112 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 40.3 t0 -73.48 -43.73 59.54 Favored 'General case' 0 CA--C 1.532 0.26 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.637 177.137 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 87.6 mt -65.12 146.66 54.69 Favored 'General case' 0 N--CA 1.456 -0.148 0 O-C-N 121.862 -0.524 . . . . 0.0 110.001 179.546 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -81.54 -32.5 32.25 Favored 'General case' 0 C--N 1.334 -0.076 0 N-CA-C 109.737 -0.468 . . . . 0.0 109.737 -179.916 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 22' ' ' SER . . . . . 0.433 ' C ' ' H ' ' A' ' 24' ' ' ILE . 14.1 m -79.22 -21.55 46.1 Favored 'General case' 0 N--CA 1.453 -0.289 0 C-N-CA 123.166 0.586 . . . . 0.0 110.738 175.487 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 72.74 -26.93 0.75 Allowed Glycine 0 CA--C 1.527 0.826 0 C-N-CA 124.578 1.085 . . . . 0.0 112.328 -178.792 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . 0.433 ' H ' ' C ' ' A' ' 22' ' ' SER . 74.3 mt -81.61 147.37 6.23 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.441 0 C-N-CA 123.396 0.678 . . . . 0.0 110.413 178.916 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 37.8 t -165.67 97.4 0.66 Allowed 'General case' 0 CA--C 1.517 -0.305 0 N-CA-C 108.42 -0.956 . . . . 0.0 108.42 173.606 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . 0.434 ' O ' ' HE2' ' A' ' 30' ' ' LYS . . . -55.84 -36.83 67.35 Favored Glycine 0 CA--C 1.527 0.796 0 N-CA-C 110.313 -1.115 . . . . 0.0 110.313 -176.497 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 88.5 p -62.27 -51.76 66.41 Favored 'General case' 0 N--CA 1.454 -0.274 0 CA-C-N 117.502 0.651 . . . . 0.0 110.123 -177.817 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 83.7 mtt180 -70.86 -40.97 72.0 Favored 'General case' 0 N--CA 1.455 -0.188 0 C-N-CA 123.626 0.77 . . . . 0.0 110.737 -178.71 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 64.0 mt -56.43 -42.01 73.74 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.707 0 N-CA-C 109.101 -0.703 . . . . 0.0 109.101 174.861 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . 0.434 ' HE2' ' O ' ' A' ' 26' ' ' GLY . 48.8 mtmt -67.81 -26.88 66.29 Favored 'General case' 0 C--N 1.34 0.194 0 CA-C-O 118.79 -0.624 . . . . 0.0 111.385 177.554 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . 0.438 ' HA ' ' HE3' ' A' ' 31' ' ' LYS . 0.0 OUTLIER -63.93 -56.56 14.32 Favored 'General case' 0 C--N 1.339 0.112 0 CA-C-N 119.187 0.903 . . . . 0.0 110.146 176.568 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 3.3 pp -75.21 -20.63 59.17 Favored 'General case' 0 CA--C 1.531 0.222 0 C-N-CA 119.662 -0.815 . . . . 0.0 111.419 -177.532 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 31.3 m -69.8 -41.68 74.71 Favored 'General case' 0 C--O 1.231 0.107 0 N-CA-C 108.28 -1.007 . . . . 0.0 108.28 175.96 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 97.5 m -68.44 -41.82 79.75 Favored 'General case' 0 N--CA 1.45 -0.46 0 N-CA-C 109.876 -0.416 . . . . 0.0 109.876 -178.751 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 52.7 t80 -62.89 -32.12 73.32 Favored 'General case' 0 C--N 1.337 0.046 0 N-CA-C 109.972 -0.381 . . . . 0.0 109.972 177.475 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -72.97 -28.72 62.57 Favored 'General case' 0 N--CA 1.447 -0.62 0 CA-C-O 119.491 -0.29 . . . . 0.0 111.061 178.999 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 2.2 mm? -79.78 -33.93 40.14 Favored 'General case' 0 CA--C 1.519 -0.224 0 N-CA-C 109.009 -0.737 . . . . 0.0 109.009 -178.371 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 81.2 m-20 -66.32 -17.25 64.65 Favored 'General case' 0 N--CA 1.443 -0.818 0 C-N-CA 123.892 0.877 . . . . 0.0 111.188 173.966 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 96.5 m-70 -152.52 90.78 1.52 Allowed 'General case' 0 N--CA 1.453 -0.286 0 C-N-CA 123.904 0.882 . . . . 0.0 110.681 -176.87 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 40' ' ' ILE . . . . . 0.497 HD11 ' H ' ' A' ' 40' ' ' ILE . 0.0 OUTLIER -71.23 -18.39 20.4 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.29 0 CA-C-N 119.235 0.925 . . . . 0.0 108.526 172.374 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 7.7 m-20 -44.84 -41.78 7.36 Favored 'General case' 0 N--CA 1.455 -0.212 0 C-N-CA 125.817 1.647 . . . . 0.0 112.806 -179.525 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 1.4 pp -101.07 16.73 4.14 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.57 0 C-N-CA 124.151 0.98 . . . . 0.0 111.742 -173.283 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 3.0 pp20? -52.97 -32.96 48.95 Favored 'General case' 0 CA--C 1.529 0.14 0 O-C-N 122.076 -0.39 . . . . 0.0 111.205 176.759 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 47.8 t -59.71 -46.14 90.0 Favored 'General case' 0 CA--C 1.53 0.211 0 O-C-N 122.273 -0.267 . . . . 0.0 111.654 -177.326 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . 0.657 ' HZ2' ' HB2' ' A' ' 7' ' ' PHE . 18.4 ptpt -75.09 -23.03 57.91 Favored 'General case' 0 C--N 1.341 0.223 0 C-N-CA 121.006 -0.278 . . . . 0.0 110.547 179.434 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 46' ' ' ILE . . . . . 0.438 HG12 ' CZ ' ' A' ' 10' ' ' PHE . 77.0 mt -73.88 -50.13 30.67 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.253 0 N-CA-C 110.18 -0.304 . . . . 0.0 110.18 -179.92 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 46.0 mm -67.32 -37.25 78.69 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.431 0 O-C-N 123.357 0.41 . . . . 0.0 110.364 -177.302 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 22.6 t -67.5 -39.7 85.19 Favored 'General case' 0 N--CA 1.452 -0.346 0 C-N-CA 119.351 -0.94 . . . . 0.0 109.818 176.939 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 53.4 tp -69.33 -35.48 75.98 Favored 'General case' 0 N--CA 1.449 -0.507 0 CA-C-O 119.162 -0.447 . . . . 0.0 111.832 -174.444 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 3.9 pt -72.07 -44.68 65.36 Favored 'Isoleucine or valine' 0 C--N 1.34 0.163 0 CA-C-N 118.834 0.743 . . . . 0.0 110.855 178.032 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 30.9 pt -66.16 -39.06 83.35 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.141 0 C-N-CA 119.559 -0.856 . . . . 0.0 111.064 179.628 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 88.9 m-20 -64.86 -45.21 87.01 Favored 'General case' 0 N--CA 1.452 -0.338 0 CA-C-N 117.958 0.344 . . . . 0.0 110.749 178.959 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 3.2 t80 -65.04 -34.79 79.27 Favored 'General case' 0 N--CA 1.456 -0.16 0 N-CA-C 109.326 -0.62 . . . . 0.0 109.326 175.867 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 28.7 t -62.37 -34.72 77.24 Favored 'General case' 0 N--CA 1.454 -0.261 0 CA-C-N 117.878 0.308 . . . . 0.0 111.082 -178.692 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . 0.415 ' HA ' ' NE ' ' A' ' 55' ' ' ARG . 11.8 mmp_? -75.42 -46.41 32.94 Favored 'General case' 0 C--N 1.34 0.183 0 CA-C-N 118.489 0.586 . . . . 0.0 111.525 177.709 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 30.5 mt -75.23 -41.25 57.98 Favored 'General case' 0 C--O 1.227 -0.085 0 N-CA-C 112.92 0.711 . . . . 0.0 112.92 -173.253 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 13.2 p -63.66 155.53 75.93 Favored Pre-proline 0 CA--C 1.535 0.391 0 N-CA-C 112.607 0.595 . . . . 0.0 112.607 -174.857 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 87.2 Cg_endo -74.57 173.04 15.0 Favored 'Trans proline' 0 N--CA 1.453 -0.876 0 C-N-CA 124.746 3.631 . . . . 0.0 111.668 -179.433 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -46.57 -52.8 12.71 Favored 'General case' 0 N--CA 1.452 -0.328 0 C-N-CA 125.407 1.483 . . . . 0.0 113.952 -170.744 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 95.1 p -68.14 -31.86 71.74 Favored 'General case' 0 N--CA 1.457 -0.089 0 O-C-N 121.915 -0.491 . . . . 0.0 110.111 -177.154 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 61' ' ' HIS . . . . . 0.433 ' CE1' ' HA ' ' A' ' 18' ' ' LYS . 37.0 m170 -75.34 -24.93 57.43 Favored 'General case' 0 N--CA 1.45 -0.431 0 N-CA-C 109.923 -0.399 . . . . 0.0 109.923 179.395 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 67.7 mttm -67.05 -40.4 87.14 Favored 'General case' 0 C--N 1.34 0.184 0 N-CA-C 109.246 -0.65 . . . . 0.0 109.246 173.292 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -60.79 -40.8 93.97 Favored 'General case' 0 CA--C 1.533 0.29 0 N-CA-C 108.458 -0.941 . . . . 0.0 108.458 175.548 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -67.62 -30.58 74.94 Favored Glycine 0 CA--C 1.528 0.876 0 N-CA-C 111.727 -0.549 . . . . 0.0 111.727 178.442 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 35.6 p -66.94 -35.12 79.27 Favored 'General case' 0 N--CA 1.456 -0.153 0 CA-C-N 117.805 0.803 . . . . 0.0 109.637 178.217 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 43.0 mt -73.94 -30.51 62.59 Favored 'General case' 0 N--CA 1.453 -0.277 0 C-N-CA 122.346 0.258 . . . . 0.0 110.579 177.424 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 2.6 m-85 -68.93 -36.44 77.97 Favored 'General case' 0 CA--C 1.518 -0.265 0 CA-C-N 117.75 0.25 . . . . 0.0 110.776 176.577 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 68' ' ' ILE . . . . . . . . . . . . . 16.3 mt -69.51 -51.52 41.15 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.484 0 C-N-CA 119.631 -0.827 . . . . 0.0 108.776 178.536 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 77.2 mt -48.47 -37.45 7.98 Favored 'Isoleucine or valine' 0 C--N 1.341 0.224 0 O-C-N 123.574 0.546 . . . . 0.0 111.161 172.355 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 19.9 t70 -70.9 -48.16 55.23 Favored 'General case' 0 C--O 1.233 0.202 0 CA-C-N 118.863 0.756 . . . . 0.0 111.096 179.418 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 30.8 t -65.11 -51.45 61.25 Favored 'General case' 0 N--CA 1.451 -0.404 0 C-N-CA 122.447 0.299 . . . . 0.0 111.251 -176.4 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 72' ' ' ILE . . . . . 0.422 HD13 ' CZ ' ' A' ' 76' ' ' TYR . 0.0 OUTLIER -75.82 -32.62 24.25 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.234 0 N-CA-C 109.89 -0.411 . . . . 0.0 109.89 -178.557 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -69.19 -46.49 57.56 Favored Glycine 0 CA--C 1.523 0.558 0 N-CA-C 111.419 -0.672 . . . . 0.0 111.419 -176.531 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 37.5 mtm105 -69.47 -42.01 75.41 Favored 'General case' 0 CA--C 1.515 -0.395 0 CA-C-N 117.694 0.747 . . . . 0.0 110.09 177.641 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -62.83 -31.32 72.31 Favored 'General case' 0 N--CA 1.448 -0.528 0 C-N-CA 119.996 -0.682 . . . . 0.0 110.306 -179.194 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 76' ' ' TYR . . . . . 0.422 ' CZ ' HD13 ' A' ' 72' ' ' ILE . 2.3 m-30 -72.29 -56.38 5.6 Favored 'General case' 0 CA--C 1.518 -0.281 0 CA-C-N 118.149 0.431 . . . . 0.0 111.065 175.428 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 53.8 tp -63.87 -40.88 97.58 Favored 'General case' 0 N--CA 1.447 -0.577 0 C-N-CA 117.885 -1.526 . . . . 0.0 109.948 -175.265 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 95.8 m-20 -60.69 -50.97 71.35 Favored 'General case' 0 N--CA 1.454 -0.24 0 CA-C-O 118.693 -0.67 . . . . 0.0 112.389 -179.843 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 68.0 mm-40 -72.52 -35.73 68.16 Favored 'General case' 0 N--CA 1.455 -0.196 0 CA-C-N 119.385 0.993 . . . . 0.0 112.078 -177.357 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 80.5 p -72.11 -30.63 65.26 Favored 'General case' 0 N--CA 1.451 -0.404 0 C-N-CA 120.18 -0.608 . . . . 0.0 110.579 179.493 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 7.4 ttm105 -82.71 -29.6 29.74 Favored 'General case' 0 CA--C 1.531 0.224 0 C-N-CA 123.649 0.78 . . . . 0.0 112.159 177.76 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 44.2 m . . . . . 0 CA--C 1.528 0.111 0 N-CA-C 112.645 0.609 . . . . 0.0 112.645 -179.102 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 82.1 Cg_endo . . . . . 0 N--CA 1.454 -0.809 0 N-CA-C 110.522 -0.607 . . . . 0.0 110.522 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 83.59 20.63 59.66 Favored Glycine 0 CA--C 1.526 0.773 0 CA-C-O 119.775 -0.458 . . . . 0.0 112.448 177.442 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -158.28 167.16 30.51 Favored 'General case' 0 N--CA 1.451 -0.392 0 C-N-CA 124.281 1.033 . . . . 0.0 109.528 179.94 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 94' ' ' CYS . . . . . . . . . . . . . 2.0 t -52.37 -28.06 18.07 Favored 'General case' 0 N--CA 1.454 -0.241 0 C-N-CA 123.82 0.848 . . . . 0.0 110.816 175.176 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -52.94 -62.57 1.57 Allowed 'General case' 0 N--CA 1.448 -0.548 0 O-C-N 122.497 -0.127 . . . . 0.0 111.086 -178.239 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 76.4 t60 -73.56 -32.98 64.45 Favored 'General case' 0 N--CA 1.453 -0.323 0 O-C-N 122.27 -0.269 . . . . 0.0 110.954 -178.308 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -64.04 -53.58 47.66 Favored 'General case' 0 N--CA 1.451 -0.397 0 O-C-N 122.934 0.147 . . . . 0.0 111.183 -177.252 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 1.7 mp -69.88 -34.55 60.77 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.166 0 N-CA-C 109.83 -0.433 . . . . 0.0 109.83 -179.81 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 59.6 m-20 -62.07 -42.39 99.15 Favored 'General case' 0 N--CA 1.456 -0.168 0 O-C-N 122.163 -0.336 . . . . 0.0 110.6 178.102 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 98.0 m -64.23 -41.28 97.08 Favored 'General case' 0 N--CA 1.454 -0.249 0 N-CA-C 109.9 -0.407 . . . . 0.0 109.9 -178.653 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 90.8 mt -68.98 -24.1 64.2 Favored 'General case' 0 N--CA 1.452 -0.329 0 CA-C-N 116.426 -0.352 . . . . 0.0 111.389 179.882 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -73.73 -25.59 71.63 Favored Glycine 0 CA--C 1.527 0.833 0 CA-C-O 119.551 -0.583 . . . . 0.0 113.518 -178.212 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 74.1 mm-40 -81.08 -45.55 16.32 Favored 'General case' 0 N--CA 1.453 -0.294 0 CA-C-N 118.3 1.05 . . . . 0.0 111.996 179.35 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 18.1 m -85.26 6.69 2.19 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.14 0 C-N-CA 123.641 0.777 . . . . 0.0 111.097 -175.79 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 105' ' ' ILE . . . . . . . . . . . . . 9.7 tp -62.0 -37.0 77.25 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.354 0 C-N-CA 122.125 0.17 . . . . 0.0 110.795 -174.464 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 16.5 pt20 -76.05 -35.67 59.35 Favored 'General case' 0 N--CA 1.451 -0.404 0 CA-C-O 119.14 -0.457 . . . . 0.0 111.153 -177.231 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 59.3 mp0 -74.7 -39.36 61.99 Favored 'General case' 0 N--CA 1.451 -0.382 0 CA-C-N 118.814 0.734 . . . . 0.0 110.449 -179.684 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 7.6 tt -73.5 -41.38 63.17 Favored 'General case' 0 N--CA 1.45 -0.475 0 CA-C-O 119.672 -0.204 . . . . 0.0 111.326 -174.774 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 9.6 mp -73.43 -49.9 24.53 Favored 'General case' 0 C--O 1.225 -0.203 0 C-N-CA 120.534 -0.466 . . . . 0.0 110.012 179.148 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 23.3 t -55.32 -39.47 70.0 Favored 'General case' 0 N--CA 1.454 -0.231 0 CA-C-N 118.334 0.515 . . . . 0.0 111.109 -177.452 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 36.9 t0 -62.4 -49.33 75.94 Favored 'General case' 0 N--CA 1.454 -0.264 0 N-CA-C 109.067 -0.716 . . . . 0.0 109.067 175.423 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -66.69 -35.72 80.8 Favored 'General case' 0 N--CA 1.446 -0.657 0 CA-C-O 119.031 -0.509 . . . . 0.0 112.097 -175.457 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 113' ' ' ILE . . . . . . . . . . . . . 20.6 mm -70.26 -40.71 78.28 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.213 0 CA-C-N 119.315 0.961 . . . . 0.0 110.209 -178.936 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -74.35 -40.38 62.19 Favored 'General case' 0 N--CA 1.451 -0.377 0 C-N-CA 121.288 -0.165 . . . . 0.0 111.385 -179.421 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 115' ' ' LYS . . . . . 0.623 ' HE2' ' HA ' ' A' ' 115' ' ' LYS . 0.6 OUTLIER -75.58 -39.31 58.25 Favored 'General case' 0 N--CA 1.449 -0.485 0 N-CA-C 113.341 0.867 . . . . 0.0 113.341 -178.516 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 116' ' ' SER . . . . . 0.478 ' HB2' ' CB ' ' A' ' 120' ' ' HIS . 44.4 p -80.5 161.3 24.91 Favored 'General case' 0 N--CA 1.455 -0.198 0 N-CA-C 112.425 0.528 . . . . 0.0 112.425 -172.52 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 22.6 m120 -88.64 178.02 6.61 Favored 'General case' 0 C--O 1.227 -0.1 0 C-N-CA 123.435 0.694 . . . . 0.0 112.59 -177.367 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 118' ' ' GLN . . . . . . . . . . . . . 2.9 pt20 -49.21 -55.09 13.65 Favored 'General case' 0 N--CA 1.456 -0.128 0 C-N-CA 123.633 0.773 . . . . 0.0 112.937 -177.661 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 21.9 t70 -56.59 -33.98 66.75 Favored 'General case' 0 C--O 1.23 0.052 0 CA-C-N 118.451 0.569 . . . . 0.0 110.104 -179.993 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 120' ' ' HIS . . . . . 0.478 ' CB ' ' HB2' ' A' ' 116' ' ' SER . 15.9 m170 -75.05 -41.41 59.17 Favored 'General case' 0 N--CA 1.449 -0.489 0 N-CA-C 109.932 -0.395 . . . . 0.0 109.932 -177.571 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 62.1 mttp -58.08 -37.97 75.48 Favored 'General case' 0 N--CA 1.455 -0.202 0 N-CA-C 110.228 -0.286 . . . . 0.0 110.228 179.88 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 81.6 mm-40 -68.86 -46.24 69.0 Favored 'General case' 0 N--CA 1.449 -0.486 0 C-N-CA 122.72 0.408 . . . . 0.0 110.299 179.033 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 97.4 mttt -64.55 -31.33 72.5 Favored 'General case' 0 N--CA 1.453 -0.307 0 CA-C-N 115.75 -0.659 . . . . 0.0 111.07 -178.698 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 124' ' ' ILE . . . . . . . . . . . . . 58.4 mt -75.62 -38.47 38.4 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.242 0 O-C-N 121.791 -0.568 . . . . 0.0 110.132 176.761 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 22.9 mtp180 -67.49 -33.11 74.44 Favored 'General case' 0 N--CA 1.453 -0.277 0 N-CA-C 112.385 0.513 . . . . 0.0 112.385 178.14 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 126' ' ' MET . . . . . . . . . . . . . 28.1 ptm -72.5 -33.82 67.2 Favored 'General case' 0 N--CA 1.455 -0.207 0 C-N-CA 119.489 -0.884 . . . . 0.0 108.686 174.328 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 2.6 mp -63.33 -38.23 90.34 Favored 'General case' 0 C--N 1.34 0.163 0 N-CA-C 109.896 -0.409 . . . . 0.0 109.896 175.19 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 57.4 tp -64.24 -42.62 96.45 Favored 'General case' 0 N--CA 1.453 -0.285 0 CA-C-N 117.747 0.249 . . . . 0.0 110.335 179.614 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 18.9 t0 -63.82 -46.64 84.19 Favored 'General case' 0 N--CA 1.455 -0.178 0 N-CA-C 109.855 -0.424 . . . . 0.0 109.855 177.697 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 54.8 mt -56.37 -35.81 44.72 Favored 'Isoleucine or valine' 0 C--O 1.235 0.296 0 N-CA-C 110.257 -0.275 . . . . 0.0 110.257 179.931 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 131' ' ' TRP . . . . . . . . . . . . . 47.6 m0 . . . . . 0 N--CA 1.45 -0.462 0 N-CA-C 112.635 0.606 . . . . 0.0 112.635 -179.536 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 31.3 p-10 . . . . . 0 N--CA 1.454 -0.256 0 N-CA-C 110.283 -0.265 . . . . 0.0 110.283 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 7' ' ' PHE . . . . . 0.505 ' CD1' ' HD3' ' A' ' 45' ' ' LYS . 1.3 t80 -57.28 -41.84 80.53 Favored 'General case' 0 N--CA 1.451 -0.376 0 C-N-CA 123.496 0.718 . . . . 0.0 111.714 -179.658 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 46.1 tp60 -53.73 -33.94 57.27 Favored 'General case' 0 N--CA 1.456 -0.127 0 C-N-CA 122.777 0.431 . . . . 0.0 111.653 -176.537 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 18.8 m-80 -70.92 -31.12 67.63 Favored 'General case' 0 N--CA 1.451 -0.398 0 N-CA-C 109.944 -0.391 . . . . 0.0 109.944 -179.964 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 10' ' ' PHE . . . . . 0.464 ' CE2' ' HB2' ' A' ' 32' ' ' LEU . 10.9 t80 -71.54 -39.02 70.97 Favored 'General case' 0 N--CA 1.452 -0.343 0 N-CA-C 109.419 -0.586 . . . . 0.0 109.419 176.189 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 57.5 t -63.15 -55.83 21.01 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.359 0 N-CA-C 109.18 -0.674 . . . . 0.0 109.18 179.059 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -60.24 -29.22 68.62 Favored 'General case' 0 N--CA 1.453 -0.291 0 C-N-CA 123.277 0.631 . . . . 0.0 112.161 -179.922 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 99.9 m -72.62 -39.74 67.02 Favored 'General case' 0 CA--C 1.53 0.211 0 CA-C-N 118.904 0.775 . . . . 0.0 109.403 177.268 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . 0.476 ' HA ' ' CD1' ' A' ' 17' ' ' PHE . 14.2 tp -65.23 -46.71 79.51 Favored 'General case' 0 N--CA 1.454 -0.233 0 CA-C-O 121.644 0.735 . . . . 0.0 109.467 178.192 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 69.0 mm-40 -63.4 -29.58 70.85 Favored 'General case' 0 N--CA 1.45 -0.443 0 C-N-CA 124.136 0.974 . . . . 0.0 110.048 178.898 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 42.3 t -69.46 -32.24 71.04 Favored 'General case' 0 N--CA 1.452 -0.336 0 N-CA-C 109.679 -0.489 . . . . 0.0 109.679 177.375 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 17' ' ' PHE . . . . . 0.476 ' CD1' ' HA ' ' A' ' 14' ' ' LEU . 19.7 m-85 -63.61 -42.05 98.25 Favored 'General case' 0 N--CA 1.454 -0.25 0 C-N-CA 119.388 -0.925 . . . . 0.0 109.604 172.559 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 67.1 mttt -61.82 -28.54 69.55 Favored 'General case' 0 C--N 1.341 0.2 0 O-C-N 122.985 0.178 . . . . 0.0 110.833 -178.776 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 54.5 t0 -73.95 -43.62 57.63 Favored 'General case' 0 N--CA 1.455 -0.177 0 O-C-N 123.48 0.488 . . . . 0.0 111.019 178.829 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . 0.42 ' CD1' ' HB2' ' A' ' 25' ' ' SER . 63.6 mt -57.82 144.13 39.75 Favored 'General case' 0 N--CA 1.454 -0.228 0 O-C-N 122.048 -0.408 . . . . 0.0 111.073 -177.157 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -83.7 -22.86 31.92 Favored 'General case' 0 N--CA 1.453 -0.323 0 N-CA-C 109.652 -0.499 . . . . 0.0 109.652 177.001 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 22' ' ' SER . . . . . 0.459 ' C ' ' H ' ' A' ' 24' ' ' ILE . 68.8 m -75.36 -24.09 57.26 Favored 'General case' 0 N--CA 1.456 -0.148 0 N-CA-C 109.832 -0.433 . . . . 0.0 109.832 170.335 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 70.64 -31.69 0.48 Allowed Glycine 0 CA--C 1.527 0.799 0 C-N-CA 124.883 1.23 . . . . 0.0 112.103 179.689 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . 0.459 ' H ' ' C ' ' A' ' 22' ' ' SER . 47.2 mt -87.23 154.95 3.28 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.523 0 C-N-CA 123.801 0.841 . . . . 0.0 109.143 173.881 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 25' ' ' SER . . . . . 0.42 ' HB2' ' CD1' ' A' ' 20' ' ' LEU . 32.7 t -158.29 81.46 0.83 Allowed 'General case' 0 CA--C 1.517 -0.319 0 N-CA-C 109.886 -0.413 . . . . 0.0 109.886 177.82 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -50.58 -33.01 25.13 Favored Glycine 0 CA--C 1.529 0.927 0 CA-C-O 119.499 -0.612 . . . . 0.0 112.43 -175.442 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 40.3 t -73.13 -52.39 14.38 Favored 'General case' 0 N--CA 1.453 -0.298 0 CA-C-N 118.205 1.003 . . . . 0.0 110.771 -179.709 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 82.6 mtt85 -69.88 -31.74 69.71 Favored 'General case' 0 C--N 1.34 0.189 0 CA-C-N 117.544 0.156 . . . . 0.0 110.681 -177.491 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 53.0 mt -59.77 -45.81 94.28 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.724 0 N-CA-C 108.164 -1.05 . . . . 0.0 108.164 174.423 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 33.5 mtmm -68.22 -23.32 64.8 Favored 'General case' 0 N--CA 1.454 -0.234 0 CA-C-O 118.606 -0.711 . . . . 0.0 111.869 177.06 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.04 -59.4 4.19 Favored 'General case' 0 C--N 1.341 0.197 0 CA-C-N 119.341 0.973 . . . . 0.0 110.281 177.777 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . 0.464 ' HB2' ' CE2' ' A' ' 10' ' ' PHE . 1.2 pp -75.29 -17.94 60.17 Favored 'General case' 0 CA--C 1.531 0.245 0 C-N-CA 119.47 -0.892 . . . . 0.0 112.068 -177.271 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 55.2 m -72.66 -38.75 67.55 Favored 'General case' 0 N--CA 1.457 -0.123 0 N-CA-C 108.898 -0.779 . . . . 0.0 108.898 175.684 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 98.8 m -70.4 -37.4 74.46 Favored 'General case' 0 N--CA 1.453 -0.321 0 N-CA-C 109.861 -0.422 . . . . 0.0 109.861 179.995 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 19.8 t80 -61.64 -38.26 87.05 Favored 'General case' 0 C--N 1.34 0.159 0 N-CA-C 109.962 -0.385 . . . . 0.0 109.962 175.359 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -68.07 -37.54 81.38 Favored 'General case' 0 N--CA 1.447 -0.621 0 CA-C-N 116.791 -0.186 . . . . 0.0 110.945 -179.331 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 3.2 mm? -71.05 -35.97 72.15 Favored 'General case' 0 CA--C 1.522 -0.114 0 C-N-CA 122.096 0.158 . . . . 0.0 110.948 -179.369 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 41.5 t0 -72.86 -14.62 61.53 Favored 'General case' 0 N--CA 1.452 -0.337 0 C-N-CA 122.472 0.309 . . . . 0.0 110.588 177.238 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 96.6 m-70 -151.52 88.99 1.45 Allowed 'General case' 0 CA--C 1.53 0.192 0 C-N-CA 122.935 0.494 . . . . 0.0 111.411 -173.897 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -75.42 -12.71 14.88 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.232 0 O-C-N 122.023 -0.423 . . . . 0.0 111.024 175.707 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -57.24 -24.38 54.33 Favored 'General case' 0 C--O 1.228 -0.045 0 C-N-CA 123.34 0.656 . . . . 0.0 111.762 -176.404 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -106.98 18.63 5.77 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.24 0 C-N-CA 123.291 0.637 . . . . 0.0 112.58 178.768 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 3.0 pp20? -54.0 -28.61 39.03 Favored 'General case' 0 CA--C 1.528 0.129 0 CA-C-N 118.723 0.692 . . . . 0.0 111.7 177.848 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 29.6 t -65.39 -46.14 81.27 Favored 'General case' 0 N--CA 1.452 -0.335 0 O-C-N 122.384 -0.198 . . . . 0.0 110.936 -176.199 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . 0.505 ' HD3' ' CD1' ' A' ' 7' ' ' PHE . 19.2 ptpt -74.69 -26.9 60.15 Favored 'General case' 0 C--N 1.339 0.13 0 N-CA-C 109.566 -0.531 . . . . 0.0 109.566 177.908 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 61.0 mt -68.63 -48.8 69.88 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.228 0 N-CA-C 109.823 -0.436 . . . . 0.0 109.823 -179.036 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 35.4 mm -63.84 -38.25 81.86 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.249 0 N-CA-C 109.065 -0.717 . . . . 0.0 109.065 176.944 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 49.8 m -63.33 -42.64 98.99 Favored 'General case' 0 CA--C 1.531 0.23 0 C-N-CA 120.82 -0.352 . . . . 0.0 111.5 -178.345 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 6.9 mp -73.51 -36.35 65.72 Favored 'General case' 0 N--CA 1.453 -0.276 0 N-CA-C 112.652 0.612 . . . . 0.0 112.652 -176.332 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 5.5 pt -71.63 -44.4 69.76 Favored 'Isoleucine or valine' 0 C--N 1.34 0.169 0 CA-C-N 119.352 0.978 . . . . 0.0 110.846 -178.55 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 16.2 pt -66.12 -38.04 81.1 Favored 'Isoleucine or valine' 0 C--N 1.335 -0.055 0 C-N-CA 120.192 -0.603 . . . . 0.0 110.785 -179.783 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 90.7 m-20 -70.86 -41.07 71.9 Favored 'General case' 0 N--CA 1.454 -0.274 0 CA-C-N 118.107 0.412 . . . . 0.0 111.756 178.365 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 18.8 t80 -63.61 -41.3 98.32 Favored 'General case' 0 N--CA 1.455 -0.182 0 N-CA-C 109.081 -0.711 . . . . 0.0 109.081 175.93 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 23.3 t -62.25 -38.91 91.05 Favored 'General case' 0 N--CA 1.45 -0.462 0 C-N-CA 122.437 0.295 . . . . 0.0 111.435 -176.64 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 55.6 mtm180 -75.12 -40.88 59.47 Favored 'General case' 0 N--CA 1.456 -0.156 0 N-CA-C 111.913 0.338 . . . . 0.0 111.913 -177.239 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 48.7 mt -80.46 -44.52 19.1 Favored 'General case' 0 N--CA 1.455 -0.206 0 N-CA-C 113.221 0.823 . . . . 0.0 113.221 -176.023 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 14.5 p -62.68 159.45 43.58 Favored Pre-proline 0 CA--C 1.535 0.382 0 N-CA-C 114.241 1.2 . . . . 0.0 114.241 -170.701 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 35.9 Cg_exo -58.79 -179.51 0.15 Allowed 'Trans proline' 0 N--CA 1.454 -0.822 1 C-N-CA 125.758 4.306 . . . . 0.0 113.746 174.423 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 42.3 p-10 -66.4 -42.65 87.52 Favored 'General case' 0 CA--C 1.533 0.298 0 C-N-CA 124.534 1.134 . . . . 0.0 113.364 -175.013 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 39.8 m -72.75 -37.03 67.81 Favored 'General case' 0 N--CA 1.455 -0.189 0 O-C-N 121.773 -0.58 . . . . 0.0 109.762 179.74 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 55.4 m80 -69.02 -27.87 66.06 Favored 'General case' 0 N--CA 1.45 -0.425 0 CA-C-N 116.176 -0.465 . . . . 0.0 109.867 176.025 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . 0.417 ' HE3' ' HB3' ' A' ' 112' ' ' ALA . 56.4 tptt -65.88 -45.39 82.24 Favored 'General case' 0 C--N 1.338 0.108 0 C-N-CA 122.623 0.369 . . . . 0.0 110.025 177.877 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . 0.46 HD13 ' CD2' ' A' ' 120' ' ' HIS . 0.3 OUTLIER -61.29 -41.94 97.82 Favored 'General case' 0 N--CA 1.455 -0.213 0 N-CA-C 108.458 -0.941 . . . . 0.0 108.458 177.641 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -65.22 -29.26 74.87 Favored Glycine 0 CA--C 1.527 0.791 0 N-CA-C 111.964 -0.454 . . . . 0.0 111.964 178.554 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 37.0 p -68.7 -37.1 79.26 Favored 'General case' 0 N--CA 1.451 -0.375 0 CA-C-N 117.931 0.866 . . . . 0.0 110.062 178.462 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 95.1 mt -75.32 -24.81 57.47 Favored 'General case' 0 N--CA 1.452 -0.338 0 CA-C-N 116.596 -0.275 . . . . 0.0 110.726 178.98 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 9.6 m-30 -70.69 -36.01 73.08 Favored 'General case' 0 CA--C 1.515 -0.374 0 CA-C-N 118.338 0.517 . . . . 0.0 110.422 174.007 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 68' ' ' ILE . . . . . . . . . . . . . 22.0 mt -68.29 -54.3 22.76 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.621 0 N-CA-C 107.448 -1.315 . . . . 0.0 107.448 177.69 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 65.5 mt -50.39 -37.14 14.28 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.174 0 C-N-CA 123.885 0.874 . . . . 0.0 111.802 175.021 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 8.8 t70 -71.06 -54.85 9.71 Favored 'General case' 0 CA--C 1.521 -0.147 0 CA-C-N 118.819 0.736 . . . . 0.0 111.487 -179.737 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 53.6 p -66.87 -44.26 81.4 Favored 'General case' 0 N--CA 1.452 -0.373 0 O-C-N 123.161 0.288 . . . . 0.0 110.499 -175.25 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -75.13 -36.65 38.22 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.246 0 N-CA-C 109.629 -0.508 . . . . 0.0 109.629 179.731 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -67.09 -46.15 75.32 Favored Glycine 0 C--N 1.337 0.622 0 N-CA-C 111.417 -0.673 . . . . 0.0 111.417 -175.351 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 39.0 mtm105 -69.81 -42.61 73.47 Favored 'General case' 0 CA--C 1.517 -0.309 0 CA-C-N 117.37 0.585 . . . . 0.0 109.906 177.913 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -64.83 -33.88 77.05 Favored 'General case' 0 N--CA 1.45 -0.432 0 CA-C-O 119.335 -0.364 . . . . 0.0 110.918 -178.191 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 1.0 OUTLIER -68.18 -45.45 73.4 Favored 'General case' 0 CA--C 1.519 -0.241 0 CA-C-N 118.571 0.623 . . . . 0.0 110.929 177.076 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . 0.447 ' HA ' ' SG ' ' A' ' 94' ' ' CYS . 6.5 tt -66.62 -48.17 70.33 Favored 'General case' 0 N--CA 1.447 -0.596 0 C-N-CA 118.249 -1.381 . . . . 0.0 108.24 -178.266 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 90.4 m-20 -54.19 -44.96 72.0 Favored 'General case' 0 C--O 1.228 -0.079 0 N-CA-C 112.864 0.69 . . . . 0.0 112.864 177.979 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 15.5 tm-20 -61.53 -50.2 73.64 Favored 'General case' 0 N--CA 1.448 -0.548 0 CA-C-N 117.878 0.308 . . . . 0.0 111.117 -177.752 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 31.6 p -72.82 -26.88 61.65 Favored 'General case' 0 N--CA 1.453 -0.276 0 C-N-CA 120.477 -0.489 . . . . 0.0 110.412 -178.12 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 33.2 ttp180 -70.4 -23.7 62.8 Favored 'General case' 0 N--CA 1.45 -0.448 0 C-N-CA 123.676 0.79 . . . . 0.0 111.061 175.022 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 34.0 t . . . . . 0 N--CA 1.454 -0.262 0 N-CA-C 113.14 0.793 . . . . 0.0 113.14 -179.13 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 31.5 Cg_exo . . . . . 0 N--CA 1.447 -1.211 0 N-CA-C 108.209 -1.496 . . . . 0.0 108.209 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 90.68 16.57 54.6 Favored Glycine 0 CA--C 1.526 0.766 0 CA-C-O 119.369 -0.684 . . . . 0.0 112.28 -176.756 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 78.0 p -151.2 172.17 16.25 Favored 'General case' 0 N--CA 1.455 -0.213 0 CA-C-N 118.05 0.925 . . . . 0.0 111.349 176.307 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 94' ' ' CYS . . . . . 0.447 ' SG ' ' HA ' ' A' ' 77' ' ' LEU . 5.3 t -57.03 -27.21 61.44 Favored 'General case' 0 N--CA 1.451 -0.422 0 CA-C-N 115.196 -0.911 . . . . 0.0 109.91 173.376 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -56.11 -59.25 5.19 Favored 'General case' 0 N--CA 1.446 -0.653 0 N-CA-C 109.384 -0.599 . . . . 0.0 109.384 -176.189 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 73.6 t60 -74.59 -34.44 62.87 Favored 'General case' 0 N--CA 1.45 -0.472 0 CA-C-N 116.36 -0.382 . . . . 0.0 111.419 -179.152 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -64.93 -50.67 65.55 Favored 'General case' 0 N--CA 1.454 -0.261 0 O-C-N 122.969 0.168 . . . . 0.0 111.356 -177.145 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 98' ' ' ILE . . . . . 0.407 HD13 ' SG ' ' A' ' 94' ' ' CYS . 1.7 mp -73.61 -32.31 35.31 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.207 0 N-CA-C 110.033 -0.358 . . . . 0.0 110.033 -178.32 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 2.0 m120 -67.11 -45.24 77.79 Favored 'General case' 0 N--CA 1.453 -0.306 0 CA-C-N 118.062 0.392 . . . . 0.0 111.101 176.838 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 95.9 m -70.67 -33.64 71.16 Favored 'General case' 0 N--CA 1.457 -0.12 0 CA-C-N 117.947 0.339 . . . . 0.0 110.497 -177.109 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 68.4 tp -73.58 -30.39 62.99 Favored 'General case' 0 N--CA 1.451 -0.408 0 C-N-CA 122.661 0.385 . . . . 0.0 110.946 -179.104 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -70.09 -19.84 75.91 Favored Glycine 0 CA--C 1.529 0.922 0 CA-C-O 119.555 -0.581 . . . . 0.0 112.828 -176.998 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 14.6 mm-40 -80.23 -39.46 29.01 Favored 'General case' 0 C--O 1.231 0.125 0 CA-C-N 118.008 0.904 . . . . 0.0 111.381 179.998 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 30.3 m -97.87 -8.87 9.09 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.158 0 N-CA-C 113.177 0.806 . . . . 0.0 113.177 -173.868 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 105' ' ' ILE . . . . . . . . . . . . . 10.6 tp -57.15 -26.78 26.09 Favored 'Isoleucine or valine' 0 CA--C 1.528 0.124 0 CA-C-N 119.162 0.892 . . . . 0.0 111.655 -176.716 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 25.4 pt20 -67.48 -30.04 69.64 Favored 'General case' 0 N--CA 1.454 -0.267 0 O-C-N 122.182 -0.324 . . . . 0.0 110.523 178.852 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 66.5 mt-10 -73.98 -41.6 61.68 Favored 'General case' 0 N--CA 1.455 -0.201 0 N-CA-C 108.795 -0.817 . . . . 0.0 108.795 177.315 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 41.1 mt -68.65 -42.73 77.53 Favored 'General case' 0 N--CA 1.449 -0.505 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.573 -174.348 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 95.9 mt -72.61 -47.1 50.58 Favored 'General case' 0 N--CA 1.451 -0.416 0 CA-C-O 119.01 -0.519 . . . . 0.0 111.319 -179.033 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 44.6 t -61.89 -41.19 97.58 Favored 'General case' 0 C--O 1.233 0.204 0 CA-C-N 118.849 0.75 . . . . 0.0 110.684 -179.295 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 22.6 t0 -59.25 -40.26 85.43 Favored 'General case' 0 N--CA 1.453 -0.289 0 N-CA-C 108.469 -0.937 . . . . 0.0 108.469 174.7 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 112' ' ' ALA . . . . . 0.417 ' HB3' ' HE3' ' A' ' 62' ' ' LYS . . . -69.33 -38.75 78.32 Favored 'General case' 0 N--CA 1.443 -0.779 0 C-N-CA 120.603 -0.439 . . . . 0.0 111.138 -175.768 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 113' ' ' ILE . . . . . 0.44 ' O ' ' HE2' ' A' ' 121' ' ' LYS . 36.6 mm -66.21 -42.37 90.92 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.473 0 C-N-CA 118.809 -1.156 . . . . 0.0 109.739 -178.276 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -71.96 -46.86 55.9 Favored 'General case' 0 N--CA 1.451 -0.422 0 N-CA-C 111.555 0.205 . . . . 0.0 111.555 -178.899 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 33.1 ttpt -76.77 -37.25 56.22 Favored 'General case' 0 N--CA 1.451 -0.384 0 N-CA-C 113.497 0.925 . . . . 0.0 113.497 -175.405 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 116' ' ' SER . . . . . 0.484 ' HB2' ' CB ' ' A' ' 120' ' ' HIS . 24.4 p -76.54 159.82 30.0 Favored 'General case' 0 CA--C 1.527 0.095 0 N-CA-C 112.605 0.595 . . . . 0.0 112.605 -170.678 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 11.6 m120 -76.68 168.4 20.15 Favored 'General case' 0 CA--C 1.519 -0.236 0 C-N-CA 123.227 0.611 . . . . 0.0 111.851 -179.719 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 118' ' ' GLN . . . . . . . . . . . . . 12.7 mm100 -53.75 -42.23 67.96 Favored 'General case' 0 C--O 1.233 0.216 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.559 -178.394 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 18.4 t0 -66.67 -32.73 74.23 Favored 'General case' 0 N--CA 1.456 -0.164 0 N-CA-C 109.303 -0.628 . . . . 0.0 109.303 -179.622 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 120' ' ' HIS . . . . . 0.484 ' CB ' ' HB2' ' A' ' 116' ' ' SER . 20.8 m170 -76.05 -40.38 53.48 Favored 'General case' 0 N--CA 1.449 -0.491 0 CA-C-N 116.002 -0.544 . . . . 0.0 110.073 -178.859 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 121' ' ' LYS . . . . . 0.44 ' HE2' ' O ' ' A' ' 113' ' ' ILE . 96.0 mttt -54.98 -41.04 70.69 Favored 'General case' 0 C--N 1.339 0.118 0 N-CA-C 108.222 -1.029 . . . . 0.0 108.222 177.932 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 46.0 tp10 -70.63 -39.31 73.79 Favored 'General case' 0 CA--C 1.53 0.178 0 N-CA-C 111.467 0.173 . . . . 0.0 111.467 178.222 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 92.0 mttt -71.36 -26.43 62.8 Favored 'General case' 0 N--CA 1.452 -0.335 0 O-C-N 121.835 -0.541 . . . . 0.0 110.827 -179.266 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 124' ' ' ILE . . . . . . . . . . . . . 69.1 mt -69.99 -40.25 78.37 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.244 0 N-CA-C 108.653 -0.869 . . . . 0.0 108.653 174.233 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 125' ' ' ARG . . . . . 0.407 ' HA ' HH11 ' A' ' 125' ' ' ARG . 6.6 mmm180 -61.28 -48.41 81.53 Favored 'General case' 0 N--CA 1.45 -0.433 0 CA-C-O 118.899 -0.572 . . . . 0.0 111.518 179.269 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 126' ' ' MET . . . . . . . . . . . . . 28.7 ptm -62.96 -30.11 71.33 Favored 'General case' 0 N--CA 1.453 -0.284 0 C-N-CA 119.183 -1.007 . . . . 0.0 109.299 179.217 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 1.2 mp -62.44 -39.29 92.86 Favored 'General case' 0 C--N 1.339 0.146 0 CA-C-N 118.187 0.449 . . . . 0.0 111.037 175.957 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 80.8 mt -72.72 -36.76 67.87 Favored 'General case' 0 N--CA 1.455 -0.223 0 CA-C-N 118.488 0.586 . . . . 0.0 110.127 179.614 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 15.1 m-20 -65.71 -35.84 81.91 Favored 'General case' 0 N--CA 1.454 -0.274 0 N-CA-C 109.351 -0.611 . . . . 0.0 109.351 176.624 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 35.7 mt -63.62 -36.43 76.41 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.229 0 C-N-CA 122.487 0.315 . . . . 0.0 110.212 176.423 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 131' ' ' TRP . . . . . . . . . . . . . 46.4 m0 . . . . . 0 N--CA 1.449 -0.481 0 N-CA-C 112.899 0.703 . . . . 0.0 112.899 179.54 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 22.4 p-10 . . . . . 0 N--CA 1.457 -0.076 0 CA-C-O 121.275 0.559 . . . . 0.0 109.602 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 7' ' ' PHE . . . . . 0.495 ' CE1' ' HD3' ' A' ' 45' ' ' LYS . 1.4 t80 -55.28 -34.72 64.34 Favored 'General case' 0 N--CA 1.447 -0.59 0 C-N-CA 125.007 1.323 . . . . 0.0 111.022 -178.314 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 50.8 tp60 -53.68 -34.82 59.99 Favored 'General case' 0 N--CA 1.454 -0.262 0 C-N-CA 123.448 0.699 . . . . 0.0 112.059 -177.189 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 27.9 m-80 -72.3 -33.36 67.34 Favored 'General case' 0 N--CA 1.453 -0.311 0 N-CA-C 110.052 -0.351 . . . . 0.0 110.052 -179.529 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 10' ' ' PHE . . . . . 0.506 ' CZ ' HG12 ' A' ' 46' ' ' ILE . 6.4 t80 -70.19 -39.39 75.23 Favored 'General case' 0 N--CA 1.45 -0.439 0 N-CA-C 108.794 -0.817 . . . . 0.0 108.794 176.18 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 88.3 t -65.89 -53.38 38.62 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.271 0 N-CA-C 109.163 -0.68 . . . . 0.0 109.163 179.054 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -58.2 -30.62 66.61 Favored 'General case' 0 N--CA 1.455 -0.221 0 C-N-CA 122.716 0.406 . . . . 0.0 111.305 -179.312 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 91.4 m -71.13 -40.36 71.44 Favored 'General case' 0 N--CA 1.453 -0.325 0 N-CA-C 109.131 -0.692 . . . . 0.0 109.131 176.213 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . 0.448 ' HA ' ' CD1' ' A' ' 17' ' ' PHE . 8.2 tp -65.9 -41.55 91.33 Favored 'General case' 0 N--CA 1.449 -0.476 0 CA-C-O 121.416 0.627 . . . . 0.0 109.869 179.473 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 73.2 mm-40 -63.81 -27.96 69.54 Favored 'General case' 0 N--CA 1.448 -0.545 0 C-N-CA 124.133 0.973 . . . . 0.0 109.949 177.931 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 51.0 m -69.78 -30.65 68.27 Favored 'General case' 0 N--CA 1.453 -0.29 0 N-CA-C 109.74 -0.467 . . . . 0.0 109.74 176.474 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 17' ' ' PHE . . . . . 0.454 ' CD1' HD11 ' A' ' 68' ' ' ILE . 33.6 m-85 -69.98 -33.16 71.69 Favored 'General case' 0 C--N 1.339 0.137 0 C-N-CA 119.469 -0.892 . . . . 0.0 111.065 171.982 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . 0.462 ' HG2' ' CE1' ' A' ' 53' ' ' TYR . 70.0 mttt -67.37 -24.18 65.67 Favored 'General case' 0 N--CA 1.462 0.152 0 CA-C-O 120.918 0.389 . . . . 0.0 110.496 174.739 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 31.2 t0 -79.37 -46.35 17.8 Favored 'General case' 0 C--N 1.334 -0.075 0 CA-C-N 116.521 -0.309 . . . . 0.0 110.653 175.469 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 13.5 mt -54.63 126.67 24.77 Favored 'General case' 0 N--CA 1.457 -0.112 0 CA-C-O 120.894 0.378 . . . . 0.0 111.556 -176.666 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 1.2 mppt? -74.06 -23.28 59.35 Favored 'General case' 0 N--CA 1.456 -0.168 0 N-CA-C 108.988 -0.745 . . . . 0.0 108.988 175.194 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 34.6 m -82.67 -20.89 35.32 Favored 'General case' 0 N--CA 1.455 -0.184 0 C-N-CA 122.923 0.489 . . . . 0.0 110.637 174.916 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 72.21 -42.52 0.8 Allowed Glycine 0 CA--C 1.527 0.829 0 C-N-CA 124.982 1.277 . . . . 0.0 111.831 -177.168 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 84.1 mt -75.52 149.43 6.95 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.392 0 C-N-CA 123.995 0.918 . . . . 0.0 111.109 177.911 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 31.2 t -167.18 93.31 0.43 Allowed 'General case' 0 CA--C 1.518 -0.281 0 N-CA-C 108.847 -0.797 . . . . 0.0 108.847 169.791 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -55.23 -35.51 60.43 Favored Glycine 0 C--N 1.332 0.349 0 N-CA-C 110.709 -0.956 . . . . 0.0 110.709 -176.834 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 30.3 t -61.83 -53.15 59.85 Favored 'General case' 0 N--CA 1.449 -0.494 0 N-CA-C 109.752 -0.462 . . . . 0.0 109.752 -179.153 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 82.5 mmt-85 -68.87 -40.6 79.2 Favored 'General case' 0 C--O 1.231 0.123 0 C-N-CA 122.941 0.496 . . . . 0.0 110.417 -179.446 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 65.6 mt -57.37 -45.13 85.32 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.657 0 N-CA-C 108.559 -0.904 . . . . 0.0 108.559 177.931 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 51.0 mtmt -68.52 -27.27 65.96 Favored 'General case' 0 N--CA 1.456 -0.132 0 CA-C-O 118.65 -0.691 . . . . 0.0 111.51 179.531 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . 0.4 ' CA ' ' HE3' ' A' ' 31' ' ' LYS . 0.0 OUTLIER -63.59 -59.61 4.4 Favored 'General case' 0 C--N 1.341 0.232 0 CA-C-N 119.131 0.878 . . . . 0.0 110.163 177.299 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . 0.476 ' HB2' ' CE2' ' A' ' 10' ' ' PHE . 1.6 pp -75.67 -19.22 59.29 Favored 'General case' 0 CA--C 1.532 0.28 0 C-N-CA 119.263 -0.975 . . . . 0.0 111.64 -176.924 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 21.4 m -69.61 -42.93 73.71 Favored 'General case' 0 CA--C 1.52 -0.174 0 N-CA-C 108.845 -0.798 . . . . 0.0 108.845 175.927 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 87.4 m -72.1 -41.54 67.18 Favored 'General case' 0 N--CA 1.448 -0.552 0 CA-C-N 116.482 -0.326 . . . . 0.0 110.374 -175.995 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 58.3 t80 -63.98 -31.34 72.49 Favored 'General case' 0 N--CA 1.456 -0.163 0 C-N-CA 119.946 -0.701 . . . . 0.0 109.842 178.436 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -72.02 -27.66 62.87 Favored 'General case' 0 N--CA 1.447 -0.589 0 CA-C-O 119.385 -0.34 . . . . 0.0 110.682 174.414 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -76.39 -39.14 54.51 Favored 'General case' 0 CA--C 1.519 -0.229 0 N-CA-C 107.79 -1.189 . . . . 0.0 107.79 -175.89 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 77.0 m-20 -67.4 -15.28 63.59 Favored 'General case' 0 N--CA 1.441 -0.883 0 C-N-CA 124.981 1.312 . . . . 0.0 111.331 176.927 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 97.0 m-70 -153.42 91.55 1.51 Allowed 'General case' 0 N--CA 1.451 -0.415 0 C-N-CA 123.265 0.626 . . . . 0.0 111.137 -175.569 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 40' ' ' ILE . . . . . 0.479 ' H ' HD13 ' A' ' 40' ' ' ILE . 0.0 OUTLIER -70.07 -14.83 18.64 Favored 'Isoleucine or valine' 0 C--O 1.226 -0.176 0 O-C-N 121.788 -0.57 . . . . 0.0 109.789 173.11 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 20.9 m-20 -57.91 -10.49 1.78 Allowed 'General case' 0 CA--C 1.532 0.255 0 C-N-CA 125.248 1.419 . . . . 0.0 113.897 -177.672 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -118.54 9.04 6.85 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.192 0 C-N-CA 124.114 0.966 . . . . 0.0 111.335 179.714 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 3.0 pp20? -47.76 -31.07 4.44 Favored 'General case' 0 C--N 1.331 -0.212 0 O-C-N 121.996 -0.44 . . . . 0.0 112.122 176.638 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 2.5 m -71.58 -39.03 70.83 Favored 'General case' 0 CA--C 1.53 0.211 0 O-C-N 121.794 -0.566 . . . . 0.0 111.234 -175.665 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . 0.495 ' HD3' ' CE1' ' A' ' 7' ' ' PHE . 19.1 ptpt -74.16 -24.5 59.41 Favored 'General case' 0 CA--C 1.531 0.24 0 O-C-N 121.637 -0.665 . . . . 0.0 109.719 176.357 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 46' ' ' ILE . . . . . 0.506 HG12 ' CZ ' ' A' ' 10' ' ' PHE . 97.7 mt -72.75 -47.37 50.2 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.237 0 C-N-CA 122.514 0.326 . . . . 0.0 110.206 -179.642 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 33.6 mm -62.79 -36.59 76.11 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.181 0 N-CA-C 109.183 -0.673 . . . . 0.0 109.183 177.454 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 47.1 m -62.84 -38.4 90.64 Favored 'General case' 0 N--CA 1.455 -0.202 0 C-N-CA 120.978 -0.289 . . . . 0.0 111.228 179.213 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 18.6 mt -74.68 -35.17 62.77 Favored 'General case' 0 N--CA 1.451 -0.413 0 N-CA-C 113.176 0.806 . . . . 0.0 113.176 -178.278 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 19.4 pt -69.59 -39.99 79.0 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.181 0 CA-C-N 118.925 0.784 . . . . 0.0 110.258 -178.893 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 36.0 pt -67.21 -42.79 88.38 Favored 'Isoleucine or valine' 0 C--N 1.338 0.092 0 C-N-CA 119.701 -0.799 . . . . 0.0 110.246 178.514 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 85.3 m-20 -63.96 -46.4 84.81 Favored 'General case' 0 N--CA 1.455 -0.208 0 CA-C-N 118.117 0.417 . . . . 0.0 110.886 -179.806 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 53' ' ' TYR . . . . . 0.462 ' CE1' ' HG2' ' A' ' 18' ' ' LYS . 12.1 t80 -63.59 -43.02 98.19 Favored 'General case' 0 N--CA 1.453 -0.314 0 N-CA-C 109.925 -0.398 . . . . 0.0 109.925 -179.819 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 24.2 m -66.0 -30.17 70.68 Favored 'General case' 0 N--CA 1.454 -0.24 0 CA-C-N 118.024 0.375 . . . . 0.0 111.757 -175.923 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 83.0 mtt-85 -76.62 -54.46 6.64 Favored 'General case' 0 N--CA 1.454 -0.251 0 CA-C-N 118.053 0.388 . . . . 0.0 111.523 -177.938 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . 0.424 ' N ' ' CD2' ' A' ' 56' ' ' LEU . 2.8 mm? -75.42 -20.16 59.05 Favored 'General case' 0 N--CA 1.455 -0.204 0 N-CA-C 113.863 1.06 . . . . 0.0 113.863 -174.084 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 57' ' ' CYS . . . . . 0.406 ' HB2' ' CB ' ' A' ' 61' ' ' HIS . 8.5 p -83.82 157.22 63.92 Favored Pre-proline 0 CA--C 1.537 0.465 0 N-CA-C 113.611 0.967 . . . . 0.0 113.611 -172.634 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 75.9 Cg_endo -75.4 -174.2 1.9 Allowed 'Trans proline' 0 N--CA 1.459 -0.507 1 C-N-CA 125.644 4.229 . . . . 0.0 111.82 174.358 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 38.5 p-10 -57.76 -50.22 73.97 Favored 'General case' 0 CA--C 1.529 0.155 0 C-N-CA 125.022 1.329 . . . . 0.0 114.407 -171.868 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 39.9 m -71.52 -32.21 67.92 Favored 'General case' 0 C--N 1.333 -0.134 0 O-C-N 122.074 -0.392 . . . . 0.0 110.428 -174.863 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 61' ' ' HIS . . . . . 0.406 ' CB ' ' HB2' ' A' ' 57' ' ' CYS . 61.5 m170 -75.39 -27.83 59.23 Favored 'General case' 0 N--CA 1.451 -0.414 0 C-N-CA 122.608 0.363 . . . . 0.0 110.207 176.464 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 45.6 tptt -68.97 -40.22 78.97 Favored 'General case' 0 N--CA 1.451 -0.425 0 N-CA-C 109.664 -0.495 . . . . 0.0 109.664 177.812 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 1.8 tm? -73.21 -35.43 66.32 Favored 'General case' 0 N--CA 1.454 -0.241 0 N-CA-C 109.537 -0.542 . . . . 0.0 109.537 178.6 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -69.39 -29.35 71.79 Favored Glycine 0 CA--C 1.525 0.718 0 N-CA-C 110.646 -0.982 . . . . 0.0 110.646 175.765 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 43.9 t -71.11 -42.74 68.89 Favored 'General case' 0 N--CA 1.454 -0.241 0 CA-C-N 117.566 0.683 . . . . 0.0 110.133 176.797 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 72.3 mt -68.01 -24.46 65.12 Favored 'General case' 0 N--CA 1.452 -0.358 0 N-CA-C 110.151 -0.314 . . . . 0.0 110.151 179.104 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 2.0 m-85 -70.04 -39.62 75.63 Favored 'General case' 0 N--CA 1.454 -0.274 0 C-N-CA 122.288 0.235 . . . . 0.0 110.815 172.802 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 68' ' ' ILE . . . . . 0.454 HD11 ' CD1' ' A' ' 17' ' ' PHE . 20.3 mt -67.07 -46.6 84.16 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.381 0 N-CA-C 108.728 -0.841 . . . . 0.0 108.728 177.994 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 97.3 mt -57.24 -36.48 52.23 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.121 0 C-N-CA 123.366 0.666 . . . . 0.0 111.028 175.729 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 22.2 t70 -70.18 -43.59 70.49 Favored 'General case' 0 N--CA 1.455 -0.223 0 CA-C-N 117.883 0.31 . . . . 0.0 110.912 178.437 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 30.1 t -67.25 -53.39 30.5 Favored 'General case' 0 N--CA 1.452 -0.351 0 CA-C-N 116.553 -0.294 . . . . 0.0 110.759 -177.458 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -75.13 -33.34 28.53 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.304 0 N-CA-C 109.911 -0.403 . . . . 0.0 109.911 -177.532 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -68.62 -45.33 67.08 Favored Glycine 0 C--N 1.338 0.67 0 CA-C-O 119.703 -0.498 . . . . 0.0 112.074 -176.155 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 33.4 mtm105 -71.01 -40.9 71.54 Favored 'General case' 0 N--CA 1.452 -0.329 0 CA-C-N 117.651 0.726 . . . . 0.0 109.695 177.143 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -61.22 -37.15 81.98 Favored 'General case' 0 N--CA 1.453 -0.297 0 C-N-CA 120.871 -0.332 . . . . 0.0 110.442 -178.673 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 2.4 m-30 -70.19 -47.5 61.25 Favored 'General case' 0 N--CA 1.453 -0.299 0 CA-C-N 118.033 0.379 . . . . 0.0 111.112 178.235 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -65.86 -38.27 88.38 Favored 'General case' 0 N--CA 1.444 -0.761 0 C-N-CA 118.935 -1.106 . . . . 0.0 108.675 -176.98 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 95.5 m-20 -63.49 -45.04 92.57 Favored 'General case' 0 N--CA 1.455 -0.188 0 N-CA-C 111.792 0.293 . . . . 0.0 111.792 177.255 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 14.5 tm-20 -63.54 -46.86 84.03 Favored 'General case' 0 N--CA 1.447 -0.579 0 CA-C-N 117.679 0.218 . . . . 0.0 111.215 -177.698 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 52.7 p -73.79 -18.53 60.95 Favored 'General case' 0 N--CA 1.453 -0.301 0 N-CA-C 112.068 0.396 . . . . 0.0 112.068 179.611 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 20.3 ttm105 -75.77 -37.13 59.52 Favored 'General case' 0 N--CA 1.455 -0.182 0 CA-C-N 118.161 0.437 . . . . 0.0 109.881 171.425 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 30.9 t . . . . . 0 N--CA 1.456 -0.17 0 C-N-CA 122.997 0.519 . . . . 0.0 112.385 -179.331 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 85.9 Cg_endo . . . . . 0 N--CA 1.453 -0.885 0 N-CA-C 109.746 -0.905 . . . . 0.0 109.746 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 80.61 17.89 72.09 Favored Glycine 0 CA--C 1.525 0.663 0 N-CA-C 111.489 -0.644 . . . . 0.0 111.489 179.306 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -156.78 166.68 32.68 Favored 'General case' 0 N--CA 1.455 -0.208 0 C-N-CA 124.811 1.244 . . . . 0.0 108.918 -178.809 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 94' ' ' CYS . . . . . . . . . . . . . 30.5 p -59.47 -18.59 40.99 Favored 'General case' 0 N--CA 1.451 -0.424 0 C-N-CA 122.358 0.263 . . . . 0.0 110.535 178.382 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -56.55 -63.09 1.31 Allowed 'General case' 0 N--CA 1.449 -0.48 0 C-N-CA 122.333 0.253 . . . . 0.0 110.62 -177.658 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 76.0 t60 -72.25 -33.54 67.58 Favored 'General case' 0 N--CA 1.449 -0.515 0 CA-C-N 116.949 -0.114 . . . . 0.0 110.739 -179.556 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -63.48 -54.1 41.63 Favored 'General case' 0 N--CA 1.452 -0.347 0 O-C-N 123.021 0.201 . . . . 0.0 111.375 -177.333 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 1.7 mp -70.13 -36.7 69.24 Favored 'Isoleucine or valine' 0 C--N 1.337 0.05 0 CA-C-N 117.778 0.263 . . . . 0.0 110.428 -179.505 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 35.9 m-20 -67.69 -45.22 75.77 Favored 'General case' 0 N--CA 1.454 -0.27 0 CA-C-N 117.916 0.325 . . . . 0.0 111.316 -178.512 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 98.1 m -70.27 -31.7 69.19 Favored 'General case' 0 N--CA 1.453 -0.308 0 N-CA-C 110.125 -0.324 . . . . 0.0 110.125 -177.797 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 53.7 tp -74.06 -38.34 63.98 Favored 'General case' 0 N--CA 1.449 -0.476 0 CA-C-O 119.626 -0.226 . . . . 0.0 111.058 179.439 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -65.96 -22.64 70.59 Favored Glycine 0 CA--C 1.53 1.009 0 CA-C-O 119.811 -0.438 . . . . 0.0 113.216 -174.562 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 17.3 mm-40 -78.84 -36.4 42.55 Favored 'General case' 0 N--CA 1.456 -0.127 0 CA-C-N 117.877 0.839 . . . . 0.0 111.455 179.186 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 19.6 m -105.02 -8.4 9.84 Favored 'Isoleucine or valine' 0 CA--C 1.527 0.089 0 N-CA-C 112.895 0.702 . . . . 0.0 112.895 -174.492 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 105' ' ' ILE . . . . . . . . . . . . . 10.6 tp -59.59 -26.79 35.78 Favored 'Isoleucine or valine' 0 C--N 1.337 0.062 0 CA-C-N 119.484 1.038 . . . . 0.0 110.587 -179.32 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 27.7 pt20 -66.97 -29.05 68.79 Favored 'General case' 0 N--CA 1.45 -0.432 0 N-CA-C 110.325 -0.25 . . . . 0.0 110.325 177.434 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 60.7 mt-10 -75.96 -36.44 59.3 Favored 'General case' 0 CA--C 1.529 0.153 0 N-CA-C 109.94 -0.393 . . . . 0.0 109.94 177.137 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 10.7 mp -71.69 -41.3 68.83 Favored 'General case' 0 N--CA 1.448 -0.543 0 N-CA-C 109.892 -0.41 . . . . 0.0 109.892 179.847 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 91.5 mt -70.72 -53.14 16.75 Favored 'General case' 0 N--CA 1.455 -0.183 0 CA-C-O 119.526 -0.273 . . . . 0.0 111.176 -179.581 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 9.8 p -47.14 -55.79 7.79 Favored 'General case' 0 C--N 1.34 0.162 0 C-N-CA 122.664 0.386 . . . . 0.0 111.067 177.474 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 18.5 t0 -59.76 -37.71 79.76 Favored 'General case' 0 N--CA 1.446 -0.665 0 N-CA-C 109.475 -0.565 . . . . 0.0 109.475 -179.808 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -68.65 -37.61 79.8 Favored 'General case' 0 N--CA 1.444 -0.761 0 C-N-CA 119.862 -0.735 . . . . 0.0 110.814 -176.504 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 113' ' ' ILE . . . . . . . . . . . . . 27.5 mm -67.71 -39.38 81.98 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.288 0 C-N-CA 119.331 -0.948 . . . . 0.0 110.211 -178.16 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -75.2 -43.57 51.23 Favored 'General case' 0 CA--C 1.53 0.201 0 N-CA-C 112.073 0.397 . . . . 0.0 112.073 179.265 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 39.4 ttmt -75.73 -38.31 58.59 Favored 'General case' 0 C--N 1.338 0.079 0 C-N-CA 123.486 0.714 . . . . 0.0 112.538 -175.263 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 54.9 p -74.66 154.09 38.64 Favored 'General case' 0 N--CA 1.453 -0.294 0 N-CA-C 112.692 0.627 . . . . 0.0 112.692 -170.735 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 21.5 t-20 -75.76 163.81 26.89 Favored 'General case' 0 N--CA 1.454 -0.267 0 N-CA-C 108.84 -0.8 . . . . 0.0 108.84 178.131 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 118' ' ' GLN . . . . . . . . . . . . . 26.5 mm100 -49.59 -51.91 33.99 Favored 'General case' 0 N--CA 1.457 -0.079 0 C-N-CA 123.117 0.567 . . . . 0.0 111.726 -171.61 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 16.0 t0 -57.16 -41.59 79.46 Favored 'General case' 0 C--O 1.23 0.04 0 N-CA-C 109.859 -0.422 . . . . 0.0 109.859 -179.761 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 68.3 m-70 -68.84 -34.4 75.42 Favored 'General case' 0 N--CA 1.447 -0.597 0 CA-C-O 118.981 -0.533 . . . . 0.0 110.603 -179.709 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 60.5 mttm -57.64 -42.81 84.17 Favored 'General case' 0 N--CA 1.464 0.267 0 CA-C-N 118.958 0.799 . . . . 0.0 109.845 177.319 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 29.6 mm-40 -75.62 -32.83 60.42 Favored 'General case' 0 N--CA 1.449 -0.478 0 N-CA-C 112.282 0.475 . . . . 0.0 112.282 -178.002 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 46.4 mtmt -67.5 -28.98 68.3 Favored 'General case' 0 C--N 1.332 -0.193 0 C-N-CA 120.046 -0.662 . . . . 0.0 109.427 176.791 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 124' ' ' ILE . . . . . . . . . . . . . 62.2 mt -69.89 -38.79 76.57 Favored 'Isoleucine or valine' 0 C--O 1.226 -0.143 0 N-CA-C 109.463 -0.569 . . . . 0.0 109.463 171.812 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -56.39 -49.05 75.6 Favored 'General case' 0 C--N 1.341 0.219 0 O-C-N 122.185 -0.322 . . . . 0.0 110.468 179.818 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 126' ' ' MET . . . . . . . . . . . . . 27.8 ptm -69.41 -31.28 69.54 Favored 'General case' 0 N--CA 1.454 -0.243 0 C-N-CA 120.508 -0.477 . . . . 0.0 110.402 -179.582 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 2.1 mp -62.85 -32.77 74.07 Favored 'General case' 0 N--CA 1.456 -0.144 0 CA-C-N 118.568 0.622 . . . . 0.0 110.547 176.107 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 96.4 mt -72.43 -38.14 68.42 Favored 'General case' 0 N--CA 1.456 -0.162 0 CA-C-N 118.777 0.717 . . . . 0.0 109.927 177.291 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 50.9 m-20 -63.4 -36.34 83.39 Favored 'General case' 0 N--CA 1.456 -0.174 0 N-CA-C 109.796 -0.446 . . . . 0.0 109.796 175.375 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 55.0 mt -69.02 -31.97 52.51 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.278 0 C-N-CA 122.59 0.356 . . . . 0.0 110.615 179.404 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 131' ' ' TRP . . . . . . . . . . . . . 47.9 m0 . . . . . 0 N--CA 1.452 -0.361 0 C-N-CA 120.12 -0.632 . . . . 0.0 111.651 175.303 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 22.0 m-20 . . . . . 0 N--CA 1.456 -0.174 0 N-CA-C 108.85 -0.796 . . . . 0.0 108.85 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 7' ' ' PHE . . . . . 0.52 ' HB2' ' HZ3' ' A' ' 45' ' ' LYS . 1.4 t80 -58.26 -34.51 70.56 Favored 'General case' 0 N--CA 1.449 -0.497 0 C-N-CA 123.29 0.636 . . . . 0.0 109.779 179.55 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 51.0 tp60 -51.69 -36.75 47.81 Favored 'General case' 0 N--CA 1.456 -0.145 0 C-N-CA 124.545 1.138 . . . . 0.0 111.829 -177.668 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 26.5 m-80 -71.43 -34.85 70.66 Favored 'General case' 0 N--CA 1.454 -0.272 0 N-CA-C 109.821 -0.437 . . . . 0.0 109.821 -179.379 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 10' ' ' PHE . . . . . 0.471 ' CZ ' HG12 ' A' ' 46' ' ' ILE . 2.1 t80 -71.45 -38.2 71.33 Favored 'General case' 0 N--CA 1.45 -0.439 0 N-CA-C 109.078 -0.712 . . . . 0.0 109.078 178.24 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 86.8 t -66.48 -55.36 18.82 Favored 'Isoleucine or valine' 0 CA--C 1.52 -0.181 0 N-CA-C 109.106 -0.702 . . . . 0.0 109.106 178.448 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -58.01 -29.75 65.54 Favored 'General case' 0 N--CA 1.456 -0.13 0 C-N-CA 122.704 0.402 . . . . 0.0 111.996 -179.107 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 92.3 m -71.93 -39.77 69.22 Favored 'General case' 0 CA--C 1.53 0.209 0 N-CA-C 109.214 -0.661 . . . . 0.0 109.214 176.18 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . 0.417 ' HA ' ' CD1' ' A' ' 17' ' ' PHE . 0.1 OUTLIER -64.28 -45.45 87.97 Favored 'General case' 0 N--CA 1.45 -0.439 0 N-CA-C 109.076 -0.713 . . . . 0.0 109.076 177.145 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 72.5 mm-40 -64.91 -29.75 70.71 Favored 'General case' 0 N--CA 1.454 -0.267 0 C-N-CA 124.004 0.922 . . . . 0.0 110.264 179.798 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 70.5 m -67.18 -34.76 78.21 Favored 'General case' 0 N--CA 1.452 -0.348 0 N-CA-C 109.464 -0.569 . . . . 0.0 109.464 175.646 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 17' ' ' PHE . . . . . 0.417 ' CD1' ' HA ' ' A' ' 14' ' ' LEU . 15.4 m-85 -63.77 -39.98 95.59 Favored 'General case' 0 C--N 1.34 0.186 0 C-N-CA 120.176 -0.61 . . . . 0.0 109.821 174.657 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . 0.467 ' HG2' ' CE1' ' A' ' 53' ' ' TYR . 59.0 mttt -65.92 -29.45 69.87 Favored 'General case' 0 C--N 1.338 0.071 0 CA-C-N 117.625 0.193 . . . . 0.0 110.993 -179.122 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 60.6 t0 -75.16 -42.05 56.88 Favored 'General case' 0 N--CA 1.454 -0.242 0 O-C-N 123.374 0.421 . . . . 0.0 111.073 -179.189 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 14.1 mt -57.99 140.79 51.58 Favored 'General case' 0 N--CA 1.451 -0.396 0 C-N-CA 120.181 -0.608 . . . . 0.0 111.069 -176.483 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 1.1 mppt? -79.84 -21.42 44.19 Favored 'General case' 0 N--CA 1.454 -0.254 0 N-CA-C 109.319 -0.623 . . . . 0.0 109.319 176.543 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 22' ' ' SER . . . . . 0.445 ' C ' ' H ' ' A' ' 24' ' ' ILE . 85.8 p -76.75 -24.95 52.96 Favored 'General case' 0 CA--C 1.53 0.205 0 N-CA-C 109.557 -0.535 . . . . 0.0 109.557 169.82 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 71.7 -29.03 0.61 Allowed Glycine 0 CA--C 1.527 0.807 0 C-N-CA 125.294 1.426 . . . . 0.0 112.683 177.3 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . 0.445 ' H ' ' C ' ' A' ' 22' ' ' SER . 35.9 mt -89.73 155.07 3.12 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.557 0 N-CA-C 108.433 -0.951 . . . . 0.0 108.433 173.327 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 4.0 t -158.48 76.27 0.75 Allowed 'General case' 0 C--O 1.225 -0.199 0 CA-C-N 118.665 0.666 . . . . 0.0 110.518 -177.498 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -48.03 -49.86 22.91 Favored Glycine 0 CA--C 1.53 1.01 0 CA-C-O 118.592 -1.116 . . . . 0.0 115.403 -170.036 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 60.1 p -71.7 -35.96 70.4 Favored 'General case' 0 C--N 1.34 0.19 0 CA-C-N 120.173 1.987 . . . . 0.0 110.871 -176.182 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 75.2 mtt85 -70.94 -37.91 72.87 Favored 'General case' 0 C--N 1.341 0.237 0 CA-C-N 118.236 0.471 . . . . 0.0 110.183 178.027 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 41.3 mt -56.45 -45.03 81.73 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.446 0 N-CA-C 107.811 -1.181 . . . . 0.0 107.811 174.159 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 52.8 mtmt -68.36 -23.73 64.72 Favored 'General case' 0 N--CA 1.454 -0.225 0 CA-C-O 118.458 -0.782 . . . . 0.0 112.341 177.544 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . 0.474 ' HA ' ' HE3' ' A' ' 31' ' ' LYS . 0.0 OUTLIER -66.1 -59.28 3.93 Favored 'General case' 0 C--N 1.344 0.331 0 CA-C-N 119.629 1.104 . . . . 0.0 110.35 177.345 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 1.4 pp -74.17 -17.97 60.84 Favored 'General case' 0 N--CA 1.455 -0.176 0 C-N-CA 119.267 -0.973 . . . . 0.0 111.695 -177.024 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 39.7 m -73.54 -37.04 65.73 Favored 'General case' 0 N--CA 1.457 -0.12 0 N-CA-C 109.621 -0.511 . . . . 0.0 109.621 176.18 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 97.6 m -74.05 -37.27 64.33 Favored 'General case' 0 N--CA 1.453 -0.301 0 N-CA-C 110.231 -0.285 . . . . 0.0 110.231 -179.297 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 71.7 t80 -67.55 -33.32 74.81 Favored 'General case' 0 N--CA 1.454 -0.229 0 N-CA-C 109.718 -0.475 . . . . 0.0 109.718 176.727 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -71.14 -31.01 67.19 Favored 'General case' 0 N--CA 1.451 -0.386 0 CA-C-O 119.722 -0.18 . . . . 0.0 111.2 177.595 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 13.1 mt -71.92 -40.88 68.48 Favored 'General case' 0 N--CA 1.454 -0.23 0 C-N-CA 122.349 0.26 . . . . 0.0 111.123 178.101 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 41.8 t0 -67.6 -21.51 65.41 Favored 'General case' 0 CA--C 1.532 0.28 0 N-CA-C 110.504 -0.184 . . . . 0.0 110.504 178.613 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 74.6 m80 -146.39 92.0 2.12 Favored 'General case' 0 N--CA 1.453 -0.314 0 CA-C-O 120.88 0.372 . . . . 0.0 111.197 -177.662 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 40' ' ' ILE . . . . . 0.557 ' H ' HD13 ' A' ' 40' ' ' ILE . 0.0 OUTLIER -72.63 -16.99 18.3 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.54 0 CA-C-O 118.965 -0.54 . . . . 0.0 110.816 176.8 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 3.8 m-20 -57.68 -22.7 47.55 Favored 'General case' 0 N--CA 1.456 -0.16 0 N-CA-C 112.864 0.69 . . . . 0.0 112.864 -176.264 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -102.57 14.79 5.94 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.159 0 C-N-CA 122.636 0.374 . . . . 0.0 111.876 177.098 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 2.8 pp20? -51.51 -34.02 34.2 Favored 'General case' 0 C--O 1.226 -0.153 0 O-C-N 121.475 -0.765 . . . . 0.0 111.23 178.042 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 30.9 t -58.39 -49.88 75.67 Favored 'General case' 0 CA--C 1.531 0.225 0 N-CA-C 112.279 0.474 . . . . 0.0 112.279 -176.853 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . 0.52 ' HZ3' ' HB2' ' A' ' 7' ' ' PHE . 19.4 ptpt -71.13 -23.22 62.04 Favored 'General case' 0 CA--C 1.529 0.153 0 O-C-N 121.959 -0.463 . . . . 0.0 110.326 -179.913 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 46' ' ' ILE . . . . . 0.471 HG12 ' CZ ' ' A' ' 10' ' ' PHE . 94.4 mt -75.2 -41.72 44.28 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.256 0 C-N-CA 122.888 0.475 . . . . 0.0 109.899 179.979 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 32.1 mm -62.61 -35.47 70.47 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.212 0 N-CA-C 109.185 -0.672 . . . . 0.0 109.185 175.672 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 17.9 t -63.59 -47.78 80.07 Favored 'General case' 0 N--CA 1.456 -0.152 0 C-N-CA 119.872 -0.731 . . . . 0.0 110.454 177.443 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 20.6 mt -64.5 -33.54 76.12 Favored 'General case' 0 N--CA 1.449 -0.496 0 CA-C-O 118.708 -0.663 . . . . 0.0 112.451 -175.788 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 24.6 pt -70.18 -42.71 79.12 Favored 'Isoleucine or valine' 0 C--O 1.226 -0.17 0 C-N-CA 119.366 -0.933 . . . . 0.0 110.669 178.554 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 43.3 pt -70.92 -39.96 75.85 Favored 'Isoleucine or valine' 0 C--N 1.342 0.264 0 CA-C-N 118.916 0.78 . . . . 0.0 110.68 179.756 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 76.3 m-20 -63.31 -48.86 76.29 Favored 'General case' 0 N--CA 1.454 -0.265 0 CA-C-N 117.783 0.265 . . . . 0.0 110.8 -179.987 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 53' ' ' TYR . . . . . 0.467 ' CE1' ' HG2' ' A' ' 18' ' ' LYS . 16.9 t80 -66.13 -47.14 75.08 Favored 'General case' 0 N--CA 1.454 -0.255 0 CA-C-O 119.443 -0.313 . . . . 0.0 110.41 -179.538 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 19.4 t -65.0 -27.91 69.15 Favored 'General case' 0 N--CA 1.454 -0.272 0 O-C-N 123.205 0.316 . . . . 0.0 111.796 -173.968 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . 0.422 HH22 ' CD ' ' A' ' 107' ' ' GLU . 90.2 mtt-85 -75.49 -51.29 13.34 Favored 'General case' 0 N--CA 1.455 -0.205 0 O-C-N 122.211 -0.306 . . . . 0.0 110.996 178.057 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 44.0 mt -75.17 -43.53 51.71 Favored 'General case' 0 N--CA 1.457 -0.112 0 N-CA-C 113.034 0.753 . . . . 0.0 113.034 -172.884 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 57' ' ' CYS . . . . . 0.464 ' O ' ' HE2' ' A' ' 62' ' ' LYS . 12.6 p -65.39 154.07 88.55 Favored Pre-proline 0 CA--C 1.538 0.483 0 N-CA-C 112.985 0.735 . . . . 0.0 112.985 -173.633 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 45.6 Cg_endo -80.23 -175.53 2.75 Favored 'Trans proline' 0 N--CA 1.458 -0.612 1 C-N-CA 125.381 4.054 . . . . 0.0 112.371 -179.557 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 35.4 t0 -36.86 -73.29 0.05 OUTLIER 'General case' 0 C--N 1.341 0.206 0 C-N-CA 126.422 1.889 . . . . 0.0 114.357 -174.134 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 19.7 m -61.88 -29.43 70.19 Favored 'General case' 0 C--O 1.232 0.138 0 O-C-N 122.079 -0.388 . . . . 0.0 111.544 -171.643 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 60.2 m80 -75.66 -29.2 59.0 Favored 'General case' 0 N--CA 1.45 -0.444 0 C-N-CA 122.467 0.307 . . . . 0.0 110.62 178.516 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . 0.464 ' HE2' ' O ' ' A' ' 57' ' ' CYS . 66.4 mttm -68.33 -37.85 80.96 Favored 'General case' 0 C--N 1.34 0.182 0 N-CA-C 109.092 -0.707 . . . . 0.0 109.092 174.241 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -61.61 -44.66 96.59 Favored 'General case' 0 C--N 1.341 0.213 0 N-CA-C 108.437 -0.949 . . . . 0.0 108.437 177.321 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -68.76 -28.31 73.2 Favored Glycine 0 CA--C 1.526 0.733 0 N-CA-C 111.609 -0.596 . . . . 0.0 111.609 -179.539 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 37.0 p -67.73 -36.94 81.49 Favored 'General case' 0 N--CA 1.452 -0.326 0 CA-C-N 117.965 0.883 . . . . 0.0 109.497 177.71 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 79.0 mt -75.47 -26.81 58.54 Favored 'General case' 0 N--CA 1.449 -0.5 0 CA-C-N 116.506 -0.315 . . . . 0.0 110.935 179.573 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 10.0 m-30 -69.29 -37.72 77.97 Favored 'General case' 0 CA--C 1.513 -0.476 0 CA-C-N 118.367 0.531 . . . . 0.0 110.97 174.231 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 68' ' ' ILE . . . . . . . . . . . . . 18.2 mt -63.87 -47.83 88.99 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.764 0 N-CA-C 107.501 -1.296 . . . . 0.0 107.501 178.907 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 97.0 mt -59.4 -32.56 48.93 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.155 0 C-N-CA 123.832 0.853 . . . . 0.0 111.34 177.056 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 15.2 t70 -68.89 -54.9 12.99 Favored 'General case' 0 CA--C 1.52 -0.196 0 CA-C-N 118.26 0.482 . . . . 0.0 111.134 179.183 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 32.3 t -70.02 -42.33 73.11 Favored 'General case' 0 N--CA 1.452 -0.342 0 C-N-CA 120.829 -0.348 . . . . 0.0 110.795 -174.353 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -74.99 -34.89 33.67 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.233 0 N-CA-C 109.583 -0.525 . . . . 0.0 109.583 179.851 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -70.15 -52.0 20.25 Favored Glycine 0 C--N 1.338 0.667 0 N-CA-C 111.619 -0.592 . . . . 0.0 111.619 -176.531 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 38.6 mtm180 -65.95 -41.79 90.83 Favored 'General case' 0 N--CA 1.45 -0.466 0 C-N-CA 120.306 -0.558 . . . . 0.0 109.608 178.839 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -67.44 -31.29 71.36 Favored 'General case' 0 N--CA 1.45 -0.442 0 C-N-CA 119.703 -0.799 . . . . 0.0 110.865 -177.645 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 1.4 m-30 -66.52 -44.84 81.38 Favored 'General case' 0 CA--C 1.52 -0.199 0 CA-C-N 118.801 0.728 . . . . 0.0 110.348 177.368 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 42.9 tp -70.62 -45.74 64.65 Favored 'General case' 0 N--CA 1.447 -0.6 0 C-N-CA 117.914 -1.514 . . . . 0.0 109.281 179.387 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 83.1 m-20 -56.91 -45.91 82.31 Favored 'General case' 0 CA--C 1.531 0.247 0 N-CA-C 113.164 0.802 . . . . 0.0 113.164 179.017 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 4.7 tm-20 -64.79 -48.62 73.78 Favored 'General case' 0 N--CA 1.453 -0.323 0 CA-C-N 119.115 0.87 . . . . 0.0 110.994 -179.66 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 68.9 p -67.41 -25.91 66.17 Favored 'General case' 0 CA--C 1.528 0.125 0 O-C-N 122.219 -0.301 . . . . 0.0 110.694 179.133 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 35.3 ttp180 -75.93 -20.36 58.04 Favored 'General case' 0 N--CA 1.452 -0.361 0 C-N-CA 124.155 0.982 . . . . 0.0 111.757 171.98 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 53.4 m . . . . . 0 CA--C 1.529 0.135 0 CA-C-O 119.364 -0.35 . . . . 0.0 111.77 -179.4 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 58.3 Cg_endo . . . . . 0 N--CA 1.453 -0.906 0 N-CA-C 108.647 -1.328 . . . . 0.0 108.647 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 96.1 19.56 28.19 Favored Glycine 0 CA--C 1.525 0.683 0 CA-C-O 119.466 -0.63 . . . . 0.0 112.569 -176.841 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 37.3 p -151.62 171.33 17.79 Favored 'General case' 0 CA--C 1.521 -0.17 0 CA-C-N 118.327 1.064 . . . . 0.0 110.922 178.595 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 94' ' ' CYS . . . . . 0.403 ' HB2' HD13 ' A' ' 98' ' ' ILE . 29.6 p -59.23 -24.79 63.47 Favored 'General case' 0 N--CA 1.451 -0.394 0 CA-C-N 115.404 -0.816 . . . . 0.0 109.287 175.133 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -60.69 -57.99 10.37 Favored 'General case' 0 N--CA 1.446 -0.675 0 N-CA-C 109.381 -0.6 . . . . 0.0 109.381 -176.814 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 63.0 t60 -75.4 -30.18 60.01 Favored 'General case' 0 N--CA 1.451 -0.406 0 N-CA-C 111.603 0.223 . . . . 0.0 111.603 -179.03 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -68.53 -51.36 43.84 Favored 'General case' 0 N--CA 1.448 -0.539 0 O-C-N 123.029 0.206 . . . . 0.0 111.127 -178.473 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 98' ' ' ILE . . . . . 0.403 HD13 ' HB2' ' A' ' 94' ' ' CYS . 2.0 mp -72.01 -29.62 33.66 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.198 0 C-N-CA 120.785 -0.366 . . . . 0.0 110.323 179.874 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 4.5 m120 -64.65 -48.78 73.56 Favored 'General case' 0 N--CA 1.455 -0.19 0 CA-C-N 118.373 0.533 . . . . 0.0 110.322 175.663 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 43.9 m -71.79 -33.94 69.0 Favored 'General case' 0 N--CA 1.456 -0.126 0 O-C-N 122.322 -0.236 . . . . 0.0 110.61 -175.717 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -71.04 -40.85 71.45 Favored 'General case' 0 N--CA 1.447 -0.578 0 N-CA-C 110.225 -0.287 . . . . 0.0 110.225 -179.794 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -64.27 -22.54 67.38 Favored Glycine 0 CA--C 1.528 0.906 0 CA-C-O 119.185 -0.786 . . . . 0.0 114.045 -172.333 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 16.0 mt-10 -95.16 -13.8 24.7 Favored 'General case' 0 C--O 1.231 0.116 0 CA-C-N 118.649 1.225 . . . . 0.0 112.015 -178.492 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 48.2 t -113.18 -23.45 4.34 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.198 0 CA-C-N 116.691 -0.231 . . . . 0.0 111.289 -173.543 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 105' ' ' ILE . . . . . . . . . . . . . 10.0 tp -59.98 -23.3 26.52 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.146 0 C-N-CA 122.922 0.489 . . . . 0.0 111.369 -178.34 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 26.5 pt20 -65.58 -29.53 70.14 Favored 'General case' 0 N--CA 1.452 -0.373 0 N-CA-C 110.288 -0.264 . . . . 0.0 110.288 179.351 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 107' ' ' GLU . . . . . 0.422 ' CD ' HH22 ' A' ' 55' ' ' ARG . 37.8 mt-10 -75.88 -39.91 55.54 Favored 'General case' 0 N--CA 1.455 -0.19 0 CA-C-N 118.079 0.4 . . . . 0.0 110.164 177.445 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 9.8 mp -67.95 -42.37 81.07 Favored 'General case' 0 N--CA 1.453 -0.314 0 N-CA-C 110.066 -0.346 . . . . 0.0 110.066 -178.462 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 90.2 mt -69.52 -59.17 3.15 Favored 'General case' 0 N--CA 1.454 -0.27 0 CA-C-O 119.113 -0.47 . . . . 0.0 110.583 -179.285 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 12.1 p -45.5 -52.74 9.88 Favored 'General case' 0 C--O 1.232 0.17 0 CA-C-N 118.163 0.438 . . . . 0.0 111.806 -179.696 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 34.2 t0 -64.34 -38.93 92.76 Favored 'General case' 0 N--CA 1.445 -0.706 0 N-CA-C 110.099 -0.334 . . . . 0.0 110.099 -178.271 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -70.41 -32.98 70.82 Favored 'General case' 0 N--CA 1.448 -0.568 0 CA-C-O 119.244 -0.407 . . . . 0.0 110.671 -177.914 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 113' ' ' ILE . . . . . . . . . . . . . 46.1 mm -65.23 -41.3 91.21 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.133 0 N-CA-C 108.525 -0.917 . . . . 0.0 108.525 178.175 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -74.6 -38.46 62.6 Favored 'General case' 0 N--CA 1.454 -0.27 0 N-CA-C 112.13 0.418 . . . . 0.0 112.13 179.89 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 115' ' ' LYS . . . . . 0.592 ' HZ1' ' HB2' ' A' ' 115' ' ' LYS . 0.1 OUTLIER -75.5 -34.17 60.82 Favored 'General case' 0 C--N 1.339 0.138 0 N-CA-C 112.784 0.661 . . . . 0.0 112.784 -176.53 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 116' ' ' SER . . . . . 0.426 ' HB2' ' HB2' ' A' ' 120' ' ' HIS . 86.5 p -82.13 154.08 25.71 Favored 'General case' 0 N--CA 1.452 -0.352 0 N-CA-C 113.739 1.014 . . . . 0.0 113.739 -168.718 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 48.8 t30 -72.01 165.46 24.2 Favored 'General case' 0 CA--C 1.533 0.296 0 C-N-CA 124.036 0.935 . . . . 0.0 110.329 176.27 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 118' ' ' GLN . . . . . . . . . . . . . 25.6 mm100 -52.71 -40.78 63.31 Favored 'General case' 0 N--CA 1.456 -0.141 0 N-CA-C 113.239 0.829 . . . . 0.0 113.239 -171.633 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 20.4 p-10 -72.44 -41.06 66.56 Favored 'General case' 0 N--CA 1.456 -0.151 0 C-N-CA 120.606 -0.437 . . . . 0.0 109.828 -179.613 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 120' ' ' HIS . . . . . 0.426 ' HB2' ' HB2' ' A' ' 116' ' ' SER . 14.6 m-70 -65.22 -34.83 79.3 Favored 'General case' 0 N--CA 1.452 -0.334 0 C-N-CA 123.11 0.564 . . . . 0.0 110.366 178.226 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 55.8 mttm -61.15 -46.26 91.26 Favored 'General case' 0 C--N 1.341 0.208 0 N-CA-C 108.638 -0.875 . . . . 0.0 108.638 175.062 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 40.7 tp10 -67.39 -36.79 82.02 Favored 'General case' 0 N--CA 1.452 -0.336 0 CA-C-N 116.513 -0.312 . . . . 0.0 111.108 -176.313 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 34.1 mtmt -64.36 -31.68 72.98 Favored 'General case' 0 N--CA 1.452 -0.332 0 N-CA-C 109.61 -0.515 . . . . 0.0 109.61 176.912 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 124' ' ' ILE . . . . . . . . . . . . . 53.7 mt -74.0 -35.86 43.13 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.319 0 O-C-N 121.642 -0.661 . . . . 0.0 109.785 175.696 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 11.7 mmm180 -63.79 -39.74 94.97 Favored 'General case' 0 C--N 1.34 0.174 0 CA-C-N 118.522 0.601 . . . . 0.0 110.353 -179.778 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 126' ' ' MET . . . . . . . . . . . . . 18.6 ptp -68.9 -32.26 71.77 Favored 'General case' 0 N--CA 1.455 -0.189 0 C-N-CA 119.623 -0.831 . . . . 0.0 109.354 176.736 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 2.0 mp -60.52 -33.06 72.09 Favored 'General case' 0 CA--C 1.531 0.221 0 CA-C-N 118.647 0.658 . . . . 0.0 110.277 175.787 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -70.27 -42.11 72.56 Favored 'General case' 0 CA--C 1.523 -0.064 0 CA-C-N 118.701 0.682 . . . . 0.0 109.992 177.196 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 15.6 t0 -61.0 -45.03 96.49 Favored 'General case' 0 N--CA 1.455 -0.211 0 CA-C-O 121.085 0.469 . . . . 0.0 109.797 177.124 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 53.6 mt -61.05 -36.89 75.6 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.348 0 C-N-CA 123.575 0.75 . . . . 0.0 110.511 -178.29 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 131' ' ' TRP . . . . . . . . . . . . . 51.3 m0 . . . . . 0 N--CA 1.451 -0.383 0 N-CA-C 112.897 0.703 . . . . 0.0 112.897 -179.834 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 18.8 p-10 . . . . . 0 N--CA 1.453 -0.32 0 N-CA-C 107.443 -1.317 . . . . 0.0 107.443 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 7' ' ' PHE . . . . . 0.547 ' HB2' ' HZ2' ' A' ' 45' ' ' LYS . 1.0 OUTLIER -62.34 -34.42 76.6 Favored 'General case' 0 N--CA 1.443 -0.816 0 C-N-CA 125.515 1.526 . . . . 0.0 111.174 -176.427 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 17.4 tp60 -50.56 -36.2 33.38 Favored 'General case' 0 N--CA 1.456 -0.135 0 C-N-CA 123.141 0.576 . . . . 0.0 111.325 -178.455 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 26.5 m-80 -70.99 -39.69 72.31 Favored 'General case' 0 N--CA 1.454 -0.248 0 N-CA-C 110.194 -0.298 . . . . 0.0 110.194 -179.389 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 10' ' ' PHE . . . . . 0.524 ' CE2' ' HB2' ' A' ' 32' ' ' LEU . 3.7 t80 -68.56 -37.51 79.96 Favored 'General case' 0 N--CA 1.451 -0.408 0 C-N-CA 123.476 0.71 . . . . 0.0 109.873 178.089 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 94.7 t -66.28 -51.19 61.67 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.219 0 N-CA-C 108.221 -1.029 . . . . 0.0 108.221 178.601 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -61.64 -25.76 67.57 Favored 'General case' 0 N--CA 1.452 -0.344 0 C-N-CA 122.844 0.458 . . . . 0.0 111.717 179.789 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 59.3 m -74.61 -37.02 62.96 Favored 'General case' 0 N--CA 1.456 -0.155 0 N-CA-C 108.972 -0.751 . . . . 0.0 108.972 175.613 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -66.49 -44.25 83.16 Favored 'General case' 0 N--CA 1.448 -0.54 0 N-CA-C 108.617 -0.883 . . . . 0.0 108.617 177.088 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 68.2 mm-40 -66.53 -27.03 67.44 Favored 'General case' 0 N--CA 1.451 -0.41 0 C-N-CA 123.952 0.901 . . . . 0.0 110.001 177.864 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 22.0 t -67.93 -35.16 77.97 Favored 'General case' 0 N--CA 1.451 -0.379 0 N-CA-C 109.316 -0.624 . . . . 0.0 109.316 177.521 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 46.6 m-85 -67.9 -39.32 83.64 Favored 'General case' 0 CA--C 1.518 -0.267 0 C-N-CA 120.304 -0.558 . . . . 0.0 110.439 173.977 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 72.1 mttt -58.7 -32.81 69.5 Favored 'General case' 0 C--N 1.339 0.11 0 C-N-CA 120.46 -0.496 . . . . 0.0 109.714 178.849 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 24.9 t0 -76.33 -45.73 30.84 Favored 'General case' 0 N--CA 1.456 -0.151 0 C-N-CA 123.27 0.628 . . . . 0.0 111.05 176.292 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 3.8 mt -46.99 136.49 8.38 Favored 'General case' 0 N--CA 1.454 -0.231 0 C-N-CA 123.224 0.61 . . . . 0.0 112.073 -173.473 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.49 -13.0 60.26 Favored 'General case' 0 CA--C 1.53 0.205 0 CA-C-N 115.252 -0.886 . . . . 0.0 111.88 -174.621 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 22' ' ' SER . . . . . 0.467 ' C ' ' H ' ' A' ' 24' ' ' ILE . 67.3 m -120.96 -10.85 9.02 Favored 'General case' 0 CA--C 1.528 0.122 0 C-N-CA 123.692 0.797 . . . . 0.0 112.005 -178.397 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 74.39 -21.66 1.43 Allowed Glycine 0 CA--C 1.531 1.059 0 N-CA-C 111.344 -0.702 . . . . 0.0 111.344 -174.824 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . 0.467 ' H ' ' C ' ' A' ' 22' ' ' SER . 81.0 mt -94.19 154.22 3.34 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.136 0 C-N-CA 124.498 1.119 . . . . 0.0 109.604 174.301 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 30.3 t -168.44 107.38 0.49 Allowed 'General case' 0 CA--C 1.517 -0.306 0 CA-C-O 119.451 -0.309 . . . . 0.0 110.289 168.933 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -54.61 -39.57 67.13 Favored Glycine 0 CA--C 1.524 0.634 0 C-N-CA 120.091 -1.052 . . . . 0.0 110.618 179.924 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 29.0 t -63.08 -52.31 63.21 Favored 'General case' 0 N--CA 1.455 -0.193 0 CA-C-N 117.866 0.833 . . . . 0.0 110.745 -178.075 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 74.2 mmt-85 -68.17 -39.46 82.56 Favored 'General case' 0 C--O 1.231 0.129 0 O-C-N 122.103 -0.373 . . . . 0.0 110.265 -178.971 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 72.9 mt -61.01 -47.59 92.89 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.511 0 N-CA-C 109.595 -0.52 . . . . 0.0 109.595 178.789 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 51.2 mtmt -64.75 -28.97 69.94 Favored 'General case' 0 C--N 1.341 0.2 0 CA-C-O 119.289 -0.386 . . . . 0.0 111.151 -179.782 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . 0.415 ' CE ' ' HA ' ' A' ' 31' ' ' LYS . 4.6 mmpt? -65.63 -58.74 5.01 Favored 'General case' 0 C--O 1.231 0.085 0 CA-C-N 118.362 0.528 . . . . 0.0 110.839 179.547 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . 0.524 ' HB2' ' CE2' ' A' ' 10' ' ' PHE . 1.6 pp -72.21 -20.97 61.48 Favored 'General case' 0 CA--C 1.528 0.115 0 C-N-CA 118.967 -1.093 . . . . 0.0 111.249 -177.642 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 33' ' ' THR . . . . . 0.403 ' N ' HD11 ' A' ' 32' ' ' LEU . 55.2 m -72.51 -40.7 66.65 Favored 'General case' 0 N--CA 1.455 -0.215 0 N-CA-C 109.364 -0.606 . . . . 0.0 109.364 178.169 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 99.9 m -69.31 -38.29 78.17 Favored 'General case' 0 N--CA 1.451 -0.389 0 C-N-CA 121.008 -0.277 . . . . 0.0 110.392 -177.671 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 42.9 t80 -66.44 -34.33 77.7 Favored 'General case' 0 N--CA 1.455 -0.223 0 C-N-CA 119.821 -0.752 . . . . 0.0 110.047 176.547 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -71.49 -32.18 67.95 Favored 'General case' 0 N--CA 1.452 -0.347 0 CA-C-O 119.376 -0.345 . . . . 0.0 111.477 179.094 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -75.07 -34.1 61.77 Favored 'General case' 0 N--CA 1.457 -0.103 0 CA-C-N 118.129 0.422 . . . . 0.0 110.544 179.003 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 44.1 t0 -67.71 -22.74 65.24 Favored 'General case' 0 N--CA 1.455 -0.212 0 N-CA-C 110.403 -0.221 . . . . 0.0 110.403 175.86 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 98.1 m-70 -151.44 99.01 2.59 Favored 'General case' 0 C--N 1.342 0.263 0 C-N-CA 122.871 0.468 . . . . 0.0 111.461 -175.157 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 40' ' ' ILE . . . . . 0.452 HD11 ' H ' ' A' ' 40' ' ' ILE . 0.0 OUTLIER -75.91 -14.59 15.2 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.322 0 CA-C-O 119.268 -0.396 . . . . 0.0 110.478 175.14 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 89.4 m-20 -58.58 -16.88 17.76 Favored 'General case' 0 CA--C 1.531 0.232 0 N-CA-C 112.723 0.638 . . . . 0.0 112.723 -178.204 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -106.71 13.19 8.33 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.159 0 C-N-CA 122.803 0.441 . . . . 0.0 111.859 177.473 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 3.0 pp20? -52.49 -30.07 28.24 Favored 'General case' 0 CA--C 1.527 0.085 0 O-C-N 121.755 -0.591 . . . . 0.0 111.557 177.532 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 40.3 t -62.4 -48.19 80.79 Favored 'General case' 0 CA--C 1.53 0.209 0 N-CA-C 112.299 0.481 . . . . 0.0 112.299 -179.326 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . 0.547 ' HZ2' ' HB2' ' A' ' 7' ' ' PHE . 18.2 ptpt -71.93 -25.58 61.95 Favored 'General case' 0 C--N 1.339 0.139 0 N-CA-C 109.494 -0.558 . . . . 0.0 109.494 179.32 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 46' ' ' ILE . . . . . 0.465 HG12 ' CZ ' ' A' ' 10' ' ' PHE . 88.7 mt -71.01 -50.38 42.93 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.297 0 C-N-CA 122.798 0.439 . . . . 0.0 110.064 -178.96 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 35.5 mm -63.75 -35.03 71.58 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.169 0 N-CA-C 109.402 -0.592 . . . . 0.0 109.402 179.237 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 50.1 m -63.68 -39.4 94.22 Favored 'General case' 0 N--CA 1.452 -0.332 0 O-C-N 122.429 -0.17 . . . . 0.0 111.073 -179.192 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -78.46 -30.58 47.5 Favored 'General case' 0 N--CA 1.456 -0.163 0 N-CA-C 113.465 0.913 . . . . 0.0 113.465 -178.728 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 13.5 pt -70.15 -40.32 78.08 Favored 'Isoleucine or valine' 0 C--N 1.34 0.161 0 CA-C-N 119.963 1.256 . . . . 0.0 110.259 177.994 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 22.1 pt -69.11 -39.91 80.01 Favored 'Isoleucine or valine' 0 C--N 1.338 0.103 0 C-N-CA 120.138 -0.625 . . . . 0.0 110.315 179.584 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 44.4 t0 -65.42 -49.34 69.58 Favored 'General case' 0 N--CA 1.456 -0.174 0 CA-C-N 117.906 0.321 . . . . 0.0 110.841 178.492 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 44.5 t80 -62.74 -43.22 99.36 Favored 'General case' 0 N--CA 1.453 -0.31 0 N-CA-C 109.538 -0.542 . . . . 0.0 109.538 179.671 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 34.7 t -62.49 -30.83 71.55 Favored 'General case' 0 N--CA 1.454 -0.237 0 CA-C-N 118.175 0.443 . . . . 0.0 111.492 -177.786 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 7.1 tpt180 -81.34 -44.53 17.49 Favored 'General case' 0 N--CA 1.454 -0.25 0 CA-C-N 118.126 0.421 . . . . 0.0 111.271 -178.942 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 95.0 mt -77.37 -47.51 19.69 Favored 'General case' 0 N--CA 1.456 -0.146 0 N-CA-C 114.032 1.123 . . . . 0.0 114.032 -175.56 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 57' ' ' CYS . . . . . 0.423 ' O ' ' HE2' ' A' ' 62' ' ' LYS . 13.5 p -61.39 158.46 38.09 Favored Pre-proline 0 CA--C 1.536 0.408 0 N-CA-C 113.957 1.095 . . . . 0.0 113.957 -169.718 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 31.7 Cg_exo -59.12 174.05 1.09 Allowed 'Trans proline' 0 N--CA 1.455 -0.774 1 C-N-CA 125.801 4.334 . . . . 0.0 113.439 176.442 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 27.3 p30 -58.48 -47.75 83.06 Favored 'General case' 0 CA--C 1.531 0.225 0 CA-C-N 115.179 -0.919 . . . . 0.0 112.624 -173.695 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 34.3 m -70.66 -29.77 66.2 Favored 'General case' 0 N--CA 1.453 -0.299 0 CA-C-O 120.927 0.394 . . . . 0.0 110.18 -179.0 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 62.9 m80 -75.34 -27.16 59.1 Favored 'General case' 0 N--CA 1.45 -0.468 0 C-N-CA 122.812 0.445 . . . . 0.0 110.313 177.701 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . 0.423 ' HE2' ' O ' ' A' ' 57' ' ' CYS . 64.1 mttm -67.79 -37.46 82.05 Favored 'General case' 0 N--CA 1.457 -0.084 0 N-CA-C 109.668 -0.493 . . . . 0.0 109.668 171.613 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -62.79 -42.84 99.88 Favored 'General case' 0 CA--C 1.53 0.199 0 N-CA-C 108.045 -1.095 . . . . 0.0 108.045 173.341 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -66.83 -30.99 76.99 Favored Glycine 0 C--N 1.34 0.75 0 N-CA-C 111.811 -0.515 . . . . 0.0 111.811 -179.423 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 30.0 t -68.62 -40.45 80.37 Favored 'General case' 0 N--CA 1.45 -0.443 0 CA-C-N 117.665 0.732 . . . . 0.0 109.884 178.317 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 77.0 mt -70.99 -24.12 62.32 Favored 'General case' 0 N--CA 1.45 -0.438 0 N-CA-C 109.767 -0.457 . . . . 0.0 109.767 178.922 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -73.49 -38.85 65.25 Favored 'General case' 0 N--CA 1.456 -0.169 0 C-N-CA 122.822 0.449 . . . . 0.0 110.698 174.765 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 68' ' ' ILE . . . . . . . . . . . . . 19.6 mt -65.59 -51.06 67.61 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.295 0 N-CA-C 108.594 -0.891 . . . . 0.0 108.594 175.211 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 86.0 mt -55.89 -32.01 31.63 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.303 0 C-N-CA 123.662 0.785 . . . . 0.0 111.4 176.588 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 15.0 t70 -69.31 -51.41 37.43 Favored 'General case' 0 N--CA 1.454 -0.264 0 O-C-N 121.757 -0.589 . . . . 0.0 111.157 178.757 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 90.2 p -67.64 -48.06 67.79 Favored 'General case' 0 N--CA 1.452 -0.368 0 O-C-N 122.987 0.18 . . . . 0.0 111.059 -175.128 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -75.72 -34.79 29.32 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.168 0 N-CA-C 109.818 -0.438 . . . . 0.0 109.818 -179.672 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -67.82 -48.21 56.48 Favored Glycine 0 C--N 1.336 0.569 0 N-CA-C 110.811 -0.916 . . . . 0.0 110.811 -176.376 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 39.5 mtm180 -68.41 -42.9 78.33 Favored 'General case' 0 N--CA 1.448 -0.526 0 CA-C-N 117.408 0.604 . . . . 0.0 109.899 178.394 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -62.38 -31.31 71.96 Favored 'General case' 0 N--CA 1.449 -0.498 0 C-N-CA 120.302 -0.559 . . . . 0.0 110.498 -178.462 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 1.9 m-30 -70.86 -51.97 23.14 Favored 'General case' 0 N--CA 1.456 -0.169 0 CA-C-N 118.46 0.573 . . . . 0.0 110.934 176.413 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 43.6 tp -68.34 -36.92 79.96 Favored 'General case' 0 N--CA 1.449 -0.493 0 C-N-CA 118.212 -1.395 . . . . 0.0 110.092 -176.952 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 83.8 m-20 -64.89 -45.41 86.07 Favored 'General case' 0 N--CA 1.454 -0.274 0 CA-C-O 119.645 -0.217 . . . . 0.0 111.507 179.052 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 16.0 tm-20 -64.92 -49.04 71.95 Favored 'General case' 0 N--CA 1.446 -0.661 0 CA-C-N 118.17 0.441 . . . . 0.0 111.575 179.378 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 79.9 p -68.32 -25.45 65.12 Favored 'General case' 0 CA--C 1.531 0.243 0 CA-C-N 117.933 0.333 . . . . 0.0 110.577 -178.538 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 37.3 ttp-105 -74.73 -30.7 61.6 Favored 'General case' 0 CA--C 1.53 0.2 0 C-N-CA 122.813 0.445 . . . . 0.0 111.42 173.023 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 58.0 m . . . . . 0 N--CA 1.458 -0.063 0 N-CA-C 112.65 0.611 . . . . 0.0 112.65 -175.839 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 55.4 Cg_endo . . . . . 0 N--CA 1.454 -0.833 0 N-CA-C 108.352 -1.441 . . . . 0.0 108.352 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 95.76 15.53 42.51 Favored Glycine 0 CA--C 1.524 0.645 0 CA-C-O 119.464 -0.631 . . . . 0.0 112.314 -177.165 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 42.0 p -150.33 168.65 23.47 Favored 'General case' 0 C--N 1.34 0.157 0 CA-C-N 118.446 1.123 . . . . 0.0 111.436 177.825 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 94' ' ' CYS . . . . . 0.435 ' SG ' HD13 ' A' ' 98' ' ' ILE . 7.5 t -54.96 -28.12 48.99 Favored 'General case' 0 N--CA 1.449 -0.48 0 CA-C-N 115.021 -0.991 . . . . 0.0 109.653 173.262 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -57.84 -57.32 13.29 Favored 'General case' 0 N--CA 1.445 -0.71 0 N-CA-C 109.244 -0.65 . . . . 0.0 109.244 -178.324 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 61.0 t60 -75.64 -31.69 59.93 Favored 'General case' 0 N--CA 1.452 -0.35 0 C-N-CA 121.103 -0.239 . . . . 0.0 111.598 -179.193 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -67.4 -48.69 66.62 Favored 'General case' 0 N--CA 1.451 -0.422 0 O-C-N 122.92 0.138 . . . . 0.0 111.039 -177.255 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 98' ' ' ILE . . . . . 0.435 HD13 ' SG ' ' A' ' 94' ' ' CYS . 1.7 mp -73.69 -30.74 29.85 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.208 0 N-CA-C 109.903 -0.406 . . . . 0.0 109.903 179.998 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 3.5 m120 -64.68 -47.93 76.58 Favored 'General case' 0 N--CA 1.457 -0.09 0 CA-C-N 118.423 0.556 . . . . 0.0 110.942 175.104 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 47.5 m -72.39 -25.96 61.7 Favored 'General case' 0 N--CA 1.456 -0.157 0 C-N-CA 122.334 0.254 . . . . 0.0 110.563 -175.259 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 57.5 tp -80.33 -37.5 32.42 Favored 'General case' 0 N--CA 1.447 -0.595 0 C-N-CA 122.794 0.438 . . . . 0.0 110.867 178.876 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -75.02 -24.84 70.61 Favored Glycine 0 CA--C 1.527 0.809 0 CA-C-O 119.485 -0.619 . . . . 0.0 112.74 -175.954 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 24.1 pt-20 -78.14 -2.48 37.71 Favored 'General case' 0 CA--C 1.532 0.27 0 CA-C-N 117.98 0.89 . . . . 0.0 111.604 -179.928 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 36.0 m -138.47 9.56 0.69 Allowed 'Isoleucine or valine' 0 CA--C 1.529 0.167 0 N-CA-C 111.996 0.369 . . . . 0.0 111.996 176.288 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 105' ' ' ILE . . . . . . . . . . . . . 11.2 tp -62.28 -26.18 39.63 Favored 'Isoleucine or valine' 0 N--CA 1.458 -0.065 0 CA-C-N 118.697 0.681 . . . . 0.0 111.408 -175.367 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 10.2 pt20 -67.9 -28.47 67.53 Favored 'General case' 0 N--CA 1.453 -0.287 0 N-CA-C 110.154 -0.313 . . . . 0.0 110.154 178.617 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 74.6 mm-40 -75.55 -42.8 51.45 Favored 'General case' 0 N--CA 1.453 -0.283 0 N-CA-C 110.007 -0.368 . . . . 0.0 110.007 -178.017 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 7.3 mp -69.83 -43.77 71.3 Favored 'General case' 0 N--CA 1.448 -0.525 0 N-CA-C 109.703 -0.48 . . . . 0.0 109.703 -179.119 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 96.2 mt -66.72 -64.14 0.92 Allowed 'General case' 0 N--CA 1.452 -0.348 0 C-N-CA 120.592 -0.443 . . . . 0.0 110.261 178.788 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 21.1 t -50.86 -39.82 54.69 Favored 'General case' 0 C--O 1.233 0.199 0 N-CA-C 112.535 0.569 . . . . 0.0 112.535 -173.593 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 49.7 t0 -68.4 -43.8 76.44 Favored 'General case' 0 N--CA 1.456 -0.146 0 N-CA-C 110.206 -0.294 . . . . 0.0 110.206 178.914 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -69.21 -34.68 75.26 Favored 'General case' 0 N--CA 1.448 -0.569 0 CA-C-N 116.836 -0.166 . . . . 0.0 110.744 -178.137 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 113' ' ' ILE . . . . . . . . . . . . . 46.7 mm -66.96 -36.06 76.23 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.333 0 N-CA-C 109.334 -0.617 . . . . 0.0 109.334 179.204 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -74.81 -42.28 58.34 Favored 'General case' 0 N--CA 1.453 -0.31 0 N-CA-C 111.828 0.307 . . . . 0.0 111.828 178.03 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 115' ' ' LYS . . . . . 0.552 ' HB2' ' HZ3' ' A' ' 115' ' ' LYS . 0.0 OUTLIER -78.14 -35.73 48.61 Favored 'General case' 0 N--CA 1.456 -0.163 0 N-CA-C 112.514 0.561 . . . . 0.0 112.514 -174.964 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 116' ' ' SER . . . . . 0.474 ' HB2' ' CB ' ' A' ' 120' ' ' HIS . 54.3 p -81.84 157.13 24.53 Favored 'General case' 0 N--CA 1.456 -0.172 0 N-CA-C 112.892 0.701 . . . . 0.0 112.892 -171.15 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 53.1 t30 -77.03 166.35 23.43 Favored 'General case' 0 C--O 1.226 -0.146 0 C-N-CA 123.203 0.601 . . . . 0.0 110.564 -178.563 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 118' ' ' GLN . . . . . . . . . . . . . 12.8 mt-30 -54.71 -36.54 64.83 Favored 'General case' 0 CA--C 1.531 0.221 0 N-CA-C 112.649 0.611 . . . . 0.0 112.649 -172.663 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 11.2 p-10 -70.99 -39.12 72.65 Favored 'General case' 0 C--O 1.226 -0.144 0 CA-C-O 121.099 0.476 . . . . 0.0 109.877 178.767 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 120' ' ' HIS . . . . . 0.474 ' CB ' ' HB2' ' A' ' 116' ' ' SER . 36.9 m170 -64.74 -38.89 92.53 Favored 'General case' 0 N--CA 1.45 -0.43 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.223 176.473 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 46.2 mttm -58.95 -43.4 91.23 Favored 'General case' 0 C--N 1.342 0.274 0 N-CA-C 108.719 -0.845 . . . . 0.0 108.719 177.196 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 41.6 tp10 -66.34 -38.73 88.3 Favored 'General case' 0 N--CA 1.454 -0.25 0 CA-C-O 119.459 -0.305 . . . . 0.0 111.358 -176.982 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 53.2 mtpt -65.74 -28.88 69.36 Favored 'General case' 0 N--CA 1.452 -0.341 0 CA-C-N 118.511 0.596 . . . . 0.0 110.225 177.729 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 124' ' ' ILE . . . . . . . . . . . . . 61.6 mt -74.44 -37.18 44.03 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.24 0 N-CA-C 109.544 -0.539 . . . . 0.0 109.544 176.822 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 55.8 mmm-85 -65.53 -42.81 91.57 Favored 'General case' 0 C--O 1.23 0.076 0 O-C-N 122.215 -0.303 . . . . 0.0 110.969 179.851 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 126' ' ' MET . . . . . . . . . . . . . 28.6 ptm -67.57 -29.54 68.93 Favored 'General case' 0 N--CA 1.454 -0.273 0 C-N-CA 119.747 -0.781 . . . . 0.0 109.237 176.563 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 1.7 mp -63.15 -29.61 70.93 Favored 'General case' 0 N--CA 1.455 -0.208 0 CA-C-O 118.993 -0.527 . . . . 0.0 110.29 172.849 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 76.0 mt -69.16 -43.2 74.76 Favored 'General case' 0 C--N 1.34 0.163 0 CA-C-N 119.23 0.923 . . . . 0.0 109.935 175.691 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 67.0 m-20 -60.17 -39.37 86.2 Favored 'General case' 0 N--CA 1.463 0.18 0 CA-C-N 118.331 0.514 . . . . 0.0 110.041 176.514 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 62.7 mt -66.15 -36.66 77.96 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.401 0 C-N-CA 122.911 0.484 . . . . 0.0 110.063 179.118 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 131' ' ' TRP . . . . . . . . . . . . . 49.4 m0 . . . . . 0 N--CA 1.455 -0.197 0 N-CA-C 112.56 0.578 . . . . 0.0 112.56 177.9 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 36.2 p-10 . . . . . 0 N--CA 1.453 -0.283 0 N-CA-C 108.788 -0.819 . . . . 0.0 108.788 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 7' ' ' PHE . . . . . 0.517 ' CE1' ' HD3' ' A' ' 45' ' ' LYS . 1.6 t80 -51.12 -37.31 45.3 Favored 'General case' 0 N--CA 1.448 -0.54 0 C-N-CA 124.375 1.07 . . . . 0.0 110.71 177.36 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 51.1 tp60 -53.64 -34.64 59.26 Favored 'General case' 0 N--CA 1.454 -0.268 0 C-N-CA 123.281 0.632 . . . . 0.0 111.579 -178.515 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 32.0 m-80 -72.49 -31.46 65.39 Favored 'General case' 0 N--CA 1.448 -0.528 0 N-CA-C 109.992 -0.373 . . . . 0.0 109.992 -179.587 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 10' ' ' PHE . . . . . 0.45 ' CE2' ' HB2' ' A' ' 32' ' ' LEU . 13.0 t80 -69.44 -40.94 76.89 Favored 'General case' 0 N--CA 1.449 -0.519 0 N-CA-C 108.986 -0.746 . . . . 0.0 108.986 175.412 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 62.6 t -64.35 -53.62 40.86 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.23 0 N-CA-C 108.657 -0.868 . . . . 0.0 108.657 179.467 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -59.84 -26.88 66.17 Favored 'General case' 0 N--CA 1.453 -0.279 0 C-N-CA 122.597 0.359 . . . . 0.0 111.808 179.534 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 91.2 m -74.25 -39.46 63.02 Favored 'General case' 0 CA--C 1.529 0.166 0 N-CA-C 109.077 -0.712 . . . . 0.0 109.077 176.703 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . 0.487 ' HA ' ' CD1' ' A' ' 17' ' ' PHE . 10.9 tp -64.42 -45.31 88.09 Favored 'General case' 0 N--CA 1.452 -0.367 0 CA-C-O 121.374 0.607 . . . . 0.0 109.371 177.402 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 68.6 mm-40 -63.85 -28.28 69.74 Favored 'General case' 0 N--CA 1.453 -0.312 0 C-N-CA 124.069 0.948 . . . . 0.0 110.005 178.393 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 74.5 m -70.62 -28.19 64.66 Favored 'General case' 0 N--CA 1.453 -0.325 0 N-CA-C 109.616 -0.513 . . . . 0.0 109.616 177.281 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 17' ' ' PHE . . . . . 0.487 ' CD1' ' HA ' ' A' ' 14' ' ' LEU . 16.6 m-85 -69.74 -40.94 75.87 Favored 'General case' 0 N--CA 1.454 -0.243 0 C-N-CA 119.648 -0.821 . . . . 0.0 110.267 171.554 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 81.0 mttt -61.96 -28.51 69.6 Favored 'General case' 0 C--N 1.34 0.18 0 CA-C-O 120.617 0.246 . . . . 0.0 110.691 -178.575 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 46.3 t0 -71.42 -27.12 63.07 Favored 'General case' 0 CA--C 1.532 0.281 0 CA-C-N 115.826 -0.625 . . . . 0.0 112.192 -179.407 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 97.4 mt -74.02 152.92 39.89 Favored 'General case' 0 N--CA 1.455 -0.176 0 O-C-N 122.055 -0.403 . . . . 0.0 110.78 -177.563 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . 0.476 ' HE3' ' CA ' ' A' ' 21' ' ' LYS . 0.0 OUTLIER -77.13 -30.89 55.35 Favored 'General case' 0 C--N 1.339 0.135 0 N-CA-C 110.261 -0.274 . . . . 0.0 110.261 176.3 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 22' ' ' SER . . . . . 0.4 ' C ' ' H ' ' A' ' 24' ' ' ILE . 99.0 p -88.33 -22.47 23.82 Favored 'General case' 0 N--CA 1.457 -0.114 0 C-N-CA 122.983 0.513 . . . . 0.0 110.931 179.568 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 73.08 -22.04 0.98 Allowed Glycine 0 CA--C 1.527 0.801 0 C-N-CA 123.532 0.586 . . . . 0.0 112.752 178.919 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . 0.4 ' H ' ' C ' ' A' ' 22' ' ' SER . 53.5 mt -78.93 149.38 5.57 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.212 0 N-CA-C 108.775 -0.824 . . . . 0.0 108.775 172.137 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 47.7 t -157.61 83.0 0.89 Allowed 'General case' 0 CA--C 1.517 -0.311 0 N-CA-C 110.146 -0.316 . . . . 0.0 110.146 177.355 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . 0.475 ' O ' ' HE2' ' A' ' 30' ' ' LYS . . . -48.58 -33.85 13.03 Favored Glycine 0 CA--C 1.526 0.741 0 N-CA-C 110.826 -0.91 . . . . 0.0 110.826 -178.89 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 4.7 t -67.76 -61.59 1.81 Allowed 'General case' 0 N--CA 1.452 -0.347 0 CA-C-N 117.407 0.604 . . . . 0.0 111.331 -178.084 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -72.68 -25.85 61.4 Favored 'General case' 0 N--CA 1.454 -0.256 0 CA-C-O 119.424 -0.322 . . . . 0.0 110.749 -175.615 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 56.7 mt -61.12 -46.51 96.49 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.332 0 N-CA-C 108.292 -1.003 . . . . 0.0 108.292 173.713 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . 0.475 ' HE2' ' O ' ' A' ' 26' ' ' GLY . 51.2 mtmt -64.74 -31.16 72.26 Favored 'General case' 0 C--N 1.34 0.154 0 CA-C-N 118.155 0.434 . . . . 0.0 111.258 178.268 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . 0.476 ' HE2' ' HA ' ' A' ' 31' ' ' LYS . 6.2 mmpt? -63.85 -59.93 3.92 Favored 'General case' 0 C--N 1.338 0.098 0 CA-C-O 119.215 -0.421 . . . . 0.0 111.61 -178.811 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . 0.45 ' HB2' ' CE2' ' A' ' 10' ' ' PHE . 1.2 pp -75.51 -16.71 60.26 Favored 'General case' 0 CA--C 1.534 0.343 0 C-N-CA 119.539 -0.865 . . . . 0.0 111.942 -178.182 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 43.5 m -72.47 -38.36 68.23 Favored 'General case' 0 C--N 1.341 0.216 0 N-CA-C 108.656 -0.868 . . . . 0.0 108.656 174.58 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 80.4 m -70.03 -36.5 75.1 Favored 'General case' 0 N--CA 1.452 -0.371 0 N-CA-C 110.168 -0.308 . . . . 0.0 110.168 179.575 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 31.5 t80 -64.8 -36.11 83.26 Favored 'General case' 0 N--CA 1.456 -0.154 0 N-CA-C 109.791 -0.448 . . . . 0.0 109.791 176.045 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -71.36 -35.46 71.12 Favored 'General case' 0 N--CA 1.45 -0.451 0 CA-C-O 119.648 -0.215 . . . . 0.0 111.422 179.253 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 2.3 mm? -69.56 -32.37 71.12 Favored 'General case' 0 N--CA 1.455 -0.182 0 CA-C-O 119.74 -0.172 . . . . 0.0 110.578 179.858 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 40.2 t0 -69.44 -22.87 63.62 Favored 'General case' 0 N--CA 1.454 -0.246 0 O-C-N 122.9 0.125 . . . . 0.0 110.745 176.283 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 77.8 m80 -150.65 101.8 2.96 Favored 'General case' 0 N--CA 1.453 -0.305 0 N-CA-C 112.583 0.586 . . . . 0.0 112.583 -174.931 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 40' ' ' ILE . . . . . 0.546 HD11 ' H ' ' A' ' 40' ' ' ILE . 0.0 OUTLIER -74.56 -9.54 12.96 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.247 0 N-CA-C 109.701 -0.481 . . . . 0.0 109.701 170.865 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 34.0 m-20 -56.72 -17.64 9.69 Favored 'General case' 0 N--CA 1.457 -0.08 0 C-N-CA 124.3 1.04 . . . . 0.0 112.541 -178.92 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -120.08 17.96 6.37 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.267 0 C-N-CA 123.825 0.85 . . . . 0.0 111.461 -178.435 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 2.9 pp20? -52.64 -32.88 44.18 Favored 'General case' 0 CA--C 1.532 0.254 0 O-C-N 121.823 -0.548 . . . . 0.0 111.103 178.159 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 40.3 t -61.16 -46.66 89.6 Favored 'General case' 0 CA--C 1.531 0.242 0 N-CA-C 112.318 0.488 . . . . 0.0 112.318 -178.958 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . 0.517 ' HD3' ' CE1' ' A' ' 7' ' ' PHE . 19.1 ptpt -73.84 -24.13 59.73 Favored 'General case' 0 C--N 1.343 0.299 0 O-C-N 121.577 -0.702 . . . . 0.0 110.153 179.897 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 64.1 mt -71.65 -48.98 49.22 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.278 0 N-CA-C 109.733 -0.469 . . . . 0.0 109.733 -179.676 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 39.4 mm -63.76 -35.93 74.8 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.237 0 N-CA-C 109.626 -0.509 . . . . 0.0 109.626 178.28 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 40.3 t -63.78 -43.48 96.24 Favored 'General case' 0 N--CA 1.455 -0.18 0 O-C-N 122.263 -0.273 . . . . 0.0 111.626 -178.985 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 33.3 mt -75.43 -33.22 60.89 Favored 'General case' 0 N--CA 1.449 -0.498 0 N-CA-C 113.23 0.826 . . . . 0.0 113.23 -176.286 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 5.1 pt -72.65 -43.97 61.03 Favored 'Isoleucine or valine' 0 C--O 1.23 0.075 0 CA-C-N 119.284 0.947 . . . . 0.0 110.787 179.702 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 21.3 pt -62.21 -40.29 87.13 Favored 'Isoleucine or valine' 0 C--N 1.339 0.145 0 C-N-CA 119.628 -0.829 . . . . 0.0 109.962 178.366 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 94.0 m-20 -70.8 -33.62 70.91 Favored 'General case' 0 N--CA 1.455 -0.18 0 CA-C-N 118.061 0.392 . . . . 0.0 111.78 177.787 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 53' ' ' TYR . . . . . 0.471 ' CD2' ' HB2' ' A' ' 65' ' ' SER . 20.8 t80 -67.67 -34.26 76.57 Favored 'General case' 0 N--CA 1.454 -0.248 0 CA-C-N 118.535 0.607 . . . . 0.0 109.667 177.017 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 35.6 t -81.76 -18.26 44.84 Favored 'General case' 0 C--N 1.338 0.075 0 N-CA-C 111.882 0.327 . . . . 0.0 111.882 178.011 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 32.0 ttp180 -93.89 -42.86 8.86 Favored 'General case' 0 N--CA 1.453 -0.314 0 N-CA-C 112.797 0.666 . . . . 0.0 112.797 -178.19 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 41.8 mt -86.3 -49.37 7.72 Favored 'General case' 0 C--N 1.338 0.093 0 N-CA-C 113.407 0.892 . . . . 0.0 113.407 -175.222 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 57' ' ' CYS . . . . . 0.403 ' HB3' ' CD ' ' A' ' 58' ' ' PRO . 84.2 m -72.34 166.72 39.01 Favored Pre-proline 0 CA--C 1.533 0.326 0 N-CA-C 113.248 0.832 . . . . 0.0 113.248 -170.996 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 58' ' ' PRO . . . . . 0.403 ' CD ' ' HB3' ' A' ' 57' ' ' CYS . 35.6 Cg_exo -61.38 166.46 11.22 Favored 'Trans proline' 0 N--CA 1.453 -0.909 1 C-N-CA 125.816 4.344 . . . . 0.0 113.404 -175.178 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 59' ' ' ASP . . . . . 0.414 ' HB2' ' HA ' ' A' ' 116' ' ' SER . 31.8 p-10 -53.86 -44.66 70.56 Favored 'General case' 0 C--N 1.329 -0.314 0 C-N-CA 125.146 1.378 . . . . 0.0 113.618 -171.328 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 9.3 t -71.73 -29.13 64.19 Favored 'General case' 0 N--CA 1.452 -0.354 0 O-C-N 122.049 -0.407 . . . . 0.0 110.151 -179.623 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 52.8 m80 -75.82 -29.47 58.68 Favored 'General case' 0 N--CA 1.452 -0.361 0 C-N-CA 122.692 0.397 . . . . 0.0 109.965 176.104 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 59.1 mttm -61.93 -41.81 98.38 Favored 'General case' 0 C--N 1.341 0.197 0 N-CA-C 109.559 -0.534 . . . . 0.0 109.559 173.164 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 3.0 tm? -63.03 -45.5 92.0 Favored 'General case' 0 N--CA 1.455 -0.222 0 N-CA-C 109.024 -0.732 . . . . 0.0 109.024 177.227 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -61.53 -27.17 67.55 Favored Glycine 0 C--N 1.339 0.729 0 N-CA-C 112.108 -0.397 . . . . 0.0 112.108 -178.95 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 65' ' ' SER . . . . . 0.471 ' HB2' ' CD2' ' A' ' 53' ' ' TYR . 30.1 t -74.66 -39.02 62.29 Favored 'General case' 0 N--CA 1.451 -0.397 0 CA-C-N 117.694 0.747 . . . . 0.0 110.561 176.795 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 82.9 mt -66.21 -23.49 66.44 Favored 'General case' 0 N--CA 1.452 -0.365 0 N-CA-C 109.721 -0.474 . . . . 0.0 109.721 177.546 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 2.3 m-30 -73.69 -39.33 64.44 Favored 'General case' 0 C--O 1.233 0.226 0 C-N-CA 122.397 0.279 . . . . 0.0 110.428 173.926 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 68' ' ' ILE . . . . . 0.424 HD13 ' CE1' ' A' ' 17' ' ' PHE . 31.5 mt -64.88 -51.19 70.0 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.543 0 N-CA-C 107.51 -1.293 . . . . 0.0 107.51 177.055 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 43.5 mt -50.26 -36.84 13.45 Favored 'Isoleucine or valine' 0 CA--C 1.528 0.133 0 C-N-CA 124.21 1.004 . . . . 0.0 111.778 174.828 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 16.6 t70 -69.87 -53.86 16.1 Favored 'General case' 0 N--CA 1.455 -0.193 0 CA-C-N 118.774 0.715 . . . . 0.0 111.116 180.0 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 79.2 p -67.89 -46.72 70.83 Favored 'General case' 0 N--CA 1.451 -0.42 0 CA-C-N 116.717 -0.22 . . . . 0.0 110.772 -174.96 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -74.84 -35.03 35.1 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.133 0 N-CA-C 109.359 -0.608 . . . . 0.0 109.359 -179.172 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -65.82 -50.76 51.41 Favored Glycine 0 C--N 1.339 0.724 0 N-CA-C 111.58 -0.608 . . . . 0.0 111.58 -175.836 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 41.7 mtm105 -69.73 -38.56 76.91 Favored 'General case' 0 N--CA 1.451 -0.4 0 CA-C-N 117.267 0.533 . . . . 0.0 110.227 179.061 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -66.57 -32.68 74.17 Favored 'General case' 0 N--CA 1.451 -0.391 0 C-N-CA 120.714 -0.395 . . . . 0.0 110.743 -179.101 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 1.0 OUTLIER -68.72 -43.52 75.79 Favored 'General case' 0 CA--C 1.518 -0.28 0 CA-C-N 118.527 0.603 . . . . 0.0 110.297 176.091 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 3.0 tm? -64.89 -47.72 76.81 Favored 'General case' 0 N--CA 1.448 -0.534 0 C-N-CA 118.359 -1.336 . . . . 0.0 108.049 178.978 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 46.9 m-20 -58.25 -43.65 87.95 Favored 'General case' 0 C--O 1.23 0.065 0 N-CA-C 112.38 0.511 . . . . 0.0 112.38 -178.063 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 10.4 tm-20 -63.96 -45.06 90.78 Favored 'General case' 0 N--CA 1.447 -0.583 0 CA-C-N 118.186 0.448 . . . . 0.0 110.623 -177.81 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 61.2 p -69.8 -37.62 76.37 Favored 'General case' 0 N--CA 1.453 -0.321 0 CA-C-O 118.927 -0.559 . . . . 0.0 111.1 -177.136 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 7.4 ppt_? -75.85 -16.55 60.05 Favored 'General case' 0 C--N 1.341 0.211 0 CA-C-N 118.823 0.738 . . . . 0.0 111.627 178.05 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 36.9 m . . . . . 0 N--CA 1.456 -0.145 0 N-CA-C 112.353 0.501 . . . . 0.0 112.353 179.132 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_endo . . . . . 0 N--CA 1.453 -0.875 0 N-CA-C 110.384 -0.66 . . . . 0.0 110.384 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 96.04 17.29 35.41 Favored Glycine 0 CA--C 1.523 0.586 0 CA-C-O 119.363 -0.687 . . . . 0.0 112.908 177.071 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 35.2 p -151.77 169.24 22.7 Favored 'General case' 0 CA--C 1.518 -0.266 0 C-N-CA 123.907 0.883 . . . . 0.0 109.227 175.974 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 94' ' ' CYS . . . . . . . . . . . . . 1.8 p -67.16 -16.95 64.63 Favored 'General case' 0 N--CA 1.447 -0.612 0 N-CA-C 109.692 -0.485 . . . . 0.0 109.692 178.599 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -62.91 -57.24 11.46 Favored 'General case' 0 N--CA 1.449 -0.5 0 N-CA-C 109.833 -0.432 . . . . 0.0 109.833 -177.104 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 72.9 t60 -72.39 -31.25 65.4 Favored 'General case' 0 N--CA 1.451 -0.408 0 N-CA-C 110.208 -0.293 . . . . 0.0 110.208 179.243 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -65.67 -56.56 11.5 Favored 'General case' 0 N--CA 1.451 -0.417 0 O-C-N 123.274 0.359 . . . . 0.0 111.517 -178.32 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 2.1 mp -67.72 -34.62 68.95 Favored 'Isoleucine or valine' 0 C--N 1.34 0.195 0 C-N-CA 120.494 -0.483 . . . . 0.0 110.456 -179.13 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 69.2 m-20 -66.71 -45.1 79.82 Favored 'General case' 0 N--CA 1.45 -0.448 0 CA-C-N 118.157 0.435 . . . . 0.0 111.509 179.534 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 98.3 m -69.12 -29.62 67.72 Favored 'General case' 0 C--N 1.338 0.088 0 CA-C-N 117.976 0.353 . . . . 0.0 110.455 -177.227 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 62.2 tp -74.11 -33.98 63.77 Favored 'General case' 0 N--CA 1.447 -0.607 0 C-N-CA 122.758 0.423 . . . . 0.0 110.431 179.558 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -67.59 -17.4 68.86 Favored Glycine 0 CA--C 1.526 0.774 0 CA-C-O 119.636 -0.536 . . . . 0.0 112.845 -177.232 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 25.5 mt-10 -79.5 -25.93 41.7 Favored 'General case' 0 C--N 1.338 0.096 0 CA-C-N 118.004 0.902 . . . . 0.0 111.316 -179.696 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 25.3 m -116.92 -6.67 11.91 Favored 'Isoleucine or valine' 0 C--O 1.23 0.061 0 N-CA-C 112.924 0.713 . . . . 0.0 112.924 -174.687 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 105' ' ' ILE . . . . . . . . . . . . . 17.5 tt -60.09 -23.07 26.17 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.25 0 CA-C-N 118.979 0.809 . . . . 0.0 111.635 -179.694 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 25.7 pt20 -61.6 -35.0 76.62 Favored 'General case' 0 N--CA 1.45 -0.447 0 C-N-CA 122.867 0.467 . . . . 0.0 110.19 175.906 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 49.2 mt-10 -71.95 -40.88 68.39 Favored 'General case' 0 N--CA 1.454 -0.232 0 N-CA-C 109.454 -0.573 . . . . 0.0 109.454 -179.828 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 20.2 mt -73.0 -40.87 64.84 Favored 'General case' 0 N--CA 1.449 -0.512 0 CA-C-N 115.899 -0.592 . . . . 0.0 110.706 -173.283 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 84.7 mt -68.56 -63.17 1.11 Allowed 'General case' 0 N--CA 1.448 -0.539 0 N-CA-C 109.626 -0.509 . . . . 0.0 109.626 178.517 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 24.4 p -46.0 -48.37 16.63 Favored 'General case' 0 CA--C 1.52 -0.183 0 C-N-CA 122.613 0.365 . . . . 0.0 111.976 -177.329 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 39.3 t0 -70.66 -35.99 73.14 Favored 'General case' 0 N--CA 1.447 -0.579 0 CA-C-N 116.882 -0.144 . . . . 0.0 110.977 -176.148 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -72.88 -31.54 64.77 Favored 'General case' 0 N--CA 1.448 -0.528 0 C-N-CA 120.882 -0.327 . . . . 0.0 110.735 -178.487 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 113' ' ' ILE . . . . . . . . . . . . . 45.4 mm -68.33 -40.86 83.12 Favored 'Isoleucine or valine' 0 C--N 1.339 0.111 0 N-CA-C 108.892 -0.781 . . . . 0.0 108.892 176.316 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -72.78 -38.3 67.33 Favored 'General case' 0 N--CA 1.45 -0.441 0 CA-C-N 115.697 -0.683 . . . . 0.0 111.926 -177.562 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 115' ' ' LYS . . . . . 0.589 ' HB2' ' HZ3' ' A' ' 115' ' ' LYS . 0.0 OUTLIER -90.46 -33.53 15.95 Favored 'General case' 0 N--CA 1.453 -0.283 0 N-CA-C 113.844 1.053 . . . . 0.0 113.844 -174.968 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 116' ' ' SER . . . . . 0.526 ' O ' ' HE3' ' A' ' 121' ' ' LYS . 1.0 OUTLIER -89.4 160.47 16.8 Favored 'General case' 0 C--N 1.339 0.111 0 N-CA-C 113.45 0.907 . . . . 0.0 113.45 -167.886 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 46.4 t30 -75.51 169.69 17.6 Favored 'General case' 0 C--O 1.226 -0.164 0 C-N-CA 123.983 0.913 . . . . 0.0 111.872 -173.941 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 118' ' ' GLN . . . . . . . . . . . . . 14.8 mm100 -54.37 -37.23 64.74 Favored 'General case' 0 C--N 1.338 0.094 0 C-N-CA 124.03 0.932 . . . . 0.0 112.954 -173.456 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 16.7 p-10 -69.28 -43.3 74.16 Favored 'General case' 0 N--CA 1.453 -0.301 0 N-CA-C 109.393 -0.595 . . . . 0.0 109.393 179.401 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 78.8 m-70 -69.22 -36.12 76.9 Favored 'General case' 0 N--CA 1.45 -0.444 0 CA-C-O 119.311 -0.376 . . . . 0.0 110.939 177.949 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 121' ' ' LYS . . . . . 0.526 ' HE3' ' O ' ' A' ' 116' ' ' SER . 89.8 mttt -58.49 -40.91 84.08 Favored 'General case' 0 C--O 1.231 0.129 0 N-CA-C 108.793 -0.817 . . . . 0.0 108.793 176.063 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 38.3 tp10 -73.99 -35.13 64.41 Favored 'General case' 0 N--CA 1.451 -0.378 0 C-N-CA 122.32 0.248 . . . . 0.0 110.93 179.849 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 84.9 mttt -63.95 -37.65 88.2 Favored 'General case' 0 N--CA 1.453 -0.296 0 N-CA-C 109.546 -0.538 . . . . 0.0 109.546 177.572 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 124' ' ' ILE . . . . . . . . . . . . . 56.4 mt -66.05 -38.92 83.11 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.182 0 N-CA-C 110.032 -0.359 . . . . 0.0 110.032 174.737 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 17.5 mtp180 -66.43 -42.31 87.91 Favored 'General case' 0 C--N 1.34 0.158 0 C-N-CA 122.404 0.282 . . . . 0.0 111.398 -177.356 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 126' ' ' MET . . . . . . . . . . . . . 17.8 ptp -68.42 -31.55 70.96 Favored 'General case' 0 N--CA 1.452 -0.325 0 C-N-CA 119.613 -0.835 . . . . 0.0 109.424 176.482 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 2.2 mp -63.25 -35.39 80.18 Favored 'General case' 0 N--CA 1.454 -0.267 0 N-CA-C 109.695 -0.483 . . . . 0.0 109.695 177.245 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 99.2 mt -68.34 -38.15 81.22 Favored 'General case' 0 N--CA 1.454 -0.256 0 CA-C-N 118.471 0.578 . . . . 0.0 110.049 177.687 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 14.9 t0 -65.49 -45.63 82.84 Favored 'General case' 0 CA--C 1.531 0.212 0 CA-C-N 118.055 0.389 . . . . 0.0 110.052 175.567 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 51.5 mt -61.11 -34.11 58.86 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.296 0 C-N-CA 123.031 0.532 . . . . 0.0 110.202 -178.721 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 131' ' ' TRP . . . . . . . . . . . . . 50.5 m0 . . . . . 0 N--CA 1.452 -0.371 0 N-CA-C 112.928 0.714 . . . . 0.0 112.928 179.271 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 21.2 p-10 . . . . . 0 N--CA 1.457 -0.111 0 N-CA-C 108.032 -1.099 . . . . 0.0 108.032 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 7' ' ' PHE . . . . . 0.494 ' CD1' ' HD3' ' A' ' 45' ' ' LYS . 1.2 t80 -55.03 -30.47 59.62 Favored 'General case' 0 N--CA 1.445 -0.695 0 C-N-CA 126.09 1.756 . . . . 0.0 111.213 -178.02 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 52.1 tp60 -50.48 -36.51 33.97 Favored 'General case' 0 N--CA 1.455 -0.218 0 C-N-CA 124.125 0.97 . . . . 0.0 111.878 -177.679 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 33.8 m-80 -72.36 -36.36 68.75 Favored 'General case' 0 N--CA 1.454 -0.251 0 CA-C-N 117.939 0.336 . . . . 0.0 110.294 -179.195 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 1.9 t80 -70.84 -39.27 73.08 Favored 'General case' 0 N--CA 1.452 -0.336 0 C-N-CA 123.519 0.728 . . . . 0.0 109.044 178.008 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 76.6 t -66.59 -53.02 39.58 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.385 0 N-CA-C 108.776 -0.824 . . . . 0.0 108.776 179.446 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -60.07 -31.25 69.83 Favored 'General case' 0 N--CA 1.454 -0.267 0 C-N-CA 122.759 0.424 . . . . 0.0 111.839 -178.517 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 86.6 m -67.53 -43.78 79.95 Favored 'General case' 0 CA--C 1.531 0.241 0 N-CA-C 108.691 -0.855 . . . . 0.0 108.691 176.488 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 5.5 tp -69.36 -39.56 78.02 Favored 'General case' 0 N--CA 1.452 -0.356 0 CA-C-N 116.418 -0.355 . . . . 0.0 111.278 -179.559 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 69.4 mm-40 -62.73 -33.76 75.8 Favored 'General case' 0 N--CA 1.451 -0.421 0 C-N-CA 123.596 0.758 . . . . 0.0 109.206 178.226 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 49.5 m -66.21 -32.89 74.59 Favored 'General case' 0 N--CA 1.451 -0.412 0 N-CA-C 108.881 -0.785 . . . . 0.0 108.881 176.774 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 17' ' ' PHE . . . . . 0.456 ' CE2' ' HB3' ' A' ' 25' ' ' SER . 14.8 m-30 -69.83 -33.82 72.83 Favored 'General case' 0 C--N 1.339 0.126 0 N-CA-C 112.2 0.444 . . . . 0.0 112.2 174.904 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 70.5 mttt -64.54 -27.08 68.72 Favored 'General case' 0 C--N 1.339 0.134 0 N-CA-C 109.243 -0.651 . . . . 0.0 109.243 174.944 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 43.8 t0 -79.41 -22.24 44.54 Favored 'General case' 0 CA--C 1.535 0.368 0 CA-C-N 115.701 -0.681 . . . . 0.0 111.898 177.009 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 81.1 mt -72.65 148.54 44.69 Favored 'General case' 0 N--CA 1.457 -0.11 0 O-C-N 121.152 -0.968 . . . . 0.0 110.674 179.649 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 1.6 mppt? -86.73 20.31 2.6 Favored 'General case' 0 CA--C 1.534 0.351 0 CA-C-N 115.653 -0.703 . . . . 0.0 109.33 175.713 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 79.9 p -147.46 -32.51 0.29 Allowed 'General case' 0 CA--C 1.53 0.198 0 C-N-CA 123.953 0.901 . . . . 0.0 111.237 -176.803 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 80.07 -19.91 6.17 Favored Glycine 0 CA--C 1.527 0.841 0 CA-C-O 119.601 -0.555 . . . . 0.0 113.63 176.194 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 96.3 mt -89.86 145.88 6.86 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.128 0 CA-C-N 118.059 0.93 . . . . 0.0 109.549 176.188 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 25' ' ' SER . . . . . 0.456 ' HB3' ' CE2' ' A' ' 17' ' ' PHE . 33.4 t -166.71 88.53 0.34 Allowed 'General case' 0 N--CA 1.455 -0.225 0 CA-C-N 117.679 0.218 . . . . 0.0 110.813 176.517 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -47.58 -56.55 8.27 Favored Glycine 0 CA--C 1.528 0.861 0 CA-C-O 119.111 -0.827 . . . . 0.0 114.623 -170.753 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 27' ' ' SER . . . . . 0.572 ' HA ' ' HE3' ' A' ' 30' ' ' LYS . 38.9 m -63.55 -36.25 83.17 Favored 'General case' 0 CA--C 1.524 -0.027 0 CA-C-N 119.2 1.5 . . . . 0.0 112.026 -176.328 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -75.76 -37.54 59.17 Favored 'General case' 0 CA--C 1.529 0.172 0 N-CA-C 109.846 -0.427 . . . . 0.0 109.846 179.079 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 60.6 mt -58.03 -42.82 83.72 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.501 0 N-CA-C 108.237 -1.023 . . . . 0.0 108.237 172.163 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . 0.572 ' HE3' ' HA ' ' A' ' 27' ' ' SER . 45.2 mtmt -69.1 -23.36 63.99 Favored 'General case' 0 N--CA 1.454 -0.226 0 CA-C-O 118.846 -0.597 . . . . 0.0 111.497 178.777 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . 0.447 ' CE ' ' HA ' ' A' ' 31' ' ' LYS . 3.9 mmpt? -67.64 -51.59 48.18 Favored 'General case' 0 C--N 1.34 0.183 0 CA-C-N 118.904 0.775 . . . . 0.0 110.314 175.405 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 4.2 pp -75.0 -23.25 58.21 Favored 'General case' 0 CA--C 1.531 0.227 0 C-N-CA 119.943 -0.703 . . . . 0.0 110.671 179.431 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 51.9 m -71.54 -39.34 70.76 Favored 'General case' 0 CA--C 1.523 -0.095 0 N-CA-C 109.678 -0.489 . . . . 0.0 109.678 177.125 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 99.7 m -70.61 -41.46 72.22 Favored 'General case' 0 N--CA 1.45 -0.47 0 N-CA-C 109.685 -0.487 . . . . 0.0 109.685 -177.881 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 29.1 t80 -66.07 -30.29 70.78 Favored 'General case' 0 N--CA 1.453 -0.282 0 C-N-CA 119.772 -0.771 . . . . 0.0 109.815 178.206 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -71.03 -27.86 63.97 Favored 'General case' 0 N--CA 1.449 -0.489 0 CA-C-O 119.492 -0.289 . . . . 0.0 111.375 176.102 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 11.4 mt -81.18 -39.63 25.17 Favored 'General case' 0 CA--C 1.519 -0.242 0 N-CA-C 108.926 -0.768 . . . . 0.0 108.926 -179.943 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 86.1 m-20 -58.65 -30.79 67.58 Favored 'General case' 0 N--CA 1.44 -0.949 0 C-N-CA 123.843 0.857 . . . . 0.0 110.633 175.076 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 78.4 m80 -149.93 103.3 3.2 Favored 'General case' 0 N--CA 1.453 -0.306 0 C-N-CA 122.885 0.474 . . . . 0.0 111.299 179.147 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 40' ' ' ILE . . . . . 0.587 HD11 ' H ' ' A' ' 40' ' ' ILE . 0.0 OUTLIER -75.72 -9.92 13.1 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.449 0 N-CA-C 109.136 -0.69 . . . . 0.0 109.136 172.672 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 4.6 m-20 -55.21 -25.11 30.95 Favored 'General case' 0 N--CA 1.455 -0.224 0 C-N-CA 124.026 0.931 . . . . 0.0 111.58 -177.744 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -105.62 16.33 6.45 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.328 0 C-N-CA 123.454 0.701 . . . . 0.0 112.105 -179.656 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 2.7 pp20? -52.31 -31.31 32.48 Favored 'General case' 0 CA--C 1.529 0.135 0 CA-C-N 118.641 0.655 . . . . 0.0 111.051 178.583 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 40.8 t -62.27 -46.85 86.95 Favored 'General case' 0 CA--C 1.531 0.238 0 N-CA-C 112.265 0.469 . . . . 0.0 112.265 -177.879 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . 0.494 ' HD3' ' CD1' ' A' ' 7' ' ' PHE . 14.6 ptpt -74.34 -23.49 59.05 Favored 'General case' 0 C--N 1.341 0.219 0 O-C-N 121.892 -0.505 . . . . 0.0 110.149 179.21 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 85.5 mt -73.74 -47.81 42.45 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.307 0 N-CA-C 110.059 -0.348 . . . . 0.0 110.059 -178.697 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 40.7 mm -66.93 -38.28 81.08 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.13 0 N-CA-C 109.781 -0.452 . . . . 0.0 109.781 179.415 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 27.8 t -64.78 -34.25 77.91 Favored 'General case' 0 N--CA 1.454 -0.258 0 C-N-CA 121.103 -0.239 . . . . 0.0 110.459 178.14 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 40.9 tp -75.15 -34.51 61.63 Favored 'General case' 0 N--CA 1.452 -0.353 0 N-CA-C 112.673 0.62 . . . . 0.0 112.673 -176.605 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 11.4 pt -71.23 -43.21 74.73 Favored 'Isoleucine or valine' 0 C--N 1.339 0.151 0 CA-C-N 118.459 0.572 . . . . 0.0 110.162 178.574 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 35.4 pt -65.29 -39.77 86.41 Favored 'Isoleucine or valine' 0 C--O 1.231 0.103 0 C-N-CA 119.87 -0.732 . . . . 0.0 110.842 -178.516 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 78.3 m-20 -65.11 -51.46 61.14 Favored 'General case' 0 N--CA 1.454 -0.254 0 CA-C-N 117.462 0.119 . . . . 0.0 111.214 179.04 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 15.9 t80 -63.95 -45.54 88.72 Favored 'General case' 0 N--CA 1.453 -0.306 0 N-CA-C 110.1 -0.334 . . . . 0.0 110.1 -179.293 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 31.7 t -65.2 -29.9 70.75 Favored 'General case' 0 N--CA 1.455 -0.216 0 N-CA-C 112.646 0.61 . . . . 0.0 112.646 -175.204 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 17.0 tpt85 -82.14 -36.67 27.2 Favored 'General case' 0 N--CA 1.454 -0.235 0 C-N-CA 119.697 -0.801 . . . . 0.0 111.193 -178.492 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 57.7 mt -80.98 -43.26 19.93 Favored 'General case' 0 C--O 1.227 -0.111 0 N-CA-C 112.764 0.654 . . . . 0.0 112.764 -178.482 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 57' ' ' CYS . . . . . 0.449 ' HB2' ' HD2' ' A' ' 58' ' ' PRO . 13.3 p -62.06 159.78 35.09 Favored Pre-proline 0 CA--C 1.536 0.419 0 N-CA-C 112.875 0.695 . . . . 0.0 112.875 -173.93 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 58' ' ' PRO . . . . . 0.449 ' HD2' ' HB2' ' A' ' 57' ' ' CYS . 84.3 Cg_endo -74.7 169.94 21.45 Favored 'Trans proline' 0 N--CA 1.451 -1.014 0 C-N-CA 124.209 3.272 . . . . 0.0 110.183 179.4 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -50.5 -47.04 57.45 Favored 'General case' 0 N--CA 1.457 -0.124 0 N-CA-C 114.287 1.218 . . . . 0.0 114.287 -170.795 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 16.6 t -66.79 -32.1 73.16 Favored 'General case' 0 N--CA 1.455 -0.198 0 C-N-CA 119.539 -0.864 . . . . 0.0 110.038 -177.323 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 54.8 m170 -76.03 -27.55 57.36 Favored 'General case' 0 N--CA 1.453 -0.276 0 N-CA-C 109.973 -0.38 . . . . 0.0 109.973 177.221 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 68.0 mttm -65.73 -39.87 91.58 Favored 'General case' 0 C--N 1.343 0.305 0 N-CA-C 109.106 -0.702 . . . . 0.0 109.106 174.074 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -63.08 -41.64 99.46 Favored 'General case' 0 N--CA 1.452 -0.374 0 N-CA-C 108.283 -1.006 . . . . 0.0 108.283 176.702 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -67.63 -31.56 76.51 Favored Glycine 0 CA--C 1.525 0.704 0 CA-C-O 119.713 -0.493 . . . . 0.0 112.271 -179.197 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 22.6 t -74.28 -32.75 63.02 Favored 'General case' 0 N--CA 1.453 -0.277 0 CA-C-N 118.118 0.959 . . . . 0.0 110.566 178.157 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 69.1 mt -71.99 -24.86 61.64 Favored 'General case' 0 N--CA 1.452 -0.328 0 N-CA-C 109.336 -0.616 . . . . 0.0 109.336 176.037 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -72.47 -36.88 68.59 Favored 'General case' 0 N--CA 1.455 -0.19 0 N-CA-C 110.333 -0.247 . . . . 0.0 110.333 174.533 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 68' ' ' ILE . . . . . . . . . . . . . 27.1 mt -66.65 -49.58 73.53 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.356 0 N-CA-C 108.811 -0.811 . . . . 0.0 108.811 174.886 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 67.1 mt -54.14 -34.68 27.43 Favored 'Isoleucine or valine' 0 C--O 1.226 -0.177 0 C-N-CA 123.085 0.554 . . . . 0.0 111.702 175.78 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 28.9 t70 -68.3 -44.58 75.11 Favored 'General case' 0 N--CA 1.452 -0.331 0 CA-C-N 119.112 0.869 . . . . 0.0 110.651 176.538 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 31.9 t -67.45 -57.22 6.93 Favored 'General case' 0 N--CA 1.451 -0.382 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.926 -176.804 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -75.12 -30.58 23.38 Favored 'Isoleucine or valine' 0 CA--C 1.523 -0.075 0 N-CA-C 110.465 -0.198 . . . . 0.0 110.465 -177.469 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -68.49 -54.3 16.64 Favored Glycine 0 C--N 1.336 0.545 0 N-CA-C 111.582 -0.607 . . . . 0.0 111.582 -175.774 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 44.3 mtm105 -69.75 -37.34 76.4 Favored 'General case' 0 N--CA 1.452 -0.327 0 C-N-CA 120.273 -0.571 . . . . 0.0 109.737 179.294 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -60.29 -37.02 79.22 Favored 'General case' 0 N--CA 1.45 -0.456 0 C-N-CA 120.299 -0.56 . . . . 0.0 110.323 179.486 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 2.1 m-30 -68.05 -54.08 20.94 Favored 'General case' 0 N--CA 1.451 -0.378 0 CA-C-N 118.075 0.398 . . . . 0.0 111.045 178.765 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 1.5 tt -67.84 -42.27 81.66 Favored 'General case' 0 N--CA 1.448 -0.531 0 C-N-CA 118.813 -1.155 . . . . 0.0 109.003 -174.837 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 79.6 m-20 -61.72 -49.45 76.4 Favored 'General case' 0 CA--C 1.531 0.235 0 N-CA-C 112.946 0.721 . . . . 0.0 112.946 179.07 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 65.5 mm-40 -66.32 -42.96 87.5 Favored 'General case' 0 C--N 1.34 0.158 0 CA-C-N 119.452 1.024 . . . . 0.0 111.688 -178.279 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 42.6 p -65.03 -35.34 80.87 Favored 'General case' 0 N--CA 1.45 -0.432 0 N-CA-C 109.737 -0.468 . . . . 0.0 109.737 178.15 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 33.1 ttp180 -69.16 -43.22 74.71 Favored 'General case' 0 N--CA 1.45 -0.432 0 C-N-CA 123.613 0.765 . . . . 0.0 111.792 179.259 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 42.0 t . . . . . 0 N--CA 1.454 -0.254 0 N-CA-C 113.568 0.951 . . . . 0.0 113.568 -176.56 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 70.5 Cg_exo . . . . . 0 N--CA 1.45 -1.075 0 N-CA-C 109.727 -0.913 . . . . 0.0 109.727 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 92.69 20.27 34.86 Favored Glycine 0 CA--C 1.528 0.851 0 CA-C-O 119.21 -0.772 . . . . 0.0 112.487 -178.246 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 60.6 p -151.67 167.61 27.61 Favored 'General case' 0 CA--C 1.522 -0.119 0 CA-C-N 118.11 0.955 . . . . 0.0 110.26 176.118 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 94' ' ' CYS . . . . . 0.443 ' HB2' HD11 ' A' ' 98' ' ' ILE . 17.2 p -59.51 -24.69 63.85 Favored 'General case' 0 N--CA 1.449 -0.512 0 CA-C-N 115.623 -0.717 . . . . 0.0 109.779 175.794 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -63.4 -57.65 9.61 Favored 'General case' 0 N--CA 1.446 -0.656 0 N-CA-C 109.376 -0.601 . . . . 0.0 109.376 -173.59 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 66.5 t60 -74.78 -29.28 61.06 Favored 'General case' 0 N--CA 1.449 -0.524 0 CA-C-N 116.553 -0.294 . . . . 0.0 110.631 -179.464 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -67.41 -54.52 19.7 Favored 'General case' 0 N--CA 1.452 -0.336 0 N-CA-C 111.643 0.238 . . . . 0.0 111.643 -179.125 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 98' ' ' ILE . . . . . 0.443 HD11 ' HB2' ' A' ' 94' ' ' CYS . 2.5 mp -70.0 -31.51 48.05 Favored 'Isoleucine or valine' 0 C--N 1.341 0.202 0 C-N-CA 120.817 -0.353 . . . . 0.0 110.504 -179.577 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 77.0 m-20 -68.65 -38.25 80.32 Favored 'General case' 0 N--CA 1.452 -0.37 0 CA-C-N 118.458 0.572 . . . . 0.0 111.379 176.544 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 58.2 m -73.14 -36.93 66.77 Favored 'General case' 0 N--CA 1.454 -0.228 0 CA-C-N 117.996 0.362 . . . . 0.0 110.378 179.874 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 60.0 tp -74.86 -31.92 61.75 Favored 'General case' 0 N--CA 1.452 -0.372 0 C-N-CA 121.394 -0.122 . . . . 0.0 111.089 179.137 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -62.91 -20.86 62.76 Favored Glycine 0 CA--C 1.525 0.71 0 CA-C-O 119.614 -0.548 . . . . 0.0 112.465 -176.047 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 6.1 mm-40 -85.92 -32.77 21.43 Favored 'General case' 0 N--CA 1.456 -0.164 0 CA-C-N 118.213 1.006 . . . . 0.0 111.428 177.711 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 43.9 t -96.06 -19.35 6.25 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.221 0 N-CA-C 112.701 0.63 . . . . 0.0 112.701 -175.415 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 105' ' ' ILE . . . . . . . . . . . . . 10.5 tp -57.59 -24.95 23.42 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.229 0 CA-C-N 118.604 0.638 . . . . 0.0 111.8 -177.025 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 27.5 pt20 -68.17 -25.3 65.18 Favored 'General case' 0 N--CA 1.452 -0.368 0 O-C-N 122.1 -0.375 . . . . 0.0 110.325 178.506 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 65.0 mm-40 -75.58 -39.95 57.31 Favored 'General case' 0 N--CA 1.456 -0.13 0 CA-C-N 118.271 0.487 . . . . 0.0 109.913 176.471 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 8.3 mp -70.56 -41.16 72.81 Favored 'General case' 0 N--CA 1.451 -0.376 0 N-CA-C 109.769 -0.456 . . . . 0.0 109.769 -178.583 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 89.1 mt -67.69 -61.45 1.88 Allowed 'General case' 0 N--CA 1.452 -0.337 0 CA-C-O 119.351 -0.357 . . . . 0.0 110.246 178.451 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 19.5 p -44.36 -51.24 8.69 Favored 'General case' 0 CA--C 1.52 -0.205 0 C-N-CA 122.993 0.517 . . . . 0.0 112.238 -178.076 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 62.3 t0 -63.69 -42.01 98.05 Favored 'General case' 0 N--CA 1.448 -0.539 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.438 -178.047 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -72.42 -35.75 68.44 Favored 'General case' 0 N--CA 1.447 -0.593 0 C-N-CA 120.762 -0.375 . . . . 0.0 111.268 -178.028 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 113' ' ' ILE . . . . . . . . . . . . . 34.9 mm -68.42 -38.27 79.06 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.185 0 CA-C-N 119.185 0.902 . . . . 0.0 109.569 -177.533 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -75.0 -45.46 41.79 Favored 'General case' 0 N--CA 1.451 -0.396 0 CA-C-N 117.471 0.123 . . . . 0.0 111.242 179.765 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 115' ' ' LYS . . . . . 0.599 ' HE2' ' HA ' ' A' ' 115' ' ' LYS . 0.2 OUTLIER -82.07 -31.16 30.94 Favored 'General case' 0 N--CA 1.455 -0.209 0 N-CA-C 113.869 1.063 . . . . 0.0 113.869 -173.111 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 116' ' ' SER . . . . . 0.466 ' HB2' ' CB ' ' A' ' 120' ' ' HIS . 45.5 p -76.39 156.12 33.48 Favored 'General case' 0 CA--C 1.528 0.13 0 N-CA-C 112.261 0.467 . . . . 0.0 112.261 -172.984 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 53.6 t30 -73.02 165.67 24.57 Favored 'General case' 0 N--CA 1.453 -0.277 0 C-N-CA 123.383 0.673 . . . . 0.0 110.708 -178.863 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 118' ' ' GLN . . . . . . . . . . . . . 20.5 mm100 -53.68 -38.1 63.86 Favored 'General case' 0 CA--C 1.531 0.226 0 N-CA-C 112.908 0.707 . . . . 0.0 112.908 -172.765 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 7.5 p-10 -71.65 -38.42 70.71 Favored 'General case' 0 N--CA 1.454 -0.272 0 N-CA-C 109.899 -0.408 . . . . 0.0 109.899 179.227 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 120' ' ' HIS . . . . . 0.466 ' CB ' ' HB2' ' A' ' 116' ' ' SER . 34.3 m170 -65.3 -40.78 94.26 Favored 'General case' 0 N--CA 1.451 -0.406 0 C-N-CA 122.681 0.392 . . . . 0.0 110.044 176.457 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 56.7 mttm -58.55 -42.94 89.02 Favored 'General case' 0 C--N 1.341 0.231 0 N-CA-C 108.895 -0.779 . . . . 0.0 108.895 178.225 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 43.8 tp10 -73.73 -36.5 65.18 Favored 'General case' 0 N--CA 1.451 -0.417 0 CA-C-N 116.661 -0.245 . . . . 0.0 111.468 -176.863 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 13.0 tppt? -62.41 -36.04 81.1 Favored 'General case' 0 N--CA 1.45 -0.431 0 N-CA-C 109.333 -0.617 . . . . 0.0 109.333 177.828 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 124' ' ' ILE . . . . . . . . . . . . . 61.2 mt -69.37 -36.26 71.14 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.261 0 O-C-N 121.957 -0.464 . . . . 0.0 109.892 177.51 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 13.7 mtp-105 -68.05 -35.34 78.07 Favored 'General case' 0 N--CA 1.457 -0.099 0 CA-C-O 119.468 -0.301 . . . . 0.0 111.511 -178.472 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 126' ' ' MET . . . . . . . . . . . . . 27.2 ptm -72.92 -28.01 62.2 Favored 'General case' 0 N--CA 1.455 -0.177 0 C-N-CA 119.488 -0.885 . . . . 0.0 109.452 174.666 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 4.2 mp -65.77 -31.62 72.69 Favored 'General case' 0 CA--C 1.529 0.163 0 CA-C-N 118.084 0.402 . . . . 0.0 110.134 172.999 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 95.6 mt -70.12 -38.72 75.66 Favored 'General case' 0 C--N 1.34 0.19 0 CA-C-N 118.755 0.707 . . . . 0.0 109.868 176.237 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 10.7 t70 -60.37 -44.02 96.01 Favored 'General case' 0 N--CA 1.454 -0.231 0 N-CA-C 109.182 -0.673 . . . . 0.0 109.182 175.561 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 73.9 mt -61.87 -39.07 82.18 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.417 0 CA-C-N 116.418 -0.355 . . . . 0.0 110.632 -179.532 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 131' ' ' TRP . . . . . . . . . . . . . 48.1 m0 . . . . . 0 N--CA 1.45 -0.43 0 N-CA-C 112.355 0.502 . . . . 0.0 112.355 -179.045 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 26.8 p-10 . . . . . 0 N--CA 1.454 -0.27 0 CA-C-O 120.965 0.412 . . . . 0.0 110.017 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 7' ' ' PHE . . . . . 0.435 ' HA ' ' HZ1' ' A' ' 45' ' ' LYS . 1.6 t80 -53.83 -37.54 63.7 Favored 'General case' 0 N--CA 1.45 -0.461 0 CA-C-N 115.965 -0.561 . . . . 0.0 109.983 178.966 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 53.3 tp60 -56.58 -32.17 64.95 Favored 'General case' 0 N--CA 1.452 -0.369 0 C-N-CA 123.166 0.586 . . . . 0.0 111.813 -177.017 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 13.7 t-20 -71.45 -34.45 70.25 Favored 'General case' 0 N--CA 1.452 -0.346 0 N-CA-C 109.832 -0.433 . . . . 0.0 109.832 177.964 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 10' ' ' PHE . . . . . 0.465 ' CE2' ' HB2' ' A' ' 32' ' ' LEU . 6.7 t80 -68.97 -38.85 79.61 Favored 'General case' 0 N--CA 1.45 -0.43 0 C-N-CA 123.176 0.591 . . . . 0.0 109.5 176.014 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 87.4 t -64.48 -55.14 23.05 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.316 0 N-CA-C 109.092 -0.707 . . . . 0.0 109.092 178.279 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -59.7 -28.45 67.33 Favored 'General case' 0 N--CA 1.452 -0.334 0 C-N-CA 122.973 0.509 . . . . 0.0 112.1 -178.932 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 90.7 m -74.57 -39.94 61.94 Favored 'General case' 0 N--CA 1.456 -0.174 0 N-CA-C 109.222 -0.659 . . . . 0.0 109.222 176.99 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . 0.454 ' HA ' ' CD1' ' A' ' 17' ' ' PHE . 13.0 tp -65.77 -44.48 85.71 Favored 'General case' 0 N--CA 1.452 -0.367 0 N-CA-C 109.3 -0.63 . . . . 0.0 109.3 179.366 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 67.7 mm-40 -62.48 -29.65 70.69 Favored 'General case' 0 N--CA 1.45 -0.458 0 C-N-CA 124.304 1.042 . . . . 0.0 109.446 177.591 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 40.8 t -69.13 -28.44 66.45 Favored 'General case' 0 N--CA 1.451 -0.392 0 CA-C-O 119.052 -0.499 . . . . 0.0 110.147 177.52 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 17' ' ' PHE . . . . . 0.454 ' CD1' ' HA ' ' A' ' 14' ' ' LEU . 29.2 m-85 -71.98 -36.67 69.86 Favored 'General case' 0 C--N 1.339 0.115 0 CA-C-N 118.693 0.679 . . . . 0.0 110.824 171.979 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 80.6 mttt -63.25 -24.21 67.77 Favored 'General case' 0 C--N 1.339 0.144 0 N-CA-C 110.169 -0.308 . . . . 0.0 110.169 177.429 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 30.1 t0 -76.59 -16.76 59.5 Favored 'General case' 0 CA--C 1.538 0.505 0 N-CA-C 112.466 0.543 . . . . 0.0 112.466 176.697 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . 0.418 ' C ' ' HE3' ' A' ' 21' ' ' LYS . 10.1 mt -85.44 161.08 19.56 Favored 'General case' 0 N--CA 1.457 -0.107 0 CA-C-N 118.728 0.694 . . . . 0.0 111.983 -174.043 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . 0.53 ' HE3' ' N ' ' A' ' 21' ' ' LYS . 0.8 OUTLIER -82.64 -36.59 25.9 Favored 'General case' 0 N--CA 1.454 -0.229 0 N-CA-C 108.803 -0.814 . . . . 0.0 108.803 176.797 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 35.9 t -90.16 -24.77 20.96 Favored 'General case' 0 C--N 1.341 0.231 0 C-N-CA 124.034 0.934 . . . . 0.0 111.648 -179.791 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 77.7 -10.52 24.14 Favored Glycine 0 CA--C 1.532 1.146 0 CA-C-O 119.675 -0.514 . . . . 0.0 111.896 -177.372 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 70.0 mt -96.05 148.93 4.93 Favored 'Isoleucine or valine' 0 C--N 1.34 0.188 0 CA-C-N 117.507 0.654 . . . . 0.0 111.155 178.447 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 19.1 t -167.68 100.82 0.48 Allowed 'General case' 0 CA--C 1.518 -0.252 0 N-CA-C 108.777 -0.823 . . . . 0.0 108.777 176.177 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -54.67 -45.62 77.68 Favored Glycine 0 CA--C 1.527 0.8 0 C-N-CA 120.861 -0.685 . . . . 0.0 112.025 -175.106 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 8.9 m -64.51 -42.72 95.64 Favored 'General case' 0 N--CA 1.456 -0.135 0 CA-C-N 118.232 1.016 . . . . 0.0 111.349 -177.327 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 28.7 mtt180 -74.63 -39.12 62.32 Favored 'General case' 0 N--CA 1.453 -0.281 0 CA-C-N 118.231 0.468 . . . . 0.0 110.083 -177.821 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 69.8 mt -58.95 -45.23 92.12 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.607 0 N-CA-C 109.045 -0.724 . . . . 0.0 109.045 174.516 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 50.4 mtmt -69.18 -25.04 64.14 Favored 'General case' 0 C--O 1.231 0.092 0 CA-C-O 119.069 -0.491 . . . . 0.0 111.403 -179.994 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . 0.444 ' CE ' ' HA ' ' A' ' 31' ' ' LYS . 3.1 mmpt? -66.22 -55.95 13.71 Favored 'General case' 0 N--CA 1.455 -0.203 0 CA-C-N 118.662 0.665 . . . . 0.0 110.14 177.856 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . 0.465 ' HB2' ' CE2' ' A' ' 10' ' ' PHE . 1.6 pp -75.43 -17.64 60.11 Favored 'General case' 0 CA--C 1.53 0.207 0 C-N-CA 119.165 -1.014 . . . . 0.0 111.554 -179.613 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 29.8 m -73.03 -41.6 64.06 Favored 'General case' 0 C--N 1.341 0.201 0 N-CA-C 108.926 -0.768 . . . . 0.0 108.926 176.378 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 97.0 m -69.59 -37.92 77.12 Favored 'General case' 0 N--CA 1.449 -0.499 0 N-CA-C 110.414 -0.217 . . . . 0.0 110.414 -178.36 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 14.8 t80 -62.92 -40.12 96.64 Favored 'General case' 0 N--CA 1.455 -0.216 0 N-CA-C 110.103 -0.332 . . . . 0.0 110.103 175.576 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -70.92 -31.95 68.72 Favored 'General case' 0 N--CA 1.45 -0.455 0 C-N-CA 122.337 0.255 . . . . 0.0 111.148 179.954 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 20.1 mt -71.34 -40.08 70.94 Favored 'General case' 0 N--CA 1.453 -0.296 0 C-N-CA 122.618 0.367 . . . . 0.0 110.733 179.844 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 42.6 t0 -65.55 -23.41 66.86 Favored 'General case' 0 N--CA 1.453 -0.285 0 CA-C-N 116.463 -0.335 . . . . 0.0 110.847 177.037 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 98.1 m-70 -149.27 98.39 2.8 Favored 'General case' 0 N--CA 1.452 -0.336 0 CA-C-O 121.071 0.462 . . . . 0.0 111.651 -175.96 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 40' ' ' ILE . . . . . 0.583 HD11 ' H ' ' A' ' 40' ' ' ILE . 0.0 OUTLIER -76.59 -10.54 13.35 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.368 0 C-N-CA 122.847 0.459 . . . . 0.0 110.357 175.385 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 8.0 m-20 -57.42 -23.99 52.83 Favored 'General case' 0 N--CA 1.455 -0.18 0 C-N-CA 123.0 0.52 . . . . 0.0 111.66 -178.322 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . 0.484 ' HB ' ' HE2' ' A' ' 45' ' ' LYS . 0.0 OUTLIER -101.92 15.77 5.07 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.244 0 C-N-CA 122.877 0.471 . . . . 0.0 112.163 177.999 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 3.0 pp20? -52.43 -29.64 25.42 Favored 'General case' 0 CA--C 1.531 0.247 0 CA-C-N 119.067 0.849 . . . . 0.0 110.812 179.262 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 39.5 t -62.0 -52.61 63.31 Favored 'General case' 0 C--O 1.234 0.28 0 N-CA-C 112.028 0.381 . . . . 0.0 112.028 -178.706 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . 0.484 ' HE2' ' HB ' ' A' ' 42' ' ' ILE . 17.7 pttt -68.43 -25.89 65.25 Favored 'General case' 0 C--N 1.34 0.184 0 CA-C-N 118.245 0.475 . . . . 0.0 109.924 179.897 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 46' ' ' ILE . . . . . 0.4 HG12 ' CZ ' ' A' ' 10' ' ' PHE . 87.0 mt -73.28 -45.8 51.89 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.493 0 C-N-CA 122.649 0.38 . . . . 0.0 110.425 -176.656 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 34.2 mm -64.89 -34.7 72.17 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.215 0 N-CA-C 109.584 -0.525 . . . . 0.0 109.584 177.84 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 23.3 t -63.78 -46.84 83.42 Favored 'General case' 0 C--O 1.227 -0.09 0 C-N-CA 119.968 -0.693 . . . . 0.0 110.367 177.708 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 6.6 mp -66.65 -30.65 70.96 Favored 'General case' 0 N--CA 1.454 -0.273 0 CA-C-O 118.635 -0.698 . . . . 0.0 112.317 -175.135 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 20.3 pt -71.93 -42.76 68.88 Favored 'Isoleucine or valine' 0 C--N 1.34 0.192 0 CA-C-N 119.64 1.109 . . . . 0.0 110.126 176.982 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 38.0 pt -68.94 -42.33 82.27 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.239 0 C-N-CA 119.459 -0.896 . . . . 0.0 110.487 179.395 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 74.3 m-20 -62.54 -37.68 87.07 Favored 'General case' 0 N--CA 1.455 -0.201 0 CA-C-N 117.779 0.263 . . . . 0.0 110.806 179.767 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 26.8 t80 -72.79 -29.75 63.53 Favored 'General case' 0 CA--C 1.528 0.118 0 N-CA-C 110.29 -0.263 . . . . 0.0 110.29 177.211 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 37.7 m -75.28 -21.94 58.15 Favored 'General case' 0 N--CA 1.455 -0.221 0 N-CA-C 111.952 0.353 . . . . 0.0 111.952 179.532 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 22.6 mmm180 -93.95 -53.23 4.07 Favored 'General case' 0 N--CA 1.453 -0.284 0 N-CA-C 112.686 0.624 . . . . 0.0 112.686 -179.569 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 46.6 mt -74.18 -46.11 44.18 Favored 'General case' 0 C--N 1.334 -0.099 0 N-CA-C 112.507 0.558 . . . . 0.0 112.507 -170.188 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 57' ' ' CYS . . . . . 0.446 ' HB3' ' HD2' ' A' ' 58' ' ' PRO . 74.4 m -74.08 158.28 85.87 Favored Pre-proline 0 CA--C 1.535 0.382 0 C-N-CA 122.539 0.336 . . . . 0.0 111.598 -176.209 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 58' ' ' PRO . . . . . 0.446 ' HD2' ' HB3' ' A' ' 57' ' ' CYS . 91.8 Cg_endo -76.89 175.09 11.82 Favored 'Trans proline' 0 N--CA 1.453 -0.894 0 C-N-CA 125.127 3.885 . . . . 0.0 112.009 -169.46 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 35.3 p-10 -46.95 -46.33 21.41 Favored 'General case' 0 CA--C 1.528 0.115 0 C-N-CA 125.182 1.393 . . . . 0.0 113.677 -171.728 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 36.3 m -67.36 -36.3 81.1 Favored 'General case' 0 N--CA 1.453 -0.298 0 N-CA-C 109.992 -0.373 . . . . 0.0 109.992 -177.17 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 61' ' ' HIS . . . . . 0.418 ' ND1' ' HD2' ' A' ' 58' ' ' PRO . 53.6 m170 -75.41 -23.9 57.06 Favored 'General case' 0 N--CA 1.452 -0.366 0 N-CA-C 110.023 -0.362 . . . . 0.0 110.023 178.261 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 57.2 mttm -68.55 -34.42 75.8 Favored 'General case' 0 CA--C 1.528 0.107 0 N-CA-C 109.405 -0.591 . . . . 0.0 109.405 172.978 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -64.64 -44.47 90.37 Favored 'General case' 0 CA--C 1.532 0.261 0 N-CA-C 108.029 -1.1 . . . . 0.0 108.029 174.579 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -66.6 -28.45 73.75 Favored Glycine 0 C--N 1.336 0.576 0 N-CA-C 111.538 -0.625 . . . . 0.0 111.538 -179.749 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 38.7 t -69.88 -44.16 70.34 Favored 'General case' 0 N--CA 1.451 -0.401 0 CA-C-N 117.387 0.594 . . . . 0.0 110.08 177.371 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 60.6 mt -65.7 -25.04 67.14 Favored 'General case' 0 N--CA 1.453 -0.307 0 N-CA-C 109.581 -0.526 . . . . 0.0 109.581 178.781 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 1.2 m-85 -72.24 -37.67 69.08 Favored 'General case' 0 N--CA 1.454 -0.235 0 C-N-CA 122.617 0.367 . . . . 0.0 110.811 174.585 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 68' ' ' ILE . . . . . 0.431 HD12 ' CD1' ' A' ' 17' ' ' PHE . 20.2 mt -69.72 -46.76 73.84 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.317 0 N-CA-C 109.137 -0.69 . . . . 0.0 109.137 176.226 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 93.7 mt -57.6 -34.14 46.51 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.258 0 C-N-CA 123.556 0.742 . . . . 0.0 110.784 176.86 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 18.7 t70 -68.73 -43.68 75.42 Favored 'General case' 0 N--CA 1.451 -0.393 0 CA-C-N 118.123 0.419 . . . . 0.0 110.757 178.165 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 30.3 t -69.31 -56.55 7.2 Favored 'General case' 0 N--CA 1.452 -0.352 0 CA-C-N 116.401 -0.363 . . . . 0.0 110.65 -177.304 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -74.97 -31.34 25.09 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.253 0 N-CA-C 110.177 -0.305 . . . . 0.0 110.177 -176.623 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -66.42 -55.61 17.33 Favored Glycine 0 C--N 1.336 0.561 0 N-CA-C 111.214 -0.754 . . . . 0.0 111.214 -176.523 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 37.6 mtm105 -66.41 -40.84 89.82 Favored 'General case' 0 N--CA 1.452 -0.349 0 C-N-CA 120.489 -0.485 . . . . 0.0 109.934 -179.358 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -64.48 -30.29 71.32 Favored 'General case' 0 N--CA 1.45 -0.426 0 C-N-CA 120.058 -0.657 . . . . 0.0 110.998 -177.893 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 1.3 m-30 -69.66 -46.66 65.62 Favored 'General case' 0 C--N 1.34 0.191 0 CA-C-N 118.18 0.446 . . . . 0.0 110.858 177.55 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 50.0 tp -71.82 -38.5 70.17 Favored 'General case' 0 N--CA 1.451 -0.419 0 C-N-CA 118.01 -1.476 . . . . 0.0 109.451 -179.611 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 91.1 m-20 -60.98 -47.84 84.6 Favored 'General case' 0 CA--C 1.529 0.156 0 N-CA-C 112.893 0.701 . . . . 0.0 112.893 178.548 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 21.3 mm-40 -66.84 -45.53 77.92 Favored 'General case' 0 CA--C 1.522 -0.098 0 CA-C-N 119.221 0.919 . . . . 0.0 111.342 179.877 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 60.0 p -65.34 -30.76 71.63 Favored 'General case' 0 N--CA 1.456 -0.142 0 C-N-CA 120.195 -0.602 . . . . 0.0 110.632 179.847 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 38.2 ttp-105 -72.15 -30.86 65.43 Favored 'General case' 0 N--CA 1.454 -0.226 0 CA-C-N 117.98 0.355 . . . . 0.0 111.631 175.415 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 17.2 m . . . . . 0 N--CA 1.457 -0.102 0 N-CA-C 113.495 0.924 . . . . 0.0 113.495 -174.422 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 57.5 Cg_exo . . . . . 0 N--CA 1.452 -0.959 0 N-CA-C 111.154 -0.364 . . . . 0.0 111.154 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 90.52 16.55 54.95 Favored Glycine 0 CA--C 1.523 0.571 0 CA-C-O 119.278 -0.735 . . . . 0.0 112.878 178.539 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 30.9 p -153.04 167.95 27.51 Favored 'General case' 0 CA--C 1.52 -0.202 0 CA-C-N 118.399 1.1 . . . . 0.0 110.591 177.864 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 94' ' ' CYS . . . . . . . . . . . . . 31.1 p -58.34 -24.3 59.33 Favored 'General case' 0 N--CA 1.451 -0.402 0 CA-C-N 115.478 -0.783 . . . . 0.0 110.27 175.561 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -60.9 -59.82 4.77 Favored 'General case' 0 N--CA 1.446 -0.638 0 N-CA-C 109.497 -0.557 . . . . 0.0 109.497 -175.722 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 72.4 t60 -73.56 -32.78 64.35 Favored 'General case' 0 N--CA 1.449 -0.492 0 N-CA-C 110.553 -0.166 . . . . 0.0 110.553 -178.92 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -66.08 -52.53 48.01 Favored 'General case' 0 N--CA 1.453 -0.323 0 N-CA-C 111.836 0.309 . . . . 0.0 111.836 -177.86 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 1.8 mp -71.01 -33.87 53.3 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.146 0 O-C-N 121.916 -0.49 . . . . 0.0 109.908 -178.829 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 75.8 m-20 -68.1 -43.37 78.64 Favored 'General case' 0 N--CA 1.45 -0.429 0 CA-C-N 118.242 0.474 . . . . 0.0 111.626 179.34 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 91.3 m -68.32 -37.6 80.75 Favored 'General case' 0 N--CA 1.455 -0.221 0 CA-C-N 117.886 0.312 . . . . 0.0 110.472 -177.579 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 65.2 tp -75.81 -36.73 59.63 Favored 'General case' 0 N--CA 1.451 -0.424 0 CA-C-N 116.661 -0.245 . . . . 0.0 111.283 179.906 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -65.56 -22.78 69.99 Favored Glycine 0 CA--C 1.522 0.527 0 CA-C-O 119.67 -0.517 . . . . 0.0 112.437 -175.187 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 17.6 mm-40 -72.68 -44.89 61.21 Favored 'General case' 0 N--CA 1.452 -0.359 0 CA-C-N 118.201 1.0 . . . . 0.0 111.873 178.138 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 25.0 m -92.1 -1.6 10.27 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.171 0 O-C-N 123.928 0.767 . . . . 0.0 112.369 -174.63 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 105' ' ' ILE . . . . . . . . . . . . . 10.1 tp -66.68 -25.15 34.15 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.167 0 CA-C-N 118.384 0.538 . . . . 0.0 110.954 -176.25 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 15.2 pt20 -71.76 -34.29 69.36 Favored 'General case' 0 N--CA 1.452 -0.345 0 CA-C-O 119.181 -0.438 . . . . 0.0 109.841 -178.631 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 57.9 mp0 -73.69 -37.96 65.05 Favored 'General case' 0 C--N 1.341 0.203 0 CA-C-N 118.929 0.786 . . . . 0.0 110.38 177.001 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 94.1 mt -71.74 -41.36 68.57 Favored 'General case' 0 N--CA 1.452 -0.343 0 CA-C-O 119.186 -0.435 . . . . 0.0 111.053 -177.568 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 81.5 mt -69.66 -55.62 9.5 Favored 'General case' 0 N--CA 1.45 -0.441 0 C-N-CA 120.494 -0.483 . . . . 0.0 110.146 179.156 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 14.2 p -49.18 -51.76 30.65 Favored 'General case' 0 CA--C 1.52 -0.181 0 CA-C-N 118.243 0.474 . . . . 0.0 111.48 -177.506 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 43.2 t0 -69.0 -31.17 69.8 Favored 'General case' 0 N--CA 1.447 -0.585 0 C-N-CA 120.897 -0.321 . . . . 0.0 110.508 -177.14 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -72.52 -31.27 65.19 Favored 'General case' 0 N--CA 1.448 -0.545 0 C-N-CA 120.822 -0.351 . . . . 0.0 110.496 178.902 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 113' ' ' ILE . . . . . . . . . . . . . 36.5 mm -66.31 -36.89 78.46 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.175 0 N-CA-C 108.317 -0.994 . . . . 0.0 108.317 176.375 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -74.56 -40.08 61.9 Favored 'General case' 0 N--CA 1.454 -0.26 0 N-CA-C 112.205 0.446 . . . . 0.0 112.205 177.92 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 115' ' ' LYS . . . . . 0.546 ' HB2' ' HZ3' ' A' ' 115' ' ' LYS . 0.0 OUTLIER -77.24 -36.46 54.54 Favored 'General case' 0 C--N 1.339 0.123 0 N-CA-C 112.531 0.567 . . . . 0.0 112.531 -175.536 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 116' ' ' SER . . . . . 0.509 ' HB2' ' CB ' ' A' ' 120' ' ' HIS . 83.8 p -79.38 153.74 29.52 Favored 'General case' 0 N--CA 1.454 -0.246 0 N-CA-C 112.991 0.737 . . . . 0.0 112.991 -170.952 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 47.2 t30 -75.62 167.43 21.9 Favored 'General case' 0 C--O 1.225 -0.22 0 C-N-CA 123.772 0.829 . . . . 0.0 110.251 -178.611 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 118' ' ' GLN . . . . . . . . . . . . . 59.8 mt-30 -45.87 -55.67 6.38 Favored 'General case' 0 C--N 1.34 0.187 0 C-N-CA 123.478 0.711 . . . . 0.0 111.542 -174.438 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 3.9 p30 -63.15 -36.88 85.1 Favored 'General case' 0 C--O 1.232 0.143 0 C-N-CA 122.778 0.431 . . . . 0.0 110.95 -177.341 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 120' ' ' HIS . . . . . 0.509 ' CB ' ' HB2' ' A' ' 116' ' ' SER . 34.0 m170 -64.93 -39.04 92.9 Favored 'General case' 0 N--CA 1.449 -0.501 0 CA-C-O 119.168 -0.444 . . . . 0.0 110.14 176.441 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 57.6 mttm -57.54 -46.88 83.36 Favored 'General case' 0 C--N 1.342 0.271 0 N-CA-C 109.329 -0.619 . . . . 0.0 109.329 179.285 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 40.1 mm-40 -64.22 -40.53 96.23 Favored 'General case' 0 N--CA 1.452 -0.354 0 C-N-CA 122.397 0.279 . . . . 0.0 111.605 -177.022 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 63.5 mttm -64.35 -29.34 70.41 Favored 'General case' 0 N--CA 1.453 -0.277 0 C-N-CA 120.342 -0.543 . . . . 0.0 110.39 179.594 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 124' ' ' ILE . . . . . . . . . . . . . 51.8 mt -75.77 -33.13 25.3 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.218 0 N-CA-C 109.874 -0.417 . . . . 0.0 109.874 176.0 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 11.3 mmm180 -66.44 -39.06 88.67 Favored 'General case' 0 C--N 1.339 0.147 0 CA-C-N 118.135 0.425 . . . . 0.0 110.466 179.676 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 126' ' ' MET . . . . . . . . . . . . . 27.8 ptm -72.43 -33.28 66.98 Favored 'General case' 0 N--CA 1.455 -0.218 0 C-N-CA 120.314 -0.554 . . . . 0.0 109.674 177.793 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 3.3 mp -64.69 -33.96 77.17 Favored 'General case' 0 N--CA 1.455 -0.212 0 N-CA-C 109.644 -0.502 . . . . 0.0 109.644 175.042 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 31.6 tp -66.4 -42.25 88.12 Favored 'General case' 0 N--CA 1.452 -0.329 0 N-CA-C 110.077 -0.342 . . . . 0.0 110.077 179.134 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 18.0 t0 -64.7 -44.72 89.35 Favored 'General case' 0 N--CA 1.455 -0.218 0 N-CA-C 110.243 -0.281 . . . . 0.0 110.243 177.856 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 59.7 mt -58.79 -35.22 54.83 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.203 0 N-CA-C 110.238 -0.282 . . . . 0.0 110.238 -179.176 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 131' ' ' TRP . . . . . . . . . . . . . 45.6 m0 . . . . . 0 N--CA 1.455 -0.182 0 N-CA-C 112.874 0.694 . . . . 0.0 112.874 -179.917 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 21.2 p-10 . . . . . 0 N--CA 1.455 -0.196 0 N-CA-C 108.549 -0.908 . . . . 0.0 108.549 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 7' ' ' PHE . . . . . 0.59 ' HB2' ' HZ3' ' A' ' 45' ' ' LYS . 1.0 OUTLIER -55.35 -33.06 63.05 Favored 'General case' 0 N--CA 1.447 -0.606 0 C-N-CA 125.584 1.554 . . . . 0.0 111.462 -177.253 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 51.1 tp60 -51.8 -36.89 49.37 Favored 'General case' 0 N--CA 1.454 -0.272 0 C-N-CA 123.201 0.601 . . . . 0.0 112.21 -176.993 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 27.6 m-80 -71.29 -36.22 71.59 Favored 'General case' 0 N--CA 1.455 -0.223 0 CA-C-O 121.175 0.512 . . . . 0.0 110.016 -179.437 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 10' ' ' PHE . . . . . 0.422 ' CE2' ' HB2' ' A' ' 32' ' ' LEU . 7.1 t80 -69.96 -39.8 75.8 Favored 'General case' 0 N--CA 1.451 -0.408 0 C-N-CA 124.05 0.94 . . . . 0.0 109.349 177.139 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 83.2 t -66.17 -51.72 56.2 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.493 0 N-CA-C 109.042 -0.725 . . . . 0.0 109.042 179.693 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -59.45 -32.12 69.93 Favored 'General case' 0 CA--C 1.53 0.175 0 C-N-CA 122.508 0.323 . . . . 0.0 111.381 -179.422 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 85.5 m -71.55 -39.53 70.62 Favored 'General case' 0 CA--C 1.531 0.246 0 N-CA-C 109.025 -0.732 . . . . 0.0 109.025 176.484 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . 0.539 ' HA ' ' CD1' ' A' ' 17' ' ' PHE . 4.9 tp -64.84 -42.15 95.14 Favored 'General case' 0 N--CA 1.45 -0.471 0 CA-C-O 121.215 0.531 . . . . 0.0 110.208 178.624 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 69.0 mm-40 -63.83 -28.06 69.6 Favored 'General case' 0 N--CA 1.45 -0.469 0 C-N-CA 124.762 1.225 . . . . 0.0 109.337 178.09 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 43.6 t -70.23 -27.35 64.4 Favored 'General case' 0 N--CA 1.449 -0.516 0 N-CA-C 110.417 -0.216 . . . . 0.0 110.417 174.942 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 17' ' ' PHE . . . . . 0.539 ' CD1' ' HA ' ' A' ' 14' ' ' LEU . 21.8 m-85 -71.42 -41.1 69.95 Favored 'General case' 0 C--N 1.338 0.108 0 C-N-CA 119.335 -0.946 . . . . 0.0 110.879 170.441 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . 0.521 ' HG2' ' CE1' ' A' ' 53' ' ' TYR . 65.9 mttt -60.62 -25.55 66.36 Favored 'General case' 0 C--N 1.34 0.19 0 CA-C-N 118.138 0.426 . . . . 0.0 111.008 175.799 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 10.6 t0 -72.47 -47.06 51.78 Favored 'General case' 0 C--N 1.331 -0.22 0 C-N-CA 123.231 0.612 . . . . 0.0 110.26 178.784 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 63.3 mt -66.78 136.31 55.28 Favored 'General case' 0 N--CA 1.453 -0.306 0 CA-C-O 120.967 0.413 . . . . 0.0 110.405 -178.769 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 1.2 mppt? -75.3 -24.24 57.46 Favored 'General case' 0 N--CA 1.454 -0.236 0 N-CA-C 109.105 -0.702 . . . . 0.0 109.105 177.35 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 80.7 p -80.94 -23.4 38.87 Favored 'General case' 0 N--CA 1.457 -0.119 0 C-N-CA 123.773 0.829 . . . . 0.0 110.391 175.845 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 72.35 -33.73 0.67 Allowed Glycine 0 CA--C 1.526 0.728 0 C-N-CA 124.846 1.212 . . . . 0.0 112.938 178.239 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 63.0 mt -76.16 147.38 7.89 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.333 0 CA-C-N 117.528 0.664 . . . . 0.0 110.109 178.112 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 32.9 t -162.37 94.2 0.88 Allowed 'General case' 0 N--CA 1.455 -0.198 0 N-CA-C 109.058 -0.719 . . . . 0.0 109.058 171.67 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . 0.414 ' O ' ' HE2' ' A' ' 30' ' ' LYS . . . -55.28 -38.33 67.95 Favored Glycine 0 CA--C 1.524 0.613 0 C-N-CA 121.12 -0.562 . . . . 0.0 111.91 -172.426 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 27' ' ' SER . . . . . 0.42 ' HA ' ' HE3' ' A' ' 30' ' ' LYS . 74.7 p -71.71 -48.66 45.69 Favored 'General case' 0 N--CA 1.452 -0.354 0 CA-C-N 118.21 1.005 . . . . 0.0 110.898 -177.196 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 71.5 mmt-85 -65.53 -38.56 90.0 Favored 'General case' 0 C--O 1.233 0.2 0 N-CA-C 109.617 -0.512 . . . . 0.0 109.617 -179.637 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 47.9 mt -59.96 -44.41 94.49 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.814 0 N-CA-C 108.71 -0.848 . . . . 0.0 108.71 176.06 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . 0.42 ' HE3' ' HA ' ' A' ' 27' ' ' SER . 49.2 mtmt -66.17 -25.79 67.12 Favored 'General case' 0 C--N 1.34 0.166 0 CA-C-O 118.727 -0.654 . . . . 0.0 111.562 177.635 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . 0.513 ' HE2' ' HA ' ' A' ' 31' ' ' LYS . 8.9 mmpt? -66.88 -57.97 5.93 Favored 'General case' 0 C--N 1.341 0.214 0 CA-C-N 119.433 1.015 . . . . 0.0 109.95 179.435 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . 0.422 ' HB2' ' CE2' ' A' ' 10' ' ' PHE . 1.4 pp -75.1 -20.07 59.64 Favored 'General case' 0 CA--C 1.53 0.194 0 C-N-CA 118.929 -1.109 . . . . 0.0 111.917 -176.782 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 54.3 m -71.16 -38.28 72.2 Favored 'General case' 0 N--CA 1.452 -0.366 0 N-CA-C 108.626 -0.879 . . . . 0.0 108.626 175.548 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 63.8 m -69.76 -37.37 76.4 Favored 'General case' 0 N--CA 1.45 -0.431 0 N-CA-C 110.032 -0.358 . . . . 0.0 110.032 -178.949 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 72.8 t80 -67.39 -33.81 75.96 Favored 'General case' 0 N--CA 1.455 -0.18 0 C-N-CA 120.279 -0.569 . . . . 0.0 110.248 177.42 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -69.47 -37.11 77.13 Favored 'General case' 0 N--CA 1.45 -0.472 0 CA-C-N 116.627 -0.261 . . . . 0.0 110.588 178.207 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 2.9 mm? -71.23 -34.5 70.84 Favored 'General case' 0 N--CA 1.456 -0.154 0 C-N-CA 122.478 0.311 . . . . 0.0 110.227 179.781 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 45.5 t0 -67.17 -26.49 66.67 Favored 'General case' 0 N--CA 1.453 -0.297 0 C-N-CA 122.315 0.246 . . . . 0.0 110.475 176.289 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 97.1 m-70 -149.0 100.29 3.05 Favored 'General case' 0 C--N 1.341 0.197 0 N-CA-C 111.82 0.304 . . . . 0.0 111.82 -175.737 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 40' ' ' ILE . . . . . 0.568 ' H ' HD12 ' A' ' 40' ' ' ILE . 0.0 OUTLIER -75.65 -13.49 15.06 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.488 0 CA-C-O 119.158 -0.449 . . . . 0.0 110.061 174.116 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 32.6 m-20 -58.15 -16.68 14.29 Favored 'General case' 0 CA--C 1.532 0.286 0 C-N-CA 123.124 0.57 . . . . 0.0 112.11 -176.07 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -113.65 19.17 7.24 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.177 0 C-N-CA 123.41 0.684 . . . . 0.0 111.834 176.903 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 2.9 pp20? -54.02 -28.84 40.8 Favored 'General case' 0 C--N 1.339 0.131 0 O-C-N 121.544 -0.722 . . . . 0.0 111.693 179.175 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 3.9 m -67.31 -44.04 80.14 Favored 'General case' 0 N--CA 1.454 -0.231 0 O-C-N 121.962 -0.461 . . . . 0.0 111.518 -176.662 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . 0.59 ' HZ3' ' HB2' ' A' ' 7' ' ' PHE . 16.6 ptpt -73.73 -27.47 61.2 Favored 'General case' 0 C--N 1.341 0.206 0 CA-C-N 118.699 0.681 . . . . 0.0 109.789 177.56 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 64.0 mt -71.45 -53.88 19.26 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.274 0 C-N-CA 123.102 0.561 . . . . 0.0 110.721 -178.29 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 34.0 mm -68.18 -39.82 81.84 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.351 0 C-N-CA 122.381 0.272 . . . . 0.0 110.313 -176.49 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 66.0 p -68.15 -33.55 74.68 Favored 'General case' 0 N--CA 1.452 -0.347 0 C-N-CA 120.219 -0.592 . . . . 0.0 110.54 179.922 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 48.4 tp -75.21 -35.13 61.52 Favored 'General case' 0 N--CA 1.453 -0.286 0 N-CA-C 113.033 0.753 . . . . 0.0 113.033 -177.823 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 3.4 pt -73.06 -42.61 59.21 Favored 'Isoleucine or valine' 0 CA--C 1.526 0.041 0 CA-C-N 118.788 0.722 . . . . 0.0 111.137 179.311 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 21.8 pt -65.79 -39.17 84.01 Favored 'Isoleucine or valine' 0 CA--C 1.528 0.112 0 C-N-CA 119.649 -0.821 . . . . 0.0 110.708 177.707 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 84.8 m-20 -68.79 -35.44 77.04 Favored 'General case' 0 N--CA 1.453 -0.325 0 CA-C-N 118.248 0.476 . . . . 0.0 111.279 177.901 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 53' ' ' TYR . . . . . 0.521 ' CE1' ' HG2' ' A' ' 18' ' ' LYS . 7.7 t80 -62.02 -45.33 94.04 Favored 'General case' 0 N--CA 1.453 -0.301 0 N-CA-C 108.501 -0.926 . . . . 0.0 108.501 174.781 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 20.5 m -63.27 -33.93 76.58 Favored 'General case' 0 N--CA 1.454 -0.232 0 C-N-CA 123.258 0.623 . . . . 0.0 111.99 -175.193 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 64.6 mtm180 -79.0 -42.65 26.1 Favored 'General case' 0 N--CA 1.455 -0.201 0 N-CA-C 111.883 0.327 . . . . 0.0 111.883 -176.685 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 45.2 mt -77.47 -43.29 32.81 Favored 'General case' 0 N--CA 1.457 -0.08 0 N-CA-C 112.309 0.485 . . . . 0.0 112.309 -177.743 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 57' ' ' CYS . . . . . 0.443 ' HB2' ' HD2' ' A' ' 58' ' ' PRO . 10.6 p -67.49 161.42 65.37 Favored Pre-proline 0 CA--C 1.532 0.264 0 N-CA-C 113.049 0.759 . . . . 0.0 113.049 -173.489 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 58' ' ' PRO . . . . . 0.443 ' HD2' ' HB2' ' A' ' 57' ' ' CYS . 86.3 Cg_endo -72.89 179.25 5.5 Favored 'Trans proline' 0 N--CA 1.454 -0.823 0 C-N-CA 124.249 3.299 . . . . 0.0 110.59 174.614 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 59' ' ' ASP . . . . . 0.48 ' CG ' ' HA ' ' A' ' 116' ' ' SER . 49.9 t0 -55.37 -52.52 63.24 Favored 'General case' 0 N--CA 1.453 -0.311 0 N-CA-C 113.958 1.095 . . . . 0.0 113.958 -173.479 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 97.4 p -63.4 -39.61 94.96 Favored 'General case' 0 C--O 1.231 0.131 0 CA-C-N 119.091 0.86 . . . . 0.0 110.545 -174.297 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 49.6 m170 -66.11 -34.71 78.67 Favored 'General case' 0 N--CA 1.452 -0.348 0 N-CA-C 109.666 -0.494 . . . . 0.0 109.666 175.54 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . 0.548 ' HE3' HD11 ' A' ' 124' ' ' ILE . 0.0 OUTLIER -72.36 -32.1 66.18 Favored 'General case' 0 N--CA 1.453 -0.283 0 C-N-CA 122.893 0.477 . . . . 0.0 111.954 -178.464 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 1.7 tm? -75.29 -35.11 61.34 Favored 'General case' 0 CA--C 1.532 0.276 0 N-CA-C 107.783 -1.192 . . . . 0.0 107.783 178.699 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -71.49 -31.64 65.42 Favored Glycine 0 CA--C 1.526 0.77 0 N-CA-C 111.601 -0.6 . . . . 0.0 111.601 176.449 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 82.6 p -71.96 -31.47 66.33 Favored 'General case' 0 N--CA 1.451 -0.401 0 O-C-N 121.822 -0.81 . . . . 0.0 109.882 177.797 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 76.8 mt -75.05 -25.08 58.4 Favored 'General case' 0 N--CA 1.455 -0.222 0 CA-C-O 119.568 -0.253 . . . . 0.0 110.413 174.781 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 4.1 m-30 -66.5 -36.26 82.29 Favored 'General case' 0 CA--C 1.516 -0.341 0 N-CA-C 109.453 -0.573 . . . . 0.0 109.453 172.465 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 68' ' ' ILE . . . . . 0.441 HD13 ' CE1' ' A' ' 17' ' ' PHE . 41.0 mt -68.32 -55.82 14.86 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.567 0 N-CA-C 108.758 -0.83 . . . . 0.0 108.758 178.03 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 61.9 mt -47.87 -37.67 6.45 Favored 'Isoleucine or valine' 0 C--N 1.343 0.297 0 C-N-CA 124.089 0.956 . . . . 0.0 111.742 176.016 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 15.4 t70 -70.4 -44.07 68.73 Favored 'General case' 0 C--O 1.233 0.203 0 CA-C-N 118.557 0.617 . . . . 0.0 110.881 178.976 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 20.4 m -68.97 -52.32 30.2 Favored 'General case' 0 N--CA 1.455 -0.183 0 N-CA-C 110.202 -0.296 . . . . 0.0 110.202 -175.46 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 72' ' ' ILE . . . . . 0.462 HD12 ' CZ ' ' A' ' 76' ' ' TYR . 0.0 OUTLIER -73.97 -31.04 29.28 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.403 0 N-CA-C 109.68 -0.489 . . . . 0.0 109.68 -176.403 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -68.76 -53.84 17.87 Favored Glycine 0 C--N 1.338 0.694 0 N-CA-C 111.695 -0.562 . . . . 0.0 111.695 -175.458 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 37.8 mtm105 -68.5 -39.5 81.24 Favored 'General case' 0 N--CA 1.452 -0.335 0 C-N-CA 120.672 -0.411 . . . . 0.0 110.157 179.844 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -65.26 -30.9 71.81 Favored 'General case' 0 N--CA 1.451 -0.386 0 C-N-CA 120.457 -0.497 . . . . 0.0 110.755 -179.183 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 76' ' ' TYR . . . . . 0.462 ' CZ ' HD12 ' A' ' 72' ' ' ILE . 1.4 m-30 -68.23 -48.06 66.14 Favored 'General case' 0 CA--C 1.517 -0.318 0 CA-C-N 118.225 0.466 . . . . 0.0 110.779 176.358 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 51.3 tp -68.59 -37.25 79.69 Favored 'General case' 0 N--CA 1.448 -0.534 0 C-N-CA 118.617 -1.233 . . . . 0.0 110.021 -177.669 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 96.5 m-20 -67.87 -40.27 83.61 Favored 'General case' 0 C--N 1.333 -0.139 0 N-CA-C 113.273 0.842 . . . . 0.0 113.273 -179.584 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 13.6 mm-40 -65.8 -48.37 71.97 Favored 'General case' 0 N--CA 1.456 -0.175 0 C-N-CA 119.917 -0.713 . . . . 0.0 110.336 174.06 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 76.5 p -66.53 -26.86 67.35 Favored 'General case' 0 CA--C 1.529 0.145 0 CA-C-N 118.505 0.593 . . . . 0.0 111.251 -179.632 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 74.7 mtt180 -65.41 -37.75 87.88 Favored 'General case' 0 C--N 1.338 0.067 0 C-N-CA 122.717 0.407 . . . . 0.0 110.393 170.858 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 20.7 m . . . . . 0 N--CA 1.452 -0.326 0 N-CA-C 112.07 0.396 . . . . 0.0 112.07 -176.645 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 91.0 Cg_endo . . . . . 0 N--CA 1.454 -0.83 0 N-CA-C 108.951 -1.211 . . . . 0.0 108.951 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 92' ' ' GLY . . . . . 0.426 ' HA2' ' O ' ' A' ' 40' ' ' ILE . . . 97.73 16.65 33.09 Favored Glycine 0 CA--C 1.527 0.842 0 CA-C-O 119.507 -0.607 . . . . 0.0 113.793 179.944 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 21.9 p -152.22 169.36 22.66 Favored 'General case' 0 C--O 1.231 0.099 0 CA-C-N 118.14 0.97 . . . . 0.0 110.508 178.179 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 94' ' ' CYS . . . . . 0.443 ' HB2' HD13 ' A' ' 98' ' ' ILE . 30.0 p -57.8 -23.24 51.52 Favored 'General case' 0 N--CA 1.449 -0.514 0 CA-C-N 115.956 -0.565 . . . . 0.0 109.64 175.88 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -60.38 -55.84 28.68 Favored 'General case' 0 N--CA 1.446 -0.659 0 N-CA-C 109.358 -0.608 . . . . 0.0 109.358 -178.013 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 53.9 t60 -76.06 -29.5 58.04 Favored 'General case' 0 N--CA 1.451 -0.401 0 N-CA-C 111.608 0.225 . . . . 0.0 111.608 179.997 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -67.58 -49.46 63.04 Favored 'General case' 0 N--CA 1.448 -0.528 0 N-CA-C 110.493 -0.188 . . . . 0.0 110.493 -178.596 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 98' ' ' ILE . . . . . 0.443 HD13 ' HB2' ' A' ' 94' ' ' CYS . 2.1 mp -72.47 -26.84 24.83 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.313 0 C-N-CA 120.546 -0.461 . . . . 0.0 110.062 178.78 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 3.7 m120 -63.69 -45.0 92.02 Favored 'General case' 0 N--CA 1.454 -0.264 0 CA-C-N 118.912 0.778 . . . . 0.0 110.193 173.251 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 85.0 m -65.04 -35.5 81.38 Favored 'General case' 0 N--CA 1.455 -0.189 0 C-N-CA 122.705 0.402 . . . . 0.0 110.967 -176.395 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 93.3 mt -75.74 -35.36 60.24 Favored 'General case' 0 N--CA 1.448 -0.559 0 N-CA-C 110.501 -0.185 . . . . 0.0 110.501 176.461 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -75.44 -30.23 58.73 Favored Glycine 0 CA--C 1.527 0.813 0 CA-C-O 119.785 -0.453 . . . . 0.0 112.941 -175.843 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 25.8 pt-20 -75.99 -6.11 49.43 Favored 'General case' 0 CA--C 1.53 0.183 0 CA-C-N 117.856 0.828 . . . . 0.0 111.926 -177.348 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 27.0 m -140.17 21.04 0.56 Allowed 'Isoleucine or valine' 0 CA--C 1.531 0.218 0 CA-C-N 118.102 0.41 . . . . 0.0 111.064 175.524 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 105' ' ' ILE . . . . . . . . . . . . . 10.0 tp -62.05 -39.21 82.95 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.288 0 CA-C-N 118.033 0.379 . . . . 0.0 111.768 -173.958 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 13.3 pt20 -73.86 -31.08 63.0 Favored 'General case' 0 N--CA 1.454 -0.228 0 O-C-N 122.009 -0.432 . . . . 0.0 110.19 -179.421 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 58.7 mm-40 -76.11 -41.42 50.28 Favored 'General case' 0 N--CA 1.454 -0.258 0 CA-C-N 117.743 0.247 . . . . 0.0 110.467 -179.863 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 65.7 tp -70.32 -38.49 74.94 Favored 'General case' 0 N--CA 1.45 -0.463 0 C-N-CA 122.657 0.383 . . . . 0.0 110.61 -177.775 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 88.5 mt -73.44 -42.51 61.9 Favored 'General case' 0 N--CA 1.453 -0.31 0 C-N-CA 120.692 -0.403 . . . . 0.0 110.16 177.386 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 45.6 t -58.07 -43.96 87.26 Favored 'General case' 0 N--CA 1.456 -0.129 0 CA-C-N 118.187 0.449 . . . . 0.0 110.465 178.753 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 55.0 t0 -64.48 -39.72 94.33 Favored 'General case' 0 N--CA 1.453 -0.299 0 N-CA-C 108.682 -0.859 . . . . 0.0 108.682 175.59 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -66.39 -38.32 87.26 Favored 'General case' 0 N--CA 1.444 -0.742 0 N-CA-C 112.202 0.445 . . . . 0.0 112.202 -175.89 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 113' ' ' ILE . . . . . . . . . . . . . 9.3 mm -71.83 -38.99 67.26 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.287 0 CA-C-N 118.462 0.574 . . . . 0.0 109.809 179.816 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -71.26 -35.44 71.4 Favored 'General case' 0 CA--C 1.531 0.23 0 N-CA-C 112.247 0.462 . . . . 0.0 112.247 178.916 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 5.2 tppp? -74.15 -32.91 63.33 Favored 'General case' 0 N--CA 1.456 -0.141 0 C-N-CA 123.004 0.522 . . . . 0.0 110.779 178.436 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 116' ' ' SER . . . . . 0.48 ' HA ' ' CG ' ' A' ' 59' ' ' ASP . 94.4 p -90.93 142.86 27.32 Favored 'General case' 0 N--CA 1.452 -0.37 0 N-CA-C 113.188 0.811 . . . . 0.0 113.188 -169.972 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 14.0 t-20 -76.82 170.53 16.3 Favored 'General case' 0 N--CA 1.454 -0.23 0 N-CA-C 109.013 -0.736 . . . . 0.0 109.013 173.456 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 118' ' ' GLN . . . . . . . . . . . . . 13.9 mm100 -58.88 -32.2 69.27 Favored 'General case' 0 CA--C 1.528 0.097 0 N-CA-C 112.489 0.551 . . . . 0.0 112.489 -170.859 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 10.5 t0 -63.22 -51.81 64.78 Favored 'General case' 0 C--O 1.233 0.221 0 CA-C-O 121.508 0.671 . . . . 0.0 109.257 175.572 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 120' ' ' HIS . . . . . 0.468 ' CE1' ' HZ1' ' A' ' 123' ' ' LYS . 98.5 m-70 -72.83 -25.44 61.13 Favored 'General case' 0 N--CA 1.447 -0.595 0 CA-C-N 116.046 -0.524 . . . . 0.0 111.098 -177.555 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 56.3 mttp -61.44 -44.65 96.75 Favored 'General case' 0 C--N 1.338 0.073 0 N-CA-C 108.973 -0.751 . . . . 0.0 108.973 172.012 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 41.0 tp10 -67.63 -35.78 79.56 Favored 'General case' 0 N--CA 1.454 -0.246 0 C-N-CA 122.185 0.194 . . . . 0.0 111.123 -177.223 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 123' ' ' LYS . . . . . 0.468 ' HZ1' ' CE1' ' A' ' 120' ' ' HIS . 43.7 mtmt -71.21 -30.23 66.12 Favored 'General case' 0 N--CA 1.454 -0.246 0 O-C-N 122.129 -0.357 . . . . 0.0 110.537 178.147 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 124' ' ' ILE . . . . . 0.548 HD11 ' HE3' ' A' ' 62' ' ' LYS . 56.4 mt -68.8 -37.69 77.78 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.195 0 N-CA-C 108.891 -0.781 . . . . 0.0 108.891 171.802 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 6.1 mmm180 -61.5 -45.33 94.65 Favored 'General case' 0 N--CA 1.453 -0.284 0 CA-C-O 118.717 -0.659 . . . . 0.0 111.476 -179.606 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 126' ' ' MET . . . . . . . . . . . . . 28.5 ptm -64.85 -34.34 78.15 Favored 'General case' 0 N--CA 1.455 -0.176 0 C-N-CA 119.187 -1.005 . . . . 0.0 108.923 177.712 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 3.6 mp -64.41 -39.82 94.59 Favored 'General case' 0 CA--C 1.531 0.224 0 CA-C-N 118.317 0.508 . . . . 0.0 110.873 175.742 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 81.3 mt -70.23 -30.59 67.71 Favored 'General case' 0 N--CA 1.454 -0.263 0 CA-C-N 118.404 0.547 . . . . 0.0 111.191 179.755 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 48.5 m-20 -73.97 -35.86 64.52 Favored 'General case' 0 N--CA 1.456 -0.143 0 N-CA-C 109.951 -0.389 . . . . 0.0 109.951 176.102 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 60.1 mt -62.15 -35.8 70.87 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.22 0 N-CA-C 109.133 -0.691 . . . . 0.0 109.133 175.273 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 131' ' ' TRP . . . . . . . . . . . . . 43.3 m0 . . . . . 0 N--CA 1.455 -0.21 0 N-CA-C 112.975 0.732 . . . . 0.0 112.975 179.536 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 28.6 p-10 . . . . . 0 N--CA 1.452 -0.342 0 CA-C-O 120.555 0.217 . . . . 0.0 110.434 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 7' ' ' PHE . . . . . 0.526 ' HB2' ' HZ3' ' A' ' 45' ' ' LYS . 1.5 t80 -59.18 -41.97 89.73 Favored 'General case' 0 N--CA 1.449 -0.508 0 CA-C-N 116.746 -0.207 . . . . 0.0 110.489 -178.984 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 9.7 tp60 -55.18 -32.74 62.41 Favored 'General case' 0 N--CA 1.454 -0.252 0 C-N-CA 122.635 0.374 . . . . 0.0 110.934 -178.793 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 27.4 m-20 -70.84 -34.64 71.88 Favored 'General case' 0 N--CA 1.45 -0.455 0 N-CA-C 109.49 -0.559 . . . . 0.0 109.49 179.856 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 10' ' ' PHE . . . . . 0.515 ' CE2' ' HB2' ' A' ' 32' ' ' LEU . 11.7 t80 -69.14 -41.45 77.29 Favored 'General case' 0 N--CA 1.453 -0.284 0 C-N-CA 123.295 0.638 . . . . 0.0 109.411 175.503 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 94.6 t -63.68 -50.1 79.42 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.36 0 N-CA-C 109.032 -0.729 . . . . 0.0 109.032 179.771 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -61.13 -28.45 69.11 Favored 'General case' 0 N--CA 1.451 -0.409 0 C-N-CA 122.702 0.401 . . . . 0.0 111.137 179.731 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 85.8 m -73.98 -38.22 64.23 Favored 'General case' 0 N--CA 1.454 -0.266 0 N-CA-C 109.335 -0.617 . . . . 0.0 109.335 175.817 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . 0.405 ' HA ' ' CD1' ' A' ' 17' ' ' PHE . 0.1 OUTLIER -64.67 -43.82 92.36 Favored 'General case' 0 N--CA 1.453 -0.285 0 N-CA-C 108.809 -0.811 . . . . 0.0 108.809 176.916 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 66.4 mm-40 -65.22 -29.05 69.82 Favored 'General case' 0 N--CA 1.454 -0.243 0 C-N-CA 123.88 0.872 . . . . 0.0 109.988 178.633 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 67.0 m -69.76 -29.03 66.28 Favored 'General case' 0 N--CA 1.451 -0.397 0 N-CA-C 109.787 -0.449 . . . . 0.0 109.787 176.968 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 17' ' ' PHE . . . . . 0.412 ' CD1' HD12 ' A' ' 68' ' ' ILE . 18.4 m-85 -68.55 -40.49 80.62 Favored 'General case' 0 N--CA 1.456 -0.151 0 C-N-CA 120.195 -0.602 . . . . 0.0 109.869 172.814 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 65.5 mttt -65.48 -26.14 67.8 Favored 'General case' 0 N--CA 1.463 0.187 0 CA-C-O 121.134 0.492 . . . . 0.0 110.544 178.338 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 31.7 t0 -81.04 -6.81 59.24 Favored 'General case' 0 CA--C 1.536 0.442 0 C-N-CA 123.748 0.819 . . . . 0.0 112.99 -178.537 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . 0.428 ' CD1' ' HB2' ' A' ' 25' ' ' SER . 18.4 mt -93.6 151.01 19.96 Favored 'General case' 0 N--CA 1.455 -0.2 0 N-CA-C 113.17 0.804 . . . . 0.0 113.17 -176.558 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -71.75 -6.36 40.77 Favored 'General case' 0 CA--C 1.53 0.188 0 C-N-CA 124.049 0.939 . . . . 0.0 112.978 178.532 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 22' ' ' SER . . . . . 0.449 ' C ' ' H ' ' A' ' 24' ' ' ILE . 58.9 m -137.85 -7.8 1.63 Allowed 'General case' 0 CA--C 1.522 -0.096 0 N-CA-C 112.925 0.713 . . . . 0.0 112.925 -176.875 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 72.52 -25.69 0.74 Allowed Glycine 0 CA--C 1.528 0.859 0 C-N-CA 123.758 0.694 . . . . 0.0 112.512 -179.805 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . 0.449 ' H ' ' C ' ' A' ' 22' ' ' SER . 94.8 mt -76.98 141.64 15.35 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.263 0 N-CA-C 108.012 -1.107 . . . . 0.0 108.012 175.388 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 25' ' ' SER . . . . . 0.428 ' HB2' ' CD1' ' A' ' 20' ' ' LEU . 7.5 t -160.51 79.88 0.65 Allowed 'General case' 0 CA--C 1.518 -0.254 0 N-CA-C 110.209 -0.293 . . . . 0.0 110.209 -174.598 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -48.28 -49.95 24.19 Favored Glycine 0 CA--C 1.527 0.782 0 CA-C-O 118.851 -0.972 . . . . 0.0 114.17 -171.002 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 27' ' ' SER . . . . . 0.509 ' HA ' ' HE3' ' A' ' 30' ' ' LYS . 47.3 p -73.27 -33.34 65.2 Favored 'General case' 0 C--N 1.339 0.14 0 CA-C-N 119.962 1.881 . . . . 0.0 111.641 -174.54 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 2.3 mpt_? -73.91 -36.8 64.76 Favored 'General case' 0 N--CA 1.456 -0.147 0 N-CA-C 109.253 -0.647 . . . . 0.0 109.253 177.344 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 74.5 mt -61.25 -47.51 93.17 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.287 0 N-CA-C 109.007 -0.738 . . . . 0.0 109.007 175.417 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . 0.509 ' HE3' ' HA ' ' A' ' 27' ' ' SER . 52.1 mtmt -64.87 -30.15 71.14 Favored 'General case' 0 C--N 1.339 0.122 0 CA-C-O 119.36 -0.352 . . . . 0.0 111.135 179.65 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . 0.456 ' CE ' ' HA ' ' A' ' 31' ' ' LYS . 2.8 mmpt? -65.87 -60.07 3.23 Favored 'General case' 0 N--CA 1.455 -0.223 0 CA-C-N 118.455 0.57 . . . . 0.0 111.328 -179.942 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . 0.515 ' HB2' ' CE2' ' A' ' 10' ' ' PHE . 1.2 pp -75.89 -16.55 60.02 Favored 'General case' 0 CA--C 1.532 0.276 0 C-N-CA 119.247 -0.981 . . . . 0.0 111.687 -177.925 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 24.7 m -70.26 -42.94 71.49 Favored 'General case' 0 N--CA 1.454 -0.232 0 N-CA-C 108.398 -0.964 . . . . 0.0 108.398 173.338 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 93.5 m -66.65 -41.46 88.19 Favored 'General case' 0 N--CA 1.45 -0.459 0 N-CA-C 109.664 -0.495 . . . . 0.0 109.664 -178.728 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 23.8 t80 -60.49 -36.53 78.54 Favored 'General case' 0 C--N 1.339 0.122 0 N-CA-C 110.155 -0.313 . . . . 0.0 110.155 177.073 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -72.3 -28.12 62.88 Favored 'General case' 0 N--CA 1.451 -0.391 0 CA-C-O 119.211 -0.423 . . . . 0.0 111.516 179.457 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 2.7 mm? -82.12 -34.08 29.4 Favored 'General case' 0 CA--C 1.518 -0.281 0 N-CA-C 108.822 -0.807 . . . . 0.0 108.822 -177.923 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 86.7 m-20 -64.4 -27.19 68.83 Favored 'General case' 0 N--CA 1.444 -0.766 0 C-N-CA 123.652 0.781 . . . . 0.0 110.959 174.274 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 65.8 m80 -151.53 106.62 3.29 Favored 'General case' 0 N--CA 1.454 -0.234 0 C-N-CA 122.624 0.37 . . . . 0.0 111.621 -179.187 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 40' ' ' ILE . . . . . 0.554 ' H ' HD13 ' A' ' 40' ' ' ILE . 0.0 OUTLIER -80.53 -10.15 12.3 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.359 0 C-N-CA 123.058 0.543 . . . . 0.0 109.728 173.631 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -55.4 -23.39 24.45 Favored 'General case' 0 N--CA 1.457 -0.122 0 C-N-CA 123.86 0.864 . . . . 0.0 111.86 -178.016 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -108.6 18.0 6.74 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.246 0 C-N-CA 124.032 0.933 . . . . 0.0 111.95 -179.83 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 3.0 pp20? -53.33 -30.1 37.46 Favored 'General case' 0 CA--C 1.53 0.183 0 O-C-N 121.649 -0.657 . . . . 0.0 111.598 178.985 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 47.1 t -65.33 -44.49 87.61 Favored 'General case' 0 CA--C 1.53 0.196 0 N-CA-C 111.756 0.28 . . . . 0.0 111.756 -175.89 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . 0.526 ' HZ3' ' HB2' ' A' ' 7' ' ' PHE . 19.4 ptpt -73.94 -24.79 59.71 Favored 'General case' 0 C--N 1.341 0.22 0 O-C-N 121.738 -0.601 . . . . 0.0 110.167 179.253 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 84.8 mt -72.99 -48.17 45.4 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.327 0 C-N-CA 122.873 0.469 . . . . 0.0 109.948 -179.475 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 35.5 mm -63.92 -35.54 73.69 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.323 0 N-CA-C 109.646 -0.501 . . . . 0.0 109.646 178.977 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 15.4 t -63.25 -45.76 90.06 Favored 'General case' 0 N--CA 1.453 -0.276 0 C-N-CA 119.813 -0.755 . . . . 0.0 110.557 178.158 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 25.7 mt -66.6 -33.6 76.03 Favored 'General case' 0 N--CA 1.451 -0.415 0 CA-C-O 118.677 -0.677 . . . . 0.0 112.684 -175.671 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 15.9 pt -69.58 -42.64 80.67 Favored 'Isoleucine or valine' 0 C--N 1.339 0.12 0 CA-C-N 119.553 1.069 . . . . 0.0 110.85 177.077 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 37.7 pt -71.03 -39.86 75.32 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.173 0 C-N-CA 119.926 -0.71 . . . . 0.0 111.13 179.8 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 79.7 m-20 -65.99 -42.31 89.98 Favored 'General case' 0 N--CA 1.454 -0.238 0 C-N-CA 122.492 0.317 . . . . 0.0 110.589 178.984 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 14.5 t80 -64.95 -45.23 86.63 Favored 'General case' 0 N--CA 1.451 -0.419 0 N-CA-C 109.566 -0.531 . . . . 0.0 109.566 178.266 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 23.7 m -63.84 -30.16 71.27 Favored 'General case' 0 N--CA 1.456 -0.156 0 N-CA-C 111.502 0.186 . . . . 0.0 111.502 -177.522 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 15.6 tpp180 -75.63 -45.07 39.44 Favored 'General case' 0 N--CA 1.453 -0.281 0 O-C-N 122.957 0.161 . . . . 0.0 110.822 -177.16 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 42.0 mt -83.71 -43.4 15.56 Favored 'General case' 0 N--CA 1.456 -0.154 0 N-CA-C 113.379 0.881 . . . . 0.0 113.379 -174.912 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 9.0 p -64.42 154.42 83.85 Favored Pre-proline 0 CA--C 1.535 0.4 0 N-CA-C 113.074 0.768 . . . . 0.0 113.074 -172.088 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 94.6 Cg_endo -74.43 171.6 17.79 Favored 'Trans proline' 0 N--CA 1.455 -0.745 0 C-N-CA 125.125 3.883 . . . . 0.0 111.824 179.806 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -43.5 -49.14 7.39 Favored 'General case' 0 CA--C 1.532 0.255 0 C-N-CA 125.909 1.684 . . . . 0.0 113.794 -174.173 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 87.9 p -70.08 -35.34 74.12 Favored 'General case' 0 N--CA 1.457 -0.118 0 O-C-N 121.967 -0.458 . . . . 0.0 110.684 -176.408 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 62.3 m170 -75.33 -24.91 57.45 Favored 'General case' 0 N--CA 1.45 -0.438 0 CA-C-O 119.28 -0.39 . . . . 0.0 110.379 178.617 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 66.3 mttm -64.61 -47.76 77.43 Favored 'General case' 0 C--N 1.342 0.251 0 N-CA-C 109.094 -0.706 . . . . 0.0 109.094 172.913 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -58.93 -43.23 91.12 Favored 'General case' 0 CA--C 1.533 0.316 0 N-CA-C 108.003 -1.11 . . . . 0.0 108.003 177.454 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -63.02 -34.84 91.05 Favored Glycine 0 CA--C 1.526 0.733 0 N-CA-C 111.146 -0.782 . . . . 0.0 111.146 -179.582 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 44.6 t -67.32 -39.18 85.84 Favored 'General case' 0 N--CA 1.452 -0.337 0 CA-C-N 117.61 0.705 . . . . 0.0 109.644 177.409 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 8.0 mp -64.27 -28.92 70.05 Favored 'General case' 0 N--CA 1.453 -0.324 0 N-CA-C 110.098 -0.334 . . . . 0.0 110.098 178.38 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 0.9 OUTLIER -69.96 -41.27 74.71 Favored 'General case' 0 CA--C 1.528 0.123 0 CA-C-N 117.784 0.265 . . . . 0.0 110.59 175.673 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 68' ' ' ILE . . . . . 0.412 HD12 ' CD1' ' A' ' 17' ' ' PHE . 8.3 mt -64.19 -48.56 85.11 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.269 0 N-CA-C 109.73 -0.471 . . . . 0.0 109.73 176.874 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 91.2 mt -57.75 -33.71 46.02 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.317 0 C-N-CA 123.129 0.572 . . . . 0.0 111.504 178.117 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 17.6 t70 -69.63 -41.84 75.11 Favored 'General case' 0 CA--C 1.521 -0.139 0 CA-C-N 119.116 0.871 . . . . 0.0 110.563 176.986 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 35.4 t -66.24 -59.6 3.58 Favored 'General case' 0 N--CA 1.45 -0.431 0 C-N-CA 122.672 0.389 . . . . 0.0 110.279 -177.381 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -75.17 -33.05 27.56 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.272 0 O-C-N 122.262 -0.274 . . . . 0.0 110.511 -177.217 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -68.33 -50.32 39.41 Favored Glycine 0 CA--C 1.524 0.613 0 N-CA-C 111.739 -0.544 . . . . 0.0 111.739 -174.119 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 41.6 mtm105 -72.13 -39.17 69.0 Favored 'General case' 0 N--CA 1.452 -0.347 0 CA-C-N 117.482 0.641 . . . . 0.0 109.753 179.061 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -62.56 -30.33 71.23 Favored 'General case' 0 N--CA 1.45 -0.461 0 C-N-CA 119.788 -0.765 . . . . 0.0 110.334 -179.611 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 1.7 m-30 -70.02 -53.46 17.49 Favored 'General case' 0 CA--C 1.518 -0.25 0 CA-C-N 118.161 0.437 . . . . 0.0 111.133 176.317 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -71.4 -32.0 67.92 Favored 'General case' 0 N--CA 1.449 -0.512 0 C-N-CA 117.751 -1.58 . . . . 0.0 109.865 -175.04 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 85.5 m-20 -68.9 -45.57 70.57 Favored 'General case' 0 N--CA 1.457 -0.096 0 CA-C-N 118.218 0.463 . . . . 0.0 112.152 179.378 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 15.7 tm-20 -65.19 -50.13 67.08 Favored 'General case' 0 N--CA 1.444 -0.727 0 C-N-CA 120.764 -0.374 . . . . 0.0 110.64 179.705 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 69.3 p -64.74 -27.11 68.68 Favored 'General case' 0 N--CA 1.454 -0.262 0 N-CA-C 111.708 0.262 . . . . 0.0 111.708 -179.242 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 32.8 ttp-105 -75.26 -30.56 60.51 Favored 'General case' 0 N--CA 1.456 -0.156 0 C-N-CA 122.806 0.442 . . . . 0.0 110.807 175.468 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 19.8 m . . . . . 0 N--CA 1.454 -0.232 0 C-N-CA 122.894 0.478 . . . . 0.0 111.673 -179.75 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 31.2 Cg_exo . . . . . 0 N--CA 1.451 -1.022 0 N-CA-C 109.368 -1.051 . . . . 0.0 109.368 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 83.6 13.81 74.9 Favored Glycine 0 CA--C 1.528 0.871 0 N-CA-C 111.65 -0.58 . . . . 0.0 111.65 -177.088 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -153.52 165.23 36.53 Favored 'General case' 0 N--CA 1.454 -0.245 0 C-N-CA 124.534 1.134 . . . . 0.0 109.469 -179.845 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 94' ' ' CYS . . . . . . . . . . . . . 29.4 p -56.22 -21.35 22.76 Favored 'General case' 0 N--CA 1.453 -0.305 0 C-N-CA 123.519 0.728 . . . . 0.0 110.925 177.323 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -58.31 -63.44 1.27 Allowed 'General case' 0 N--CA 1.447 -0.616 0 O-C-N 122.297 -0.252 . . . . 0.0 110.327 -176.111 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 76.8 t60 -71.62 -33.28 68.83 Favored 'General case' 0 N--CA 1.451 -0.418 0 CA-C-N 117.609 0.186 . . . . 0.0 110.514 -179.489 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -62.75 -52.78 61.89 Favored 'General case' 0 N--CA 1.451 -0.388 0 O-C-N 123.229 0.331 . . . . 0.0 111.535 -176.837 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 1.8 mp -71.82 -36.11 57.31 Favored 'Isoleucine or valine' 0 C--N 1.338 0.097 0 C-N-CA 121.001 -0.28 . . . . 0.0 110.75 -178.69 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 24.4 m-80 -69.02 -38.51 79.25 Favored 'General case' 0 N--CA 1.455 -0.2 0 CA-C-N 118.442 0.565 . . . . 0.0 111.736 -179.996 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 99.6 m -73.37 -33.68 65.18 Favored 'General case' 0 N--CA 1.456 -0.143 0 CA-C-N 118.422 0.555 . . . . 0.0 110.449 -178.98 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 62.6 tp -75.29 -37.56 60.79 Favored 'General case' 0 N--CA 1.449 -0.489 0 N-CA-C 110.317 -0.253 . . . . 0.0 110.317 179.707 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -61.96 -22.75 62.83 Favored Glycine 0 CA--C 1.527 0.81 0 CA-C-O 119.448 -0.64 . . . . 0.0 113.138 -173.752 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 13.7 mm-40 -80.14 -39.32 29.67 Favored 'General case' 0 N--CA 1.452 -0.36 0 CA-C-N 117.702 0.751 . . . . 0.0 112.403 -179.939 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 21.7 m -100.61 -14.77 7.8 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.092 0 N-CA-C 112.992 0.738 . . . . 0.0 112.992 -175.746 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 105' ' ' ILE . . . . . . . . . . . . . 9.8 tp -63.5 -26.8 41.62 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.206 0 CA-C-N 118.511 0.596 . . . . 0.0 111.206 -177.458 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 20.3 pt20 -66.27 -29.85 70.17 Favored 'General case' 0 N--CA 1.452 -0.361 0 O-C-N 122.006 -0.434 . . . . 0.0 111.039 -179.937 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 84.0 mt-10 -73.74 -40.7 63.34 Favored 'General case' 0 N--CA 1.453 -0.31 0 N-CA-C 109.511 -0.552 . . . . 0.0 109.511 177.395 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 66.1 mt -74.96 -35.94 62.08 Favored 'General case' 0 N--CA 1.451 -0.405 0 C-N-CA 122.996 0.518 . . . . 0.0 111.343 -174.853 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 92.7 mt -70.54 -52.71 19.84 Favored 'General case' 0 N--CA 1.452 -0.341 0 N-CA-C 109.583 -0.525 . . . . 0.0 109.583 177.163 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 13.1 t -59.26 -37.43 77.6 Favored 'General case' 0 N--CA 1.453 -0.276 0 CA-C-N 117.749 0.249 . . . . 0.0 111.034 -178.153 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 36.9 t0 -62.87 -45.75 91.1 Favored 'General case' 0 N--CA 1.454 -0.267 0 N-CA-C 108.883 -0.784 . . . . 0.0 108.883 174.59 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -65.7 -30.36 71.03 Favored 'General case' 0 N--CA 1.448 -0.569 0 CA-C-O 118.959 -0.543 . . . . 0.0 110.837 -176.538 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 113' ' ' ILE . . . . . . . . . . . . . 49.6 mm -68.19 -50.78 54.91 Favored 'Isoleucine or valine' 0 C--N 1.34 0.156 0 CA-C-N 119.073 0.851 . . . . 0.0 109.56 177.647 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -69.63 -41.29 75.82 Favored 'General case' 0 N--CA 1.449 -0.501 0 O-C-N 123.03 0.207 . . . . 0.0 111.088 -175.381 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 115' ' ' LYS . . . . . 0.58 ' HE2' ' HA ' ' A' ' 115' ' ' LYS . 0.6 OUTLIER -75.61 -40.42 56.4 Favored 'General case' 0 N--CA 1.45 -0.429 0 N-CA-C 113.977 1.103 . . . . 0.0 113.977 -176.521 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 116' ' ' SER . . . . . 0.437 ' HB3' ' CB ' ' A' ' 120' ' ' HIS . 2.4 m -80.53 157.33 26.14 Favored 'General case' 0 CA--C 1.53 0.188 0 C-N-CA 120.181 -0.608 . . . . 0.0 112.539 -169.156 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 62.9 t30 -72.74 171.35 12.76 Favored 'General case' 0 CA--C 1.531 0.213 0 C-N-CA 124.05 0.94 . . . . 0.0 111.887 -174.845 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 118' ' ' GLN . . . . . . . . . . . . . 53.6 mt-30 -51.4 -44.3 62.18 Favored 'General case' 0 C--O 1.231 0.115 0 C-N-CA 123.615 0.766 . . . . 0.0 111.553 -176.826 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 22.5 t0 -65.97 -33.04 74.9 Favored 'General case' 0 N--CA 1.454 -0.234 0 CA-C-O 121.469 0.652 . . . . 0.0 109.975 -179.717 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 120' ' ' HIS . . . . . 0.437 ' CB ' ' HB3' ' A' ' 116' ' ' SER . 21.9 m170 -75.98 -45.88 32.5 Favored 'General case' 0 N--CA 1.447 -0.576 0 CA-C-N 115.746 -0.661 . . . . 0.0 110.342 -178.824 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 52.8 mttm -57.7 -37.77 74.07 Favored 'General case' 0 C--N 1.341 0.234 0 N-CA-C 108.856 -0.794 . . . . 0.0 108.856 179.792 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 7.0 tm-20 -62.48 -51.99 65.29 Favored 'General case' 0 N--CA 1.452 -0.373 0 C-N-CA 122.251 0.221 . . . . 0.0 110.758 179.004 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 3.1 mtmm -64.77 -27.12 68.68 Favored 'General case' 0 N--CA 1.454 -0.226 0 CA-C-N 116.761 -0.2 . . . . 0.0 111.244 179.866 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 124' ' ' ILE . . . . . . . . . . . . . 54.6 mt -74.81 -39.65 45.81 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.242 0 O-C-N 121.576 -0.702 . . . . 0.0 109.517 175.706 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 7.2 mmm180 -59.79 -41.5 91.3 Favored 'General case' 0 N--CA 1.454 -0.271 0 CA-C-O 119.073 -0.489 . . . . 0.0 111.09 178.584 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 126' ' ' MET . . . . . . . . . . . . . 28.1 ptm -66.23 -39.98 89.93 Favored 'General case' 0 N--CA 1.449 -0.48 0 C-N-CA 118.542 -1.263 . . . . 0.0 108.409 176.663 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 4.0 mp -62.29 -36.95 83.7 Favored 'General case' 0 N--CA 1.456 -0.174 0 CA-C-N 118.839 0.745 . . . . 0.0 111.549 179.845 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 93.2 mt -67.61 -42.94 81.58 Favored 'General case' 0 N--CA 1.457 -0.099 0 CA-C-N 118.551 0.614 . . . . 0.0 110.325 178.598 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 27.6 m-20 -69.73 -32.4 70.93 Favored 'General case' 0 N--CA 1.454 -0.261 0 N-CA-C 110.045 -0.354 . . . . 0.0 110.045 178.946 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 34.5 mt -61.98 -39.76 84.82 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.286 0 N-CA-C 109.885 -0.413 . . . . 0.0 109.885 176.641 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 131' ' ' TRP . . . . . . . . . . . . . 32.3 m0 . . . . . 0 N--CA 1.453 -0.302 0 C-N-CA 120.372 -0.531 . . . . 0.0 112.084 -179.779 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 21.3 p-10 . . . . . 0 CA--C 1.518 -0.28 0 CA-C-O 120.649 0.261 . . . . 0.0 111.678 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 7' ' ' PHE . . . . . 0.481 ' HB2' ' HZ3' ' A' ' 45' ' ' LYS . 0.6 OUTLIER -75.65 -41.58 53.7 Favored 'General case' 0 N--CA 1.441 -0.905 0 C-N-CA 120.356 -0.538 . . . . 0.0 111.534 -170.501 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 52.2 tp60 -52.52 -36.57 55.62 Favored 'General case' 0 N--CA 1.453 -0.298 0 N-CA-C 112.169 0.433 . . . . 0.0 112.169 -176.179 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 54.2 m-80 -71.74 -35.64 70.2 Favored 'General case' 0 N--CA 1.453 -0.291 0 C-N-CA 120.541 -0.463 . . . . 0.0 110.139 179.391 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 10' ' ' PHE . . . . . 0.416 ' CZ ' HG12 ' A' ' 46' ' ' ILE . 1.9 t80 -71.99 -37.49 69.84 Favored 'General case' 0 N--CA 1.451 -0.394 0 C-N-CA 123.011 0.524 . . . . 0.0 110.891 178.987 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 99.3 t -65.79 -57.3 11.23 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.337 0 N-CA-C 108.625 -0.88 . . . . 0.0 108.625 179.6 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -59.06 -31.35 68.79 Favored 'General case' 0 N--CA 1.453 -0.284 0 C-N-CA 122.894 0.477 . . . . 0.0 112.021 -177.246 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 79.2 m -70.31 -39.36 74.85 Favored 'General case' 0 N--CA 1.456 -0.144 0 CA-C-N 118.723 0.692 . . . . 0.0 109.588 176.707 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . 0.433 ' HA ' ' CD1' ' A' ' 17' ' ' PHE . 2.8 tp -70.15 -39.66 75.24 Favored 'General case' 0 N--CA 1.453 -0.285 0 CA-C-O 121.169 0.509 . . . . 0.0 110.489 -179.479 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . 0.404 ' CD ' ' HZ1' ' A' ' 18' ' ' LYS . 61.7 mm-40 -64.07 -29.69 70.81 Favored 'General case' 0 N--CA 1.45 -0.431 0 N-CA-C 108.872 -0.788 . . . . 0.0 108.872 177.617 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 32.3 t -71.59 -29.18 64.41 Favored 'General case' 0 N--CA 1.45 -0.455 0 CA-C-O 119.476 -0.297 . . . . 0.0 110.427 177.306 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 17' ' ' PHE . . . . . 0.433 ' CD1' ' HA ' ' A' ' 14' ' ' LEU . 27.3 m-85 -67.6 -36.66 81.29 Favored 'General case' 0 C--N 1.342 0.253 0 CA-C-N 118.508 0.595 . . . . 0.0 110.845 172.503 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . 0.488 ' HG2' ' CE1' ' A' ' 53' ' ' TYR . 61.2 mttt -61.49 -37.72 84.66 Favored 'General case' 0 C--N 1.341 0.202 0 C-N-CA 120.088 -0.645 . . . . 0.0 109.367 176.643 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 39.1 t0 -81.07 -18.87 45.13 Favored 'General case' 0 CA--C 1.534 0.331 0 N-CA-C 113.176 0.806 . . . . 0.0 113.176 -178.908 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 1.4 mt -64.8 -7.51 11.38 Favored 'General case' 0 C--O 1.227 -0.1 0 CA-C-O 118.439 -0.791 . . . . 0.0 112.816 178.722 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 36.0 mmtm 64.19 -48.08 0.29 Allowed 'General case' 0 CA--C 1.528 0.111 0 C-N-CA 126.506 1.923 . . . . 0.0 112.547 179.602 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 53.3 m -85.74 -13.26 48.9 Favored 'General case' 0 N--CA 1.451 -0.418 0 C-N-CA 123.186 0.594 . . . . 0.0 110.861 174.309 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 79.31 -34.33 1.99 Allowed Glycine 0 CA--C 1.527 0.834 0 C-N-CA 124.45 1.024 . . . . 0.0 113.16 175.553 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 93.9 mt -80.45 146.15 8.02 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.252 0 CA-C-N 118.025 0.912 . . . . 0.0 111.401 -178.933 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 35.1 t -169.02 97.68 0.36 Allowed 'General case' 0 CA--C 1.517 -0.326 0 N-CA-C 108.274 -1.01 . . . . 0.0 108.274 173.438 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -53.41 -34.72 49.22 Favored Glycine 0 CA--C 1.526 0.742 0 CA-C-O 119.405 -0.664 . . . . 0.0 111.672 -176.518 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 98.4 p -66.6 -49.92 64.74 Favored 'General case' 0 N--CA 1.456 -0.157 0 CA-C-N 118.255 1.027 . . . . 0.0 110.432 -178.261 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 33.8 mtm180 -73.83 -34.9 64.75 Favored 'General case' 0 C--O 1.231 0.127 0 C-N-CA 122.383 0.273 . . . . 0.0 110.788 -179.077 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 59.7 mt -58.79 -50.44 79.32 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.467 0 N-CA-C 109.228 -0.656 . . . . 0.0 109.228 174.55 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 70.9 mttt -64.47 -28.73 69.87 Favored 'General case' 0 CA--C 1.529 0.141 0 CA-C-O 118.904 -0.569 . . . . 0.0 111.43 178.773 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . 0.433 ' CE ' ' HA ' ' A' ' 31' ' ' LYS . 3.4 mmpt? -63.41 -58.88 5.65 Favored 'General case' 0 N--CA 1.457 -0.083 0 CA-C-N 118.624 0.647 . . . . 0.0 111.205 179.124 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . 0.407 HD23 ' CE1' ' A' ' 10' ' ' PHE . 1.4 pp -75.78 -18.42 59.53 Favored 'General case' 0 N--CA 1.454 -0.256 0 C-N-CA 118.732 -1.187 . . . . 0.0 111.739 -178.714 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 38.6 m -70.76 -41.49 71.68 Favored 'General case' 0 N--CA 1.455 -0.201 0 N-CA-C 108.664 -0.865 . . . . 0.0 108.664 175.931 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 98.2 m -69.54 -38.31 77.43 Favored 'General case' 0 N--CA 1.45 -0.46 0 CA-C-N 116.459 -0.337 . . . . 0.0 110.441 -178.188 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 26.6 t80 -69.89 -29.81 67.1 Favored 'General case' 0 N--CA 1.454 -0.259 0 C-N-CA 119.826 -0.75 . . . . 0.0 110.899 178.369 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -68.94 -32.15 71.55 Favored 'General case' 0 N--CA 1.448 -0.571 0 N-CA-C 110.313 -0.254 . . . . 0.0 110.313 176.53 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -76.98 -34.26 57.56 Favored 'General case' 0 N--CA 1.456 -0.154 0 N-CA-C 110.173 -0.306 . . . . 0.0 110.173 174.171 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 40.4 t0 -60.55 -24.81 65.7 Favored 'General case' 0 CA--C 1.531 0.229 0 C-N-CA 122.926 0.49 . . . . 0.0 110.563 175.547 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 27.3 m-70 -158.32 110.19 2.25 Favored 'General case' 0 N--CA 1.455 -0.193 0 C-N-CA 123.374 0.67 . . . . 0.0 111.28 172.691 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 40' ' ' ILE . . . . . 0.529 ' H ' HD13 ' A' ' 40' ' ' ILE . 0.0 OUTLIER -77.35 -11.39 13.59 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.385 0 N-CA-C 109.626 -0.509 . . . . 0.0 109.626 173.45 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 48.0 m-20 -59.33 -19.91 50.28 Favored 'General case' 0 CA--C 1.532 0.264 0 C-N-CA 122.987 0.515 . . . . 0.0 111.87 -177.916 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -102.95 13.36 6.93 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.195 0 C-N-CA 123.068 0.547 . . . . 0.0 111.848 176.576 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 3.0 pp20? -52.78 -32.01 41.51 Favored 'General case' 0 CA--C 1.527 0.093 0 O-C-N 121.613 -0.679 . . . . 0.0 112.096 -179.659 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 48.2 t -61.99 -48.86 78.46 Favored 'General case' 0 N--CA 1.455 -0.199 0 O-C-N 122.172 -0.33 . . . . 0.0 111.563 -176.113 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . 0.481 ' HZ3' ' HB2' ' A' ' 7' ' ' PHE . 19.6 ptpt -71.9 -24.66 61.69 Favored 'General case' 0 C--N 1.34 0.156 0 O-C-N 121.857 -0.527 . . . . 0.0 109.837 179.764 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 46' ' ' ILE . . . . . 0.416 HG12 ' CZ ' ' A' ' 10' ' ' PHE . 89.6 mt -71.87 -46.0 62.51 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.263 0 C-N-CA 122.763 0.425 . . . . 0.0 110.427 -179.393 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 33.9 mm -63.99 -35.67 74.26 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.224 0 N-CA-C 109.478 -0.564 . . . . 0.0 109.478 178.058 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 13.3 t -63.25 -41.6 99.08 Favored 'General case' 0 N--CA 1.453 -0.319 0 C-N-CA 119.644 -0.822 . . . . 0.0 110.36 177.801 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 4.4 mp -67.99 -37.13 81.12 Favored 'General case' 0 N--CA 1.454 -0.272 0 CA-C-O 118.791 -0.623 . . . . 0.0 112.172 -176.202 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 15.6 pt -69.33 -41.54 80.98 Favored 'Isoleucine or valine' 0 C--O 1.23 0.076 0 CA-C-N 119.168 0.895 . . . . 0.0 110.597 179.901 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 27.5 pt -71.48 -39.75 71.3 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.178 0 C-N-CA 120.084 -0.647 . . . . 0.0 110.646 179.164 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 90.1 m-20 -68.19 -41.67 81.05 Favored 'General case' 0 N--CA 1.452 -0.33 0 CA-C-N 118.1 0.409 . . . . 0.0 112.002 -179.93 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 53' ' ' TYR . . . . . 0.488 ' CE1' ' HG2' ' A' ' 18' ' ' LYS . 8.5 t80 -67.1 -47.04 72.42 Favored 'General case' 0 N--CA 1.453 -0.292 0 N-CA-C 109.202 -0.666 . . . . 0.0 109.202 178.512 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 39.8 t -65.19 -28.16 69.2 Favored 'General case' 0 N--CA 1.453 -0.288 0 N-CA-C 111.589 0.218 . . . . 0.0 111.589 -178.052 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 55.7 ttp85 -75.48 -41.46 55.44 Favored 'General case' 0 N--CA 1.454 -0.232 0 C-N-CA 123.405 0.682 . . . . 0.0 112.251 -179.078 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 46.8 mt -86.98 -43.54 12.28 Favored 'General case' 0 C--O 1.227 -0.111 0 N-CA-C 112.541 0.571 . . . . 0.0 112.541 -176.448 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 8.2 p -66.48 156.8 84.83 Favored Pre-proline 0 CA--C 1.538 0.486 0 N-CA-C 113.416 0.895 . . . . 0.0 113.416 -172.666 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 87.2 Cg_endo -73.49 173.3 14.06 Favored 'Trans proline' 0 N--CA 1.456 -0.711 0 C-N-CA 124.707 3.605 . . . . 0.0 111.048 178.887 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -51.78 -42.78 62.68 Favored 'General case' 0 CA--C 1.53 0.197 0 N-CA-C 113.581 0.956 . . . . 0.0 113.581 -172.96 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 51.0 m -66.88 -40.39 87.78 Favored 'General case' 0 N--CA 1.455 -0.189 0 CA-C-N 118.076 0.398 . . . . 0.0 110.283 -177.006 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 39.9 m170 -75.78 -24.11 55.97 Favored 'General case' 0 N--CA 1.45 -0.44 0 N-CA-C 109.89 -0.411 . . . . 0.0 109.89 177.272 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 19.7 ttmm -73.61 -34.02 64.86 Favored 'General case' 0 N--CA 1.454 -0.257 0 C-N-CA 123.744 0.817 . . . . 0.0 109.595 178.51 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -66.54 -45.18 80.28 Favored 'General case' 0 CA--C 1.53 0.186 0 N-CA-C 107.334 -1.358 . . . . 0.0 107.334 172.719 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -64.96 -30.45 78.04 Favored Glycine 0 C--N 1.34 0.768 0 N-CA-C 111.193 -0.763 . . . . 0.0 111.193 179.241 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 59.4 m -67.54 -40.63 85.02 Favored 'General case' 0 N--CA 1.454 -0.255 0 N-CA-C 109.419 -0.586 . . . . 0.0 109.419 177.649 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 59.6 mt -70.82 -24.05 62.47 Favored 'General case' 0 N--CA 1.452 -0.326 0 N-CA-C 110.187 -0.301 . . . . 0.0 110.187 178.885 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -72.43 -37.91 68.47 Favored 'General case' 0 C--O 1.231 0.101 0 CA-C-N 117.932 0.333 . . . . 0.0 110.105 175.421 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 68' ' ' ILE . . . . . 0.427 HD11 ' CD1' ' A' ' 17' ' ' PHE . 18.2 mt -68.48 -44.94 82.79 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.342 0 N-CA-C 109.114 -0.699 . . . . 0.0 109.114 176.609 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 76.2 mt -58.34 -32.01 44.06 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.114 0 C-N-CA 123.156 0.582 . . . . 0.0 110.748 175.791 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 19.7 t70 -69.57 -47.11 64.72 Favored 'General case' 0 N--CA 1.454 -0.263 0 CA-C-N 117.967 0.349 . . . . 0.0 111.325 179.696 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 99.2 p -71.59 -47.35 55.38 Favored 'General case' 0 N--CA 1.449 -0.503 0 C-N-CA 121.092 -0.243 . . . . 0.0 110.73 -176.538 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -75.66 -34.04 27.88 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.28 0 N-CA-C 109.879 -0.415 . . . . 0.0 109.879 -178.539 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -66.23 -52.41 36.5 Favored Glycine 0 C--N 1.334 0.466 0 N-CA-C 111.248 -0.741 . . . . 0.0 111.248 -175.745 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 44.5 mtm105 -71.46 -38.65 71.26 Favored 'General case' 0 N--CA 1.451 -0.408 0 CA-C-O 119.168 -0.444 . . . . 0.0 110.767 -179.926 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -63.16 -30.94 71.99 Favored 'General case' 0 N--CA 1.451 -0.401 0 C-N-CA 119.763 -0.775 . . . . 0.0 109.972 -179.231 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 1.8 m-30 -69.76 -52.14 27.94 Favored 'General case' 0 N--CA 1.454 -0.234 0 CA-C-O 119.265 -0.398 . . . . 0.0 110.965 176.473 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 8.0 tt -70.28 -45.53 66.17 Favored 'General case' 0 N--CA 1.448 -0.547 0 C-N-CA 117.328 -1.749 . . . . 0.0 109.458 -176.474 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 91.0 m-20 -56.96 -47.64 80.25 Favored 'General case' 0 N--CA 1.455 -0.189 0 CA-C-O 119.17 -0.443 . . . . 0.0 111.795 -176.244 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 75.5 mm-40 -70.41 -41.38 73.05 Favored 'General case' 0 N--CA 1.455 -0.22 0 CA-C-N 118.498 0.59 . . . . 0.0 111.902 -179.614 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 80.9 p -72.38 -28.14 62.82 Favored 'General case' 0 CA--C 1.529 0.148 0 CA-C-N 118.804 0.729 . . . . 0.0 111.574 -179.429 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 5.7 tmm_? -82.48 -35.05 27.79 Favored 'General case' 0 N--CA 1.457 -0.09 0 C-N-CA 123.22 0.608 . . . . 0.0 111.48 179.372 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 40.0 t . . . . . 0 N--CA 1.457 -0.082 0 N-CA-C 113.086 0.773 . . . . 0.0 113.086 -179.326 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 83.7 Cg_endo . . . . . 0 N--CA 1.453 -0.877 0 N-CA-C 108.94 -1.215 . . . . 0.0 108.94 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 88.64 15.33 60.05 Favored Glycine 0 CA--C 1.526 0.762 0 C-N-CA 121.186 -0.53 . . . . 0.0 112.175 -177.753 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -152.48 164.35 37.75 Favored 'General case' 0 N--CA 1.455 -0.187 0 C-N-CA 124.025 0.93 . . . . 0.0 110.042 179.679 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 94' ' ' CYS . . . . . 0.4 ' SG ' HD12 ' A' ' 98' ' ' ILE . 2.5 t -52.63 -26.47 13.74 Favored 'General case' 0 N--CA 1.453 -0.317 0 C-N-CA 123.316 0.646 . . . . 0.0 110.716 175.93 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -55.74 -58.76 6.48 Favored 'General case' 0 N--CA 1.449 -0.501 0 O-C-N 122.164 -0.335 . . . . 0.0 110.598 -176.98 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 76.3 t60 -75.49 -32.96 60.74 Favored 'General case' 0 N--CA 1.453 -0.306 0 O-C-N 122.286 -0.259 . . . . 0.0 111.117 -179.833 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -65.4 -51.86 57.45 Favored 'General case' 0 N--CA 1.449 -0.493 0 O-C-N 122.977 0.173 . . . . 0.0 111.453 -176.255 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 98' ' ' ILE . . . . . 0.4 HD12 ' SG ' ' A' ' 94' ' ' CYS . 1.7 mp -72.03 -34.18 49.67 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.153 0 N-CA-C 110.18 -0.304 . . . . 0.0 110.18 -179.248 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 1.7 m120 -66.87 -46.18 75.78 Favored 'General case' 0 N--CA 1.452 -0.355 0 C-N-CA 120.319 -0.552 . . . . 0.0 111.304 178.281 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 87.8 m -67.95 -35.03 77.7 Favored 'General case' 0 N--CA 1.456 -0.125 0 CA-C-N 118.077 0.399 . . . . 0.0 110.896 -176.319 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 57.7 tp -75.9 -39.83 55.57 Favored 'General case' 0 N--CA 1.449 -0.489 0 CA-C-O 119.779 -0.153 . . . . 0.0 111.05 -179.261 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -66.37 -16.09 64.49 Favored Glycine 0 CA--C 1.528 0.849 0 CA-C-O 119.634 -0.537 . . . . 0.0 112.717 -175.549 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 14.9 mm-40 -78.83 -34.77 44.9 Favored 'General case' 0 N--CA 1.455 -0.211 0 CA-C-N 117.754 0.777 . . . . 0.0 112.133 179.908 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 18.9 m -112.44 3.47 8.4 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.135 0 O-C-N 124.007 0.817 . . . . 0.0 112.88 -174.027 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 105' ' ' ILE . . . . . . . . . . . . . 10.9 tp -68.93 -26.93 33.68 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.224 0 O-C-N 121.927 -0.483 . . . . 0.0 111.49 -177.915 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 14.1 pt20 -70.32 -31.56 68.93 Favored 'General case' 0 N--CA 1.455 -0.214 0 O-C-N 121.786 -0.571 . . . . 0.0 110.085 -178.888 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 48.4 mp0 -71.49 -38.74 71.15 Favored 'General case' 0 N--CA 1.451 -0.394 0 CA-C-N 118.256 0.48 . . . . 0.0 110.32 177.705 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 87.3 mt -74.11 -36.24 64.2 Favored 'General case' 0 N--CA 1.455 -0.212 0 N-CA-C 110.669 -0.122 . . . . 0.0 110.669 -178.401 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 87.6 mt -71.58 -47.7 53.14 Favored 'General case' 0 N--CA 1.452 -0.344 0 C-N-CA 120.874 -0.33 . . . . 0.0 110.295 176.133 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 48.3 t -57.16 -40.34 77.06 Favored 'General case' 0 N--CA 1.457 -0.105 0 C-N-CA 122.435 0.294 . . . . 0.0 110.604 179.716 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 39.8 t0 -64.12 -42.75 96.72 Favored 'General case' 0 N--CA 1.453 -0.282 0 N-CA-C 109.256 -0.646 . . . . 0.0 109.256 176.156 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -70.79 -39.01 73.39 Favored 'General case' 0 N--CA 1.445 -0.68 0 CA-C-O 119.141 -0.457 . . . . 0.0 111.36 -175.252 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 113' ' ' ILE . . . . . . . . . . . . . 12.1 mm -68.65 -38.53 79.12 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.276 0 CA-C-N 119.592 1.087 . . . . 0.0 109.75 -179.308 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -67.2 -47.6 70.41 Favored 'General case' 0 N--CA 1.45 -0.464 0 C-N-CA 122.839 0.456 . . . . 0.0 111.707 178.234 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 115' ' ' LYS . . . . . 0.561 ' HE2' ' HA ' ' A' ' 115' ' ' LYS . 0.3 OUTLIER -84.05 -34.79 24.16 Favored 'General case' 0 N--CA 1.455 -0.194 0 N-CA-C 114.018 1.118 . . . . 0.0 114.018 -172.907 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 116' ' ' SER . . . . . 0.454 ' HB2' ' CB ' ' A' ' 120' ' ' HIS . 28.3 p -77.63 159.42 29.21 Favored 'General case' 0 CA--C 1.528 0.121 0 N-CA-C 112.527 0.565 . . . . 0.0 112.527 -172.505 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 7.8 t-20 -80.35 164.58 23.02 Favored 'General case' 0 C--O 1.225 -0.22 0 C-N-CA 123.713 0.805 . . . . 0.0 111.127 -178.461 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 118' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -44.76 -48.86 10.85 Favored 'General case' 0 N--CA 1.455 -0.197 0 C-N-CA 124.034 0.934 . . . . 0.0 113.05 -179.176 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 49.8 t0 -60.76 -39.69 89.68 Favored 'General case' 0 CA--C 1.531 0.217 0 CA-C-O 121.002 0.429 . . . . 0.0 110.192 178.51 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 120' ' ' HIS . . . . . 0.454 ' CB ' ' HB2' ' A' ' 116' ' ' SER . 24.9 m170 -68.67 -40.8 79.96 Favored 'General case' 0 N--CA 1.451 -0.38 0 N-CA-C 109.69 -0.485 . . . . 0.0 109.69 -179.053 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 94.8 mttt -59.26 -34.6 72.44 Favored 'General case' 0 C--N 1.339 0.127 0 N-CA-C 109.446 -0.576 . . . . 0.0 109.446 178.87 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 24.2 tt0 -67.58 -45.98 73.97 Favored 'General case' 0 N--CA 1.455 -0.193 0 C-N-CA 122.527 0.331 . . . . 0.0 110.766 179.134 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 14.4 mptt -68.18 -35.42 77.99 Favored 'General case' 0 C--N 1.338 0.099 0 C-N-CA 120.42 -0.512 . . . . 0.0 110.386 -177.753 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 124' ' ' ILE . . . . . . . . . . . . . 63.5 mt -66.7 -38.52 81.74 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.207 0 N-CA-C 108.96 -0.756 . . . . 0.0 108.96 177.513 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 125' ' ' ARG . . . . . 0.401 ' HD2' ' HA ' ' A' ' 125' ' ' ARG . 25.0 tpt85 -66.39 -42.22 88.21 Favored 'General case' 0 N--CA 1.443 -0.776 0 N-CA-C 111.849 0.314 . . . . 0.0 111.849 -172.431 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 126' ' ' MET . . . . . . . . . . . . . 27.1 ptm -67.13 -33.28 75.1 Favored 'General case' 0 N--CA 1.45 -0.436 0 N-CA-C 108.965 -0.754 . . . . 0.0 108.965 175.606 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 2.7 mp -61.92 -34.55 76.28 Favored 'General case' 0 CA--C 1.53 0.203 0 CA-C-O 119.271 -0.395 . . . . 0.0 110.146 176.227 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 53.6 mt -68.1 -43.46 78.4 Favored 'General case' 0 N--CA 1.455 -0.201 0 CA-C-N 119.139 0.881 . . . . 0.0 110.459 178.743 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 55.3 m-20 -65.47 -37.74 87.74 Favored 'General case' 0 CA--C 1.529 0.163 0 C-N-CA 120.314 -0.555 . . . . 0.0 110.042 177.925 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 53.1 mt -63.06 -36.39 75.65 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.319 0 C-N-CA 122.766 0.426 . . . . 0.0 110.297 178.516 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 131' ' ' TRP . . . . . . . . . . . . . 51.4 m0 . . . . . 0 N--CA 1.453 -0.299 0 N-CA-C 112.522 0.564 . . . . 0.0 112.522 -179.27 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 23.1 p-10 . . . . . 0 CA--C 1.52 -0.184 0 N-CA-C 106.835 -1.543 . . . . 0.0 106.835 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 7' ' ' PHE . . . . . 0.659 ' HB2' ' HZ3' ' A' ' 45' ' ' LYS . 0.7 OUTLIER -75.05 -34.3 61.82 Favored 'General case' 0 N--CA 1.441 -0.886 0 CA-C-N 115.341 -0.845 . . . . 0.0 110.129 -179.023 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 60.5 tp60 -48.19 -39.84 22.27 Favored 'General case' 0 CA--C 1.529 0.163 0 C-N-CA 123.984 0.914 . . . . 0.0 112.125 -175.427 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 4.1 m-80 -70.16 -38.65 75.49 Favored 'General case' 0 CA--C 1.529 0.173 0 CA-C-O 121.264 0.554 . . . . 0.0 110.283 -178.867 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 1.8 t80 -70.82 -37.38 73.2 Favored 'General case' 0 N--CA 1.451 -0.425 0 C-N-CA 124.289 1.036 . . . . 0.0 109.601 179.503 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 74.9 t -68.6 -52.9 31.26 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.302 0 N-CA-C 108.872 -0.788 . . . . 0.0 108.872 179.322 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -57.91 -31.43 66.77 Favored 'General case' 0 N--CA 1.453 -0.29 0 CA-C-N 117.78 0.264 . . . . 0.0 111.519 -179.135 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 82.9 m -69.31 -42.67 75.1 Favored 'General case' 0 CA--C 1.534 0.332 0 N-CA-C 109.015 -0.735 . . . . 0.0 109.015 175.366 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . 0.431 HD11 ' CD2' ' A' ' 53' ' ' TYR . 0.1 OUTLIER -64.09 -40.23 95.77 Favored 'General case' 0 N--CA 1.454 -0.232 0 C-N-CA 122.947 0.499 . . . . 0.0 110.039 179.152 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 73.1 mm-40 -65.27 -32.5 74.19 Favored 'General case' 0 N--CA 1.451 -0.38 0 C-N-CA 123.565 0.746 . . . . 0.0 109.702 179.558 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 16.2 p -65.14 -34.28 78.02 Favored 'General case' 0 N--CA 1.454 -0.253 0 N-CA-C 109.537 -0.542 . . . . 0.0 109.537 176.068 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 17' ' ' PHE . . . . . 0.43 ' CD1' HD11 ' A' ' 68' ' ' ILE . 14.8 m-30 -67.18 -34.26 77.15 Favored 'General case' 0 N--CA 1.458 -0.038 0 C-N-CA 121.187 -0.205 . . . . 0.0 111.529 175.845 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . 0.507 ' HG2' ' CE1' ' A' ' 53' ' ' TYR . 53.2 mttt -68.99 -24.9 64.28 Favored 'General case' 0 C--O 1.227 -0.089 0 N-CA-C 110.084 -0.339 . . . . 0.0 110.084 175.172 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 30.6 t0 -78.43 -23.9 46.41 Favored 'General case' 0 CA--C 1.534 0.359 0 C-N-CA 123.106 0.563 . . . . 0.0 111.811 178.23 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 93.3 mt -75.53 164.93 25.84 Favored 'General case' 0 CA--C 1.529 0.17 0 CA-C-O 121.132 0.492 . . . . 0.0 111.196 179.101 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -94.01 -45.53 7.55 Favored 'General case' 0 N--CA 1.455 -0.212 0 N-CA-C 108.573 -0.899 . . . . 0.0 108.573 177.533 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 53.9 m -80.43 -16.35 54.62 Favored 'General case' 0 CA--C 1.529 0.139 0 C-N-CA 122.949 0.5 . . . . 0.0 111.563 -179.235 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 72.6 -29.05 0.73 Allowed Glycine 0 CA--C 1.529 0.963 0 C-N-CA 124.29 0.948 . . . . 0.0 113.203 178.134 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 94.6 mt -75.81 147.54 7.95 Favored 'Isoleucine or valine' 0 C--N 1.339 0.109 0 CA-C-N 117.94 0.87 . . . . 0.0 109.455 177.028 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 6.4 t -163.7 78.23 0.41 Allowed 'General case' 0 N--CA 1.453 -0.312 0 N-CA-C 110.322 -0.251 . . . . 0.0 110.322 -178.495 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -45.72 -52.74 9.12 Favored Glycine 0 CA--C 1.527 0.798 0 CA-C-O 118.928 -0.929 . . . . 0.0 114.126 -170.63 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 37.8 t -65.5 -45.04 85.12 Favored 'General case' 0 N--CA 1.456 -0.157 0 CA-C-N 119.432 1.616 . . . . 0.0 110.918 -175.374 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 17.1 mtm180 -70.48 -37.64 74.26 Favored 'General case' 0 CA--C 1.527 0.091 0 CA-C-O 119.385 -0.341 . . . . 0.0 111.228 -179.356 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 63.4 mt -56.5 -43.92 79.25 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.474 0 N-CA-C 108.185 -1.042 . . . . 0.0 108.185 172.105 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 46.0 mtmt -70.81 -19.3 62.69 Favored 'General case' 0 N--CA 1.452 -0.337 0 CA-C-O 118.653 -0.689 . . . . 0.0 111.753 179.382 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . 0.463 ' HA ' ' HE3' ' A' ' 31' ' ' LYS . 0.0 OUTLIER -69.32 -55.17 11.21 Favored 'General case' 0 C--N 1.343 0.284 0 CA-C-N 119.223 0.919 . . . . 0.0 109.585 174.793 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 3.2 pp -75.18 -19.71 59.69 Favored 'General case' 0 N--CA 1.456 -0.145 0 C-N-CA 119.567 -0.853 . . . . 0.0 111.177 -178.773 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 53.3 m -71.84 -43.18 65.97 Favored 'General case' 0 N--CA 1.453 -0.314 0 N-CA-C 108.923 -0.769 . . . . 0.0 108.923 175.535 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 80.6 m -67.39 -37.53 83.27 Favored 'General case' 0 N--CA 1.453 -0.284 0 O-C-N 122.359 -0.213 . . . . 0.0 110.449 -177.7 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 81.0 t80 -68.68 -34.42 75.65 Favored 'General case' 0 N--CA 1.45 -0.467 0 O-C-N 122.285 -0.259 . . . . 0.0 110.493 177.451 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -68.48 -36.18 78.58 Favored 'General case' 0 N--CA 1.451 -0.421 0 O-C-N 122.288 -0.257 . . . . 0.0 110.352 177.688 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -69.86 -33.84 72.8 Favored 'General case' 0 N--CA 1.455 -0.208 0 C-N-CA 122.729 0.412 . . . . 0.0 110.32 179.357 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 43.5 t0 -69.44 -21.59 63.72 Favored 'General case' 0 N--CA 1.451 -0.393 0 C-N-CA 122.564 0.346 . . . . 0.0 110.767 176.129 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 95.6 m-70 -150.67 95.62 2.25 Favored 'General case' 0 C--N 1.341 0.22 0 N-CA-C 112.208 0.447 . . . . 0.0 112.208 -175.413 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 40' ' ' ILE . . . . . 0.555 HD11 ' H ' ' A' ' 40' ' ' ILE . 0.0 OUTLIER -74.28 -13.28 15.64 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.291 0 CA-C-O 119.529 -0.272 . . . . 0.0 110.311 175.09 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 19.1 m-20 -57.68 -22.46 46.16 Favored 'General case' 0 N--CA 1.456 -0.131 0 C-N-CA 122.975 0.51 . . . . 0.0 112.104 -176.997 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -108.77 18.38 6.6 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.185 0 C-N-CA 122.897 0.479 . . . . 0.0 112.255 178.384 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 3.1 pp20? -52.85 -27.58 19.03 Favored 'General case' 0 C--O 1.226 -0.165 0 CA-C-N 118.365 0.529 . . . . 0.0 109.582 174.785 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 90.3 p -58.94 -55.11 39.42 Favored 'General case' 0 N--CA 1.453 -0.294 0 C-N-CA 123.668 0.787 . . . . 0.0 111.315 -178.708 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . 0.659 ' HZ3' ' HB2' ' A' ' 7' ' ' PHE . 17.0 ptpt -73.76 -21.5 60.17 Favored 'General case' 0 C--N 1.338 0.108 0 O-C-N 122.298 -0.251 . . . . 0.0 110.98 -179.858 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 93.5 mt -74.37 -45.61 46.01 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.198 0 N-CA-C 110.045 -0.354 . . . . 0.0 110.045 -179.81 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 34.6 mm -66.35 -38.85 82.71 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.126 0 N-CA-C 109.422 -0.584 . . . . 0.0 109.422 178.66 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 27.4 t -63.05 -38.92 93.11 Favored 'General case' 0 N--CA 1.453 -0.278 0 C-N-CA 119.657 -0.817 . . . . 0.0 109.887 177.332 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 32.7 tp -72.03 -31.89 66.61 Favored 'General case' 0 N--CA 1.449 -0.52 0 N-CA-C 112.615 0.598 . . . . 0.0 112.615 -173.772 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 14.4 pt -70.82 -41.34 77.33 Favored 'Isoleucine or valine' 0 C--N 1.34 0.169 0 CA-C-N 118.785 0.72 . . . . 0.0 110.099 175.996 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 42.4 pt -71.38 -37.74 66.24 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.171 0 C-N-CA 119.875 -0.73 . . . . 0.0 110.85 179.664 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 84.5 m-20 -65.37 -44.99 85.88 Favored 'General case' 0 C--O 1.233 0.214 0 CA-C-N 117.927 0.331 . . . . 0.0 111.307 177.849 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 53' ' ' TYR . . . . . 0.507 ' CE1' ' HG2' ' A' ' 18' ' ' LYS . 9.3 t80 -60.64 -42.94 97.94 Favored 'General case' 0 C--N 1.34 0.189 0 N-CA-C 108.893 -0.78 . . . . 0.0 108.893 176.365 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 25.0 m -69.21 -26.93 65.06 Favored 'General case' 0 N--CA 1.453 -0.319 0 C-N-CA 122.197 0.199 . . . . 0.0 111.479 -177.899 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 51.9 tpt85 -75.78 -35.13 60.21 Favored 'General case' 0 N--CA 1.455 -0.194 0 O-C-N 121.985 -0.447 . . . . 0.0 111.336 -178.697 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 32.4 mt -89.08 -43.17 11.27 Favored 'General case' 0 N--CA 1.457 -0.113 0 N-CA-C 112.772 0.656 . . . . 0.0 112.772 -177.548 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 57' ' ' CYS . . . . . 0.434 ' HB2' ' CB ' ' A' ' 61' ' ' HIS . 3.4 p -65.89 157.86 78.08 Favored Pre-proline 0 CA--C 1.536 0.422 0 N-CA-C 114.981 1.474 . . . . 0.0 114.981 -169.715 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 58' ' ' PRO . . . . . 0.419 ' HD2' ' HB2' ' A' ' 57' ' ' CYS . 51.5 Cg_endo -78.12 -166.92 0.43 Allowed 'Trans proline' 0 N--CA 1.456 -0.677 1 C-N-CA 125.72 4.28 . . . . 0.0 111.243 175.29 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 29.9 p-10 -61.7 -52.26 65.05 Favored 'General case' 0 CA--C 1.53 0.2 0 C-N-CA 125.131 1.372 . . . . 0.0 113.793 -172.15 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 40.3 m -67.73 -34.25 76.47 Favored 'General case' 0 N--CA 1.455 -0.198 0 CA-C-O 120.709 0.29 . . . . 0.0 110.615 -174.234 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 61' ' ' HIS . . . . . 0.434 ' CB ' ' HB2' ' A' ' 57' ' ' CYS . 55.3 m170 -74.33 -23.29 59.03 Favored 'General case' 0 N--CA 1.452 -0.33 0 N-CA-C 109.901 -0.407 . . . . 0.0 109.901 176.132 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 4.4 tppt? -67.36 -39.8 85.73 Favored 'General case' 0 N--CA 1.455 -0.215 0 N-CA-C 108.978 -0.749 . . . . 0.0 108.978 176.558 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -67.49 -42.41 82.96 Favored 'General case' 0 N--CA 1.454 -0.254 0 N-CA-C 108.875 -0.787 . . . . 0.0 108.875 177.221 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -66.14 -31.0 77.94 Favored Glycine 0 C--N 1.339 0.738 0 N-CA-C 111.116 -0.794 . . . . 0.0 111.116 179.533 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 50.5 m -67.29 -43.04 82.75 Favored 'General case' 0 N--CA 1.455 -0.189 0 N-CA-C 109.808 -0.442 . . . . 0.0 109.808 177.571 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 61.3 mt -68.51 -25.98 65.22 Favored 'General case' 0 N--CA 1.453 -0.311 0 CA-C-O 119.554 -0.26 . . . . 0.0 110.79 179.384 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 1.4 m-85 -70.94 -37.81 72.87 Favored 'General case' 0 N--CA 1.455 -0.215 0 CA-C-N 117.778 0.263 . . . . 0.0 110.721 175.473 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 68' ' ' ILE . . . . . 0.43 HD11 ' CD1' ' A' ' 17' ' ' PHE . 14.7 mt -67.69 -46.9 81.78 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.472 0 N-CA-C 108.859 -0.793 . . . . 0.0 108.859 176.401 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 95.7 mt -57.39 -37.5 57.69 Favored 'Isoleucine or valine' 0 C--N 1.339 0.128 0 C-N-CA 123.49 0.716 . . . . 0.0 111.071 176.641 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 17.6 t70 -69.42 -43.6 73.07 Favored 'General case' 0 N--CA 1.455 -0.19 0 CA-C-N 118.161 0.437 . . . . 0.0 110.291 178.421 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 29.4 t -66.63 -57.33 7.42 Favored 'General case' 0 N--CA 1.451 -0.385 0 C-N-CA 122.733 0.413 . . . . 0.0 110.988 -176.993 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -75.57 -32.32 24.71 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.408 0 N-CA-C 109.868 -0.419 . . . . 0.0 109.868 -176.733 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -64.84 -50.55 57.77 Favored Glycine 0 C--N 1.337 0.606 0 N-CA-C 111.385 -0.686 . . . . 0.0 111.385 -175.587 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 37.1 mtm105 -71.88 -39.13 69.84 Favored 'General case' 0 N--CA 1.451 -0.383 0 CA-C-N 117.481 0.64 . . . . 0.0 110.134 178.81 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -62.16 -33.94 75.46 Favored 'General case' 0 N--CA 1.452 -0.357 0 C-N-CA 120.54 -0.464 . . . . 0.0 110.751 -179.122 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 1.4 m-30 -69.79 -49.85 48.8 Favored 'General case' 0 CA--C 1.52 -0.204 0 CA-C-N 118.419 0.554 . . . . 0.0 111.023 175.764 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 2.5 tm? -67.93 -35.85 79.14 Favored 'General case' 0 N--CA 1.45 -0.443 0 C-N-CA 118.689 -1.204 . . . . 0.0 109.092 -175.024 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 92.6 m-20 -65.79 -46.9 76.96 Favored 'General case' 0 C--O 1.231 0.116 0 N-CA-C 112.488 0.551 . . . . 0.0 112.488 177.166 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 13.6 tm-20 -65.02 -47.77 76.25 Favored 'General case' 0 N--CA 1.448 -0.573 0 C-N-CA 121.096 -0.241 . . . . 0.0 110.55 -179.027 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 68.4 p -67.27 -28.33 67.94 Favored 'General case' 0 N--CA 1.45 -0.463 0 CA-C-O 119.502 -0.285 . . . . 0.0 110.913 179.727 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 36.8 ttp-105 -69.93 -26.88 64.35 Favored 'General case' 0 C--N 1.338 0.088 0 CA-C-N 118.544 0.611 . . . . 0.0 110.182 173.401 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 22.5 m . . . . . 0 N--CA 1.454 -0.242 0 N-CA-C 112.965 0.728 . . . . 0.0 112.965 -177.669 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_exo . . . . . 0 N--CA 1.453 -0.875 0 CA-C-O 120.769 0.237 . . . . 0.0 111.707 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 89.31 17.17 56.07 Favored Glycine 0 CA--C 1.528 0.851 0 CA-C-O 119.525 -0.597 . . . . 0.0 113.238 176.427 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -156.21 165.37 36.58 Favored 'General case' 0 N--CA 1.457 -0.076 0 CA-C-N 117.904 0.852 . . . . 0.0 109.557 178.724 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 94' ' ' CYS . . . . . . . . . . . . . 31.5 p -55.55 -23.08 24.75 Favored 'General case' 0 N--CA 1.453 -0.317 0 C-N-CA 123.611 0.764 . . . . 0.0 110.813 178.729 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -60.18 -60.35 3.96 Favored 'General case' 0 N--CA 1.445 -0.681 0 N-CA-C 110.098 -0.334 . . . . 0.0 110.098 -176.076 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 75.0 t60 -72.71 -31.45 65.02 Favored 'General case' 0 N--CA 1.451 -0.386 0 O-C-N 122.052 -0.405 . . . . 0.0 110.728 179.417 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -64.33 -53.67 45.04 Favored 'General case' 0 N--CA 1.452 -0.348 0 CA-C-O 119.686 -0.197 . . . . 0.0 111.366 -178.36 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 1.9 mp -70.91 -34.31 55.33 Favored 'Isoleucine or valine' 0 C--N 1.339 0.109 0 CA-C-N 118.074 0.397 . . . . 0.0 110.244 -179.757 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 73.0 m-20 -62.56 -42.28 99.44 Favored 'General case' 0 N--CA 1.456 -0.165 0 CA-C-N 118.159 0.436 . . . . 0.0 110.883 177.719 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 92.2 m -74.54 -31.78 62.23 Favored 'General case' 0 N--CA 1.455 -0.178 0 N-CA-C 110.443 -0.206 . . . . 0.0 110.443 -178.705 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -70.82 -41.11 71.98 Favored 'General case' 0 N--CA 1.452 -0.359 0 C-N-CA 122.632 0.373 . . . . 0.0 110.742 -179.01 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -62.47 -20.74 61.6 Favored Glycine 0 CA--C 1.529 0.928 0 CA-C-O 119.63 -0.539 . . . . 0.0 113.741 -173.767 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 55.9 mm-40 -85.58 -36.06 20.66 Favored 'General case' 0 N--CA 1.455 -0.21 0 CA-C-N 118.362 1.081 . . . . 0.0 112.666 -179.837 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 59.0 t -92.14 -26.57 4.89 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.155 0 O-C-N 123.26 0.35 . . . . 0.0 111.765 -176.985 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 105' ' ' ILE . . . . . . . . . . . . . 10.5 tp -62.45 -26.0 39.32 Favored 'Isoleucine or valine' 0 C--N 1.338 0.075 0 O-C-N 122.111 -0.368 . . . . 0.0 111.672 -174.126 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 24.0 pt20 -69.73 -40.69 76.04 Favored 'General case' 0 N--CA 1.451 -0.404 0 C-N-CA 120.96 -0.296 . . . . 0.0 110.695 -178.765 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 76.8 mm-40 -80.89 -26.15 37.05 Favored 'General case' 0 N--CA 1.454 -0.252 0 CA-C-N 118.367 0.531 . . . . 0.0 110.743 176.696 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 6.8 tt -67.69 -42.59 81.81 Favored 'General case' 0 N--CA 1.454 -0.248 0 N-CA-C 108.891 -0.781 . . . . 0.0 108.891 176.277 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 69.2 mt -68.9 -45.42 70.95 Favored 'General case' 0 N--CA 1.449 -0.475 0 N-CA-C 109.192 -0.67 . . . . 0.0 109.192 173.921 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 43.2 t -47.4 -52.07 17.91 Favored 'General case' 0 C--O 1.234 0.264 0 CA-C-N 118.041 0.382 . . . . 0.0 111.087 178.471 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 40.7 t0 -62.09 -43.8 98.05 Favored 'General case' 0 N--CA 1.455 -0.175 0 N-CA-C 109.135 -0.691 . . . . 0.0 109.135 179.362 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -65.08 -39.69 93.56 Favored 'General case' 0 N--CA 1.45 -0.472 0 N-CA-C 112.237 0.458 . . . . 0.0 112.237 -176.424 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 113' ' ' ILE . . . . . . . . . . . . . 26.8 mm -69.08 -39.44 79.53 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.502 0 CA-C-N 119.133 0.879 . . . . 0.0 109.756 -176.714 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -74.95 -43.83 51.87 Favored 'General case' 0 N--CA 1.453 -0.291 0 C-N-CA 120.624 -0.431 . . . . 0.0 111.878 178.935 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 33.3 ttmt -80.0 -30.74 39.7 Favored 'General case' 0 C--O 1.227 -0.11 0 N-CA-C 113.892 1.071 . . . . 0.0 113.892 -173.159 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 116' ' ' SER . . . . . 0.456 ' HB2' ' CB ' ' A' ' 120' ' ' HIS . 50.6 p -80.0 157.28 26.84 Favored 'General case' 0 CA--C 1.529 0.166 0 N-CA-C 111.974 0.361 . . . . 0.0 111.974 -174.139 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 53.1 t30 -76.21 166.5 23.37 Favored 'General case' 0 N--CA 1.454 -0.226 0 C-N-CA 123.323 0.649 . . . . 0.0 110.269 -179.056 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 118' ' ' GLN . . . . . . . . . . . . . 21.2 mm100 -55.11 -38.46 68.19 Favored 'General case' 0 CA--C 1.528 0.13 0 N-CA-C 112.778 0.658 . . . . 0.0 112.778 -172.426 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 8.0 p30 -69.4 -37.77 77.66 Favored 'General case' 0 N--CA 1.457 -0.084 0 N-CA-C 109.667 -0.494 . . . . 0.0 109.667 178.617 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 120' ' ' HIS . . . . . 0.456 ' CB ' ' HB2' ' A' ' 116' ' ' SER . 31.0 m170 -65.47 -42.11 92.61 Favored 'General case' 0 N--CA 1.45 -0.451 0 N-CA-C 109.445 -0.576 . . . . 0.0 109.445 176.798 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 52.8 mttm -56.74 -38.69 72.75 Favored 'General case' 0 C--N 1.341 0.234 0 N-CA-C 109.299 -0.63 . . . . 0.0 109.299 178.147 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 3.5 tm-20 -68.18 -48.93 63.95 Favored 'General case' 0 N--CA 1.456 -0.142 0 CA-C-O 119.47 -0.3 . . . . 0.0 111.71 179.179 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 40.9 mmtm -58.67 -33.65 70.36 Favored 'General case' 0 N--CA 1.456 -0.133 0 CA-C-N 118.112 0.414 . . . . 0.0 111.05 178.31 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 124' ' ' ILE . . . . . . . . . . . . . 57.1 mt -74.17 -37.41 46.18 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.291 0 N-CA-C 109.606 -0.516 . . . . 0.0 109.606 178.122 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 5.9 tpt180 -68.09 -36.68 80.2 Favored 'General case' 0 N--CA 1.45 -0.451 0 O-C-N 122.07 -0.394 . . . . 0.0 111.066 -176.84 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 126' ' ' MET . . . . . . . . . . . . . 5.6 ppp? -75.05 -27.03 59.86 Favored 'General case' 0 C--O 1.226 -0.139 0 N-CA-C 109.913 -0.402 . . . . 0.0 109.913 176.255 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 1.1 mp -62.11 -39.34 92.18 Favored 'General case' 0 CA--C 1.528 0.119 0 CA-C-N 117.928 0.331 . . . . 0.0 110.269 172.066 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -69.44 -37.81 77.53 Favored 'General case' 0 N--CA 1.457 -0.085 0 CA-C-N 118.162 0.437 . . . . 0.0 109.96 178.158 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 18.6 t70 -59.05 -45.03 91.8 Favored 'General case' 0 N--CA 1.452 -0.337 0 N-CA-C 109.27 -0.641 . . . . 0.0 109.27 175.666 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 55.0 mt -60.14 -35.68 63.19 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.24 0 N-CA-C 110.407 -0.22 . . . . 0.0 110.407 179.909 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 131' ' ' TRP . . . . . . . . . . . . . 46.2 m0 . . . . . 0 N--CA 1.453 -0.305 0 N-CA-C 112.937 0.717 . . . . 0.0 112.937 -178.589 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 23.5 p-10 . . . . . 0 N--CA 1.451 -0.408 0 N-CA-C 107.003 -1.48 . . . . 0.0 107.003 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 7' ' ' PHE . . . . . 0.65 ' HB2' ' HZ2' ' A' ' 45' ' ' LYS . 1.5 t80 -54.58 -34.45 61.95 Favored 'General case' 0 N--CA 1.45 -0.447 0 CA-C-N 114.839 -1.073 . . . . 0.0 109.311 175.006 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 50.9 tp60 -51.82 -35.64 45.06 Favored 'General case' 0 N--CA 1.454 -0.234 0 C-N-CA 124.564 1.145 . . . . 0.0 111.802 -178.157 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 30.3 m-80 -73.0 -34.13 66.21 Favored 'General case' 0 N--CA 1.455 -0.196 0 N-CA-C 109.826 -0.435 . . . . 0.0 109.826 -179.762 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 10' ' ' PHE . . . . . 0.452 ' CE2' ' HB2' ' A' ' 32' ' ' LEU . 5.1 t80 -69.54 -38.95 77.69 Favored 'General case' 0 N--CA 1.447 -0.59 0 C-N-CA 123.57 0.748 . . . . 0.0 109.166 175.774 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 93.3 t -65.47 -53.18 42.52 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.426 0 N-CA-C 109.167 -0.679 . . . . 0.0 109.167 178.548 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -57.59 -29.18 64.26 Favored 'General case' 0 N--CA 1.454 -0.246 0 C-N-CA 122.554 0.341 . . . . 0.0 111.359 178.884 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 87.2 m -72.31 -39.1 68.5 Favored 'General case' 0 N--CA 1.456 -0.16 0 N-CA-C 109.345 -0.613 . . . . 0.0 109.345 176.263 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -64.74 -45.61 85.73 Favored 'General case' 0 N--CA 1.454 -0.236 0 N-CA-C 109.457 -0.572 . . . . 0.0 109.457 178.356 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 57.5 mm-40 -63.83 -32.12 73.53 Favored 'General case' 0 N--CA 1.453 -0.302 0 N-CA-C 109.357 -0.609 . . . . 0.0 109.357 178.37 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 69.7 m -66.25 -34.13 77.32 Favored 'General case' 0 N--CA 1.45 -0.473 0 CA-C-O 118.722 -0.656 . . . . 0.0 110.188 177.456 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 42.8 m-85 -67.77 -39.33 84.13 Favored 'General case' 0 C--N 1.343 0.296 0 CA-C-N 119.036 0.835 . . . . 0.0 110.152 176.274 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . 0.418 ' HG2' ' CE1' ' A' ' 53' ' ' TYR . 46.0 mttt -60.14 -31.2 69.86 Favored 'General case' 0 C--N 1.341 0.208 0 CA-C-N 118.285 0.493 . . . . 0.0 109.844 -179.715 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 45.8 t0 -74.71 -16.78 60.74 Favored 'General case' 0 CA--C 1.534 0.359 0 CA-C-N 115.33 -0.85 . . . . 0.0 112.36 -179.676 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 81.8 mt -73.29 158.72 34.59 Favored 'General case' 0 N--CA 1.456 -0.138 0 O-C-N 121.528 -0.732 . . . . 0.0 112.07 -176.796 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 1.5 mppt? -98.3 -2.97 38.24 Favored 'General case' 0 CA--C 1.533 0.317 0 CA-C-N 115.106 -0.952 . . . . 0.0 109.7 176.087 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 87.0 p -120.65 -20.08 7.2 Favored 'General case' 0 C--N 1.34 0.168 0 C-N-CA 123.885 0.874 . . . . 0.0 111.031 179.428 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 77.03 -28.71 1.63 Allowed Glycine 0 CA--C 1.53 0.986 0 C-N-CA 124.093 0.854 . . . . 0.0 111.952 179.424 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 92.8 mt -85.89 150.21 3.98 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.341 0 N-CA-C 108.889 -0.782 . . . . 0.0 108.889 175.181 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 29.7 t -161.56 94.96 0.99 Allowed 'General case' 0 CA--C 1.513 -0.47 0 N-CA-C 109.159 -0.682 . . . . 0.0 109.159 170.006 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -55.56 -34.56 60.36 Favored Glycine 0 N--CA 1.445 -0.722 0 N-CA-C 110.881 -0.887 . . . . 0.0 110.881 -177.646 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 15.8 t -65.28 -54.44 29.24 Favored 'General case' 0 N--CA 1.455 -0.218 0 CA-C-N 118.334 1.067 . . . . 0.0 109.905 179.327 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 17.4 mmt85 -68.19 -38.06 81.61 Favored 'General case' 0 N--CA 1.455 -0.217 0 C-N-CA 122.3 0.24 . . . . 0.0 110.69 -176.523 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 75.6 mt -59.71 -43.49 91.55 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.634 0 N-CA-C 108.615 -0.883 . . . . 0.0 108.615 176.109 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 31.6 mtmm -67.02 -27.61 67.55 Favored 'General case' 0 C--N 1.34 0.19 0 CA-C-O 118.928 -0.558 . . . . 0.0 111.466 178.108 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.55 -58.61 5.38 Favored 'General case' 0 C--N 1.343 0.291 0 CA-C-N 118.848 0.749 . . . . 0.0 110.028 -179.969 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . 0.452 ' HB2' ' CE2' ' A' ' 10' ' ' PHE . 2.3 pp -75.31 -19.23 59.77 Favored 'General case' 0 CA--C 1.529 0.144 0 C-N-CA 119.887 -0.725 . . . . 0.0 111.589 -175.964 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 37.9 m -71.61 -40.93 69.49 Favored 'General case' 0 N--CA 1.456 -0.158 0 N-CA-C 107.8 -1.185 . . . . 0.0 107.8 176.517 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 92.6 m -68.21 -37.24 80.67 Favored 'General case' 0 N--CA 1.453 -0.323 0 C-N-CA 121.078 -0.249 . . . . 0.0 110.384 -178.563 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 24.1 t80 -63.06 -37.62 87.93 Favored 'General case' 0 N--CA 1.456 -0.135 0 N-CA-C 109.992 -0.373 . . . . 0.0 109.992 175.749 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -73.52 -36.5 65.73 Favored 'General case' 0 N--CA 1.45 -0.434 0 C-N-CA 122.471 0.309 . . . . 0.0 110.761 -179.026 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -71.32 -34.58 70.69 Favored 'General case' 0 N--CA 1.455 -0.183 0 C-N-CA 122.568 0.347 . . . . 0.0 110.547 179.363 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 43.5 t0 -69.72 -22.81 63.36 Favored 'General case' 0 CA--C 1.534 0.344 0 C-N-CA 122.544 0.338 . . . . 0.0 110.745 176.462 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 96.5 m-70 -151.68 101.23 2.76 Favored 'General case' 0 N--CA 1.454 -0.24 0 N-CA-C 111.914 0.338 . . . . 0.0 111.914 -175.461 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 40' ' ' ILE . . . . . 0.518 ' H ' HD12 ' A' ' 40' ' ' ILE . 0.0 OUTLIER -78.67 -12.78 13.57 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.294 0 N-CA-C 109.728 -0.471 . . . . 0.0 109.728 174.187 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 17.2 m-20 -57.87 -19.43 29.28 Favored 'General case' 0 N--CA 1.454 -0.235 0 C-N-CA 123.774 0.83 . . . . 0.0 112.655 -176.817 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -112.29 19.82 6.79 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.245 0 C-N-CA 123.31 0.644 . . . . 0.0 111.388 178.091 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 3.1 pp20? -52.89 -28.1 21.64 Favored 'General case' 0 CA--C 1.532 0.255 0 O-C-N 121.856 -0.528 . . . . 0.0 111.728 178.055 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 36.6 t -64.97 -48.42 74.11 Favored 'General case' 0 CA--C 1.532 0.269 0 N-CA-C 111.634 0.235 . . . . 0.0 111.634 -177.26 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . 0.65 ' HZ2' ' HB2' ' A' ' 7' ' ' PHE . 17.6 ptpt -73.35 -23.6 60.24 Favored 'General case' 0 C--N 1.341 0.2 0 CA-C-N 117.95 0.341 . . . . 0.0 110.398 179.275 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 67.1 mt -72.58 -51.19 29.63 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.318 0 C-N-CA 122.999 0.52 . . . . 0.0 110.278 -178.835 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 36.6 mm -66.78 -38.35 81.33 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.352 0 N-CA-C 109.996 -0.372 . . . . 0.0 109.996 -179.716 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 33.3 t -67.85 -34.98 77.74 Favored 'General case' 0 N--CA 1.454 -0.272 0 C-N-CA 120.778 -0.369 . . . . 0.0 111.378 -179.046 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 39.7 tp -77.79 -33.67 52.5 Favored 'General case' 0 N--CA 1.451 -0.395 0 O-C-N 121.652 -0.655 . . . . 0.0 112.407 -176.46 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 4.2 pt -70.28 -43.08 78.83 Favored 'Isoleucine or valine' 0 C--N 1.34 0.173 0 CA-C-N 118.832 0.742 . . . . 0.0 110.378 177.55 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 32.3 pt -63.12 -37.32 79.09 Favored 'Isoleucine or valine' 0 N--CA 1.461 0.101 0 C-N-CA 119.444 -0.903 . . . . 0.0 110.766 177.949 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 92.6 m-20 -68.51 -41.5 79.87 Favored 'General case' 0 N--CA 1.452 -0.346 0 O-C-N 121.937 -0.477 . . . . 0.0 111.571 178.409 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 53' ' ' TYR . . . . . 0.418 ' CE1' ' HG2' ' A' ' 18' ' ' LYS . 11.2 t80 -64.15 -42.75 96.66 Favored 'General case' 0 CA--C 1.523 -0.078 0 CA-C-N 118.891 0.769 . . . . 0.0 109.227 177.027 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 24.1 t -68.75 -24.72 64.48 Favored 'General case' 0 N--CA 1.453 -0.323 0 N-CA-C 112.105 0.409 . . . . 0.0 112.105 -176.665 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 73.4 mtm180 -86.18 -31.72 21.62 Favored 'General case' 0 N--CA 1.457 -0.094 0 CA-C-N 118.7 0.682 . . . . 0.0 111.823 179.946 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 47.4 mt -84.86 -43.6 13.98 Favored 'General case' 0 CA--C 1.528 0.118 0 N-CA-C 113.02 0.748 . . . . 0.0 113.02 -179.22 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 16.7 p -60.65 155.26 51.76 Favored Pre-proline 0 CA--C 1.538 0.493 0 N-CA-C 113.705 1.002 . . . . 0.0 113.705 -173.322 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 72.3 Cg_endo -75.67 -177.76 3.82 Favored 'Trans proline' 0 N--CA 1.457 -0.619 0 C-N-CA 124.848 3.698 . . . . 0.0 111.545 177.188 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -55.02 -50.91 67.87 Favored 'General case' 0 CA--C 1.53 0.201 0 N-CA-C 114.908 1.447 . . . . 0.0 114.908 -171.913 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 45.3 m -66.99 -39.34 87.12 Favored 'General case' 0 C--N 1.331 -0.199 0 O-C-N 121.743 -0.598 . . . . 0.0 109.964 -176.609 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 71.2 m80 -75.43 -17.47 60.16 Favored 'General case' 0 N--CA 1.45 -0.437 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.526 177.378 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 10.9 tppt? -66.95 -45.08 78.88 Favored 'General case' 0 N--CA 1.457 -0.086 0 N-CA-C 109.065 -0.716 . . . . 0.0 109.065 174.081 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -63.91 -42.76 97.32 Favored 'General case' 0 N--CA 1.454 -0.267 0 N-CA-C 108.32 -0.993 . . . . 0.0 108.32 177.789 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -66.15 -33.84 86.47 Favored Glycine 0 CA--C 1.53 0.98 0 N-CA-C 111.95 -0.46 . . . . 0.0 111.95 178.331 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 63.2 m -64.74 -42.16 95.39 Favored 'General case' 0 N--CA 1.456 -0.141 0 CA-C-N 117.927 0.864 . . . . 0.0 110.342 177.601 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 80.0 mt -68.71 -27.23 65.76 Favored 'General case' 0 N--CA 1.455 -0.224 0 N-CA-C 110.277 -0.268 . . . . 0.0 110.277 179.421 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 1.0 OUTLIER -68.42 -38.73 81.48 Favored 'General case' 0 N--CA 1.455 -0.203 0 CA-C-N 117.736 0.244 . . . . 0.0 111.413 175.739 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 68' ' ' ILE . . . . . . . . . . . . . 14.7 mt -66.42 -53.64 34.09 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.445 0 N-CA-C 109.178 -0.675 . . . . 0.0 109.178 176.679 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 81.3 mt -50.27 -37.11 13.79 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.19 0 C-N-CA 124.233 1.013 . . . . 0.0 111.678 174.413 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 12.8 t70 -69.05 -46.2 68.47 Favored 'General case' 0 N--CA 1.455 -0.195 0 CA-C-N 118.292 0.496 . . . . 0.0 111.109 179.915 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 30.7 t -64.06 -55.51 21.64 Favored 'General case' 0 N--CA 1.45 -0.464 0 CA-C-N 116.58 -0.282 . . . . 0.0 110.646 -175.968 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -74.36 -32.9 32.25 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.246 0 N-CA-C 110.192 -0.299 . . . . 0.0 110.192 -177.18 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -66.7 -55.26 18.14 Favored Glycine 0 C--N 1.34 0.777 0 N-CA-C 111.589 -0.604 . . . . 0.0 111.589 -174.555 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 33.9 mtm105 -68.7 -37.52 79.58 Favored 'General case' 0 N--CA 1.455 -0.182 0 C-N-CA 120.099 -0.64 . . . . 0.0 110.088 179.158 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -64.7 -29.95 70.96 Favored 'General case' 0 N--CA 1.452 -0.368 0 C-N-CA 120.1 -0.64 . . . . 0.0 110.624 -179.624 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 1.3 m-30 -69.73 -46.0 66.89 Favored 'General case' 0 N--CA 1.454 -0.274 0 CA-C-N 118.401 0.546 . . . . 0.0 110.494 175.832 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -65.01 -49.09 71.57 Favored 'General case' 0 N--CA 1.449 -0.475 0 C-N-CA 118.788 -1.165 . . . . 0.0 108.047 -179.634 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 89.2 m-20 -55.92 -44.34 78.21 Favored 'General case' 0 CA--C 1.53 0.176 0 N-CA-C 112.725 0.639 . . . . 0.0 112.725 -179.689 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 8.3 tm-20 -63.42 -51.85 64.02 Favored 'General case' 0 N--CA 1.45 -0.438 0 CA-C-N 118.548 0.613 . . . . 0.0 111.32 -178.808 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 59.2 p -65.47 -26.24 67.84 Favored 'General case' 0 N--CA 1.454 -0.237 0 CA-C-N 117.83 0.286 . . . . 0.0 110.567 -179.957 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 35.5 ttp180 -75.62 -20.07 58.79 Favored 'General case' 0 N--CA 1.448 -0.542 0 C-N-CA 123.937 0.895 . . . . 0.0 111.051 174.349 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 27.5 m . . . . . 0 CA--C 1.53 0.198 0 C-N-CA 122.924 0.49 . . . . 0.0 111.82 179.476 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 67.2 Cg_endo . . . . . 0 N--CA 1.453 -0.899 0 N-CA-C 109.193 -1.118 . . . . 0.0 109.193 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 85.55 16.25 64.43 Favored Glycine 0 CA--C 1.525 0.674 0 N-CA-C 110.788 -0.925 . . . . 0.0 110.788 -176.272 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -155.8 167.15 31.33 Favored 'General case' 0 N--CA 1.454 -0.255 0 C-N-CA 123.7 0.8 . . . . 0.0 109.333 -179.218 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 94' ' ' CYS . . . . . . . . . . . . . 30.1 p -58.15 -20.01 37.32 Favored 'General case' 0 N--CA 1.453 -0.307 0 C-N-CA 122.703 0.401 . . . . 0.0 110.807 179.087 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -58.53 -60.47 3.74 Favored 'General case' 0 N--CA 1.447 -0.577 0 C-N-CA 122.34 0.256 . . . . 0.0 110.702 -176.514 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 75.3 t60 -74.01 -32.65 63.48 Favored 'General case' 0 N--CA 1.451 -0.407 0 C-N-CA 121.003 -0.279 . . . . 0.0 110.496 -179.86 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -64.46 -53.44 48.15 Favored 'General case' 0 N--CA 1.451 -0.402 0 C-N-CA 122.407 0.283 . . . . 0.0 111.124 -176.26 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 1.7 mp -72.42 -33.12 44.6 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.291 0 N-CA-C 110.056 -0.35 . . . . 0.0 110.056 -178.737 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 1.4 m120 -66.42 -41.25 89.49 Favored 'General case' 0 C--O 1.225 -0.199 0 CA-C-N 118.27 0.486 . . . . 0.0 111.1 177.976 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 96.7 m -73.5 -32.59 64.35 Favored 'General case' 0 N--CA 1.457 -0.122 0 CA-C-N 118.242 0.474 . . . . 0.0 110.894 -177.675 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 60.5 tp -73.2 -39.6 65.44 Favored 'General case' 0 N--CA 1.45 -0.463 0 N-CA-C 111.528 0.196 . . . . 0.0 111.528 -177.268 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -69.31 -16.9 71.74 Favored Glycine 0 CA--C 1.529 0.944 0 CA-C-O 119.713 -0.493 . . . . 0.0 114.031 -173.828 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 6.2 mm-40 -87.76 -32.08 19.31 Favored 'General case' 0 CA--C 1.52 -0.173 0 CA-C-N 118.322 1.061 . . . . 0.0 111.538 178.92 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 81.7 t -93.69 -20.68 6.23 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.09 0 C-N-CA 122.759 0.424 . . . . 0.0 112.119 -177.499 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 105' ' ' ILE . . . . . . . . . . . . . 10.7 tp -60.54 -22.5 25.9 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.224 0 O-C-N 121.571 -0.706 . . . . 0.0 112.099 -175.167 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 26.4 pt20 -67.77 -25.67 65.73 Favored 'General case' 0 CA--C 1.53 0.201 0 O-C-N 121.982 -0.448 . . . . 0.0 110.511 177.236 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 72.2 mt-10 -74.3 -43.04 58.43 Favored 'General case' 0 N--CA 1.454 -0.254 0 N-CA-C 109.474 -0.565 . . . . 0.0 109.474 176.816 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 10.4 mp -67.4 -45.11 77.14 Favored 'General case' 0 N--CA 1.452 -0.364 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.239 -177.847 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 3.0 mp -65.94 -53.33 40.59 Favored 'General case' 0 N--CA 1.451 -0.379 0 CA-C-O 119.146 -0.454 . . . . 0.0 110.584 -178.219 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 15.4 m -54.39 -47.22 72.94 Favored 'General case' 0 C--O 1.233 0.198 0 CA-C-N 118.139 0.427 . . . . 0.0 110.501 -178.262 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 40.5 t0 -62.21 -43.37 98.98 Favored 'General case' 0 N--CA 1.452 -0.365 0 N-CA-C 109.309 -0.626 . . . . 0.0 109.309 178.117 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -67.87 -36.89 81.05 Favored 'General case' 0 N--CA 1.447 -0.619 0 CA-C-O 119.135 -0.46 . . . . 0.0 111.438 -175.148 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 113' ' ' ILE . . . . . 0.487 ' O ' ' HE2' ' A' ' 121' ' ' LYS . 19.9 mm -68.79 -40.85 81.94 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.426 0 C-N-CA 118.805 -1.158 . . . . 0.0 110.1 -179.434 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -75.56 -39.09 58.7 Favored 'General case' 0 N--CA 1.454 -0.237 0 N-CA-C 112.837 0.68 . . . . 0.0 112.837 179.836 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 115' ' ' LYS . . . . . 0.598 ' HE2' ' HA ' ' A' ' 115' ' ' LYS . 0.6 OUTLIER -78.85 -38.41 38.0 Favored 'General case' 0 N--CA 1.456 -0.165 0 N-CA-C 113.342 0.867 . . . . 0.0 113.342 -177.711 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 116' ' ' SER . . . . . 0.446 ' HB2' ' CB ' ' A' ' 120' ' ' HIS . 52.6 p -74.56 157.23 35.82 Favored 'General case' 0 CA--C 1.529 0.146 0 CA-C-N 117.918 0.326 . . . . 0.0 111.744 -172.628 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 56.5 t30 -79.57 166.21 22.15 Favored 'General case' 0 CA--C 1.531 0.23 0 C-N-CA 122.877 0.471 . . . . 0.0 110.61 -178.997 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 118' ' ' GLN . . . . . . . . . . . . . 3.4 pt20 -49.1 -46.27 44.51 Favored 'General case' 0 CA--C 1.532 0.25 0 N-CA-C 112.823 0.675 . . . . 0.0 112.823 -174.34 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 6.8 p30 -65.42 -35.85 82.18 Favored 'General case' 0 N--CA 1.456 -0.149 0 C-N-CA 123.059 0.544 . . . . 0.0 111.358 179.122 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 120' ' ' HIS . . . . . 0.446 ' CB ' ' HB2' ' A' ' 116' ' ' SER . 32.3 m170 -68.12 -43.91 77.3 Favored 'General case' 0 N--CA 1.448 -0.544 0 N-CA-C 110.145 -0.317 . . . . 0.0 110.145 176.666 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 121' ' ' LYS . . . . . 0.487 ' HE2' ' O ' ' A' ' 113' ' ' ILE . 76.0 mttt -57.0 -38.99 73.85 Favored 'General case' 0 C--N 1.342 0.254 0 N-CA-C 109.514 -0.55 . . . . 0.0 109.514 179.896 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 2.8 tm-20 -65.43 -47.61 75.61 Favored 'General case' 0 N--CA 1.456 -0.172 0 C-N-CA 122.402 0.281 . . . . 0.0 110.614 178.905 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 62.4 mttp -65.95 -28.92 69.27 Favored 'General case' 0 N--CA 1.454 -0.233 0 CA-C-O 119.836 -0.126 . . . . 0.0 111.075 -179.558 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 124' ' ' ILE . . . . . . . . . . . . . 59.2 mt -70.73 -42.97 77.7 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.297 0 N-CA-C 109.436 -0.579 . . . . 0.0 109.436 176.071 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 125' ' ' ARG . . . . . 0.415 ' HA ' HH11 ' A' ' 125' ' ' ARG . 7.3 mmm180 -59.27 -46.39 88.67 Favored 'General case' 0 N--CA 1.451 -0.383 0 CA-C-O 118.982 -0.532 . . . . 0.0 111.236 -179.503 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 126' ' ' MET . . . . . . . . . . . . . 27.6 ptm -65.47 -33.47 76.0 Favored 'General case' 0 N--CA 1.451 -0.401 0 C-N-CA 119.278 -0.969 . . . . 0.0 109.66 178.814 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 18.7 tp -69.61 -31.72 70.01 Favored 'General case' 0 CA--C 1.533 0.307 0 CA-C-N 118.025 0.375 . . . . 0.0 111.617 179.654 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 92.9 mt -75.76 -38.06 58.73 Favored 'General case' 0 N--CA 1.456 -0.167 0 O-C-N 121.909 -0.494 . . . . 0.0 110.531 177.378 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 54.7 m-20 -60.29 -38.23 82.97 Favored 'General case' 0 N--CA 1.454 -0.226 0 N-CA-C 109.117 -0.698 . . . . 0.0 109.117 176.031 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 36.5 mt -63.15 -40.7 90.02 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.359 0 C-N-CA 124.32 1.048 . . . . 0.0 110.816 176.08 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 131' ' ' TRP . . . . . . . . . . . . . 48.7 m0 . . . . . 0 N--CA 1.452 -0.349 0 C-N-CA 120.009 -0.677 . . . . 0.0 111.178 176.949 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 29.7 p-10 . . . . . 0 N--CA 1.451 -0.389 0 N-CA-C 107.786 -1.19 . . . . 0.0 107.786 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 7' ' ' PHE . . . . . 0.53 ' HB2' ' HZ1' ' A' ' 45' ' ' LYS . 1.3 t80 -59.14 -33.99 71.54 Favored 'General case' 0 N--CA 1.446 -0.67 0 C-N-CA 125.416 1.487 . . . . 0.0 109.981 -179.978 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 51.2 tp60 -49.76 -37.24 28.84 Favored 'General case' 0 N--CA 1.451 -0.395 0 C-N-CA 124.347 1.059 . . . . 0.0 111.609 -179.006 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 25.5 m-80 -73.94 -33.27 63.86 Favored 'General case' 0 N--CA 1.452 -0.356 0 O-C-N 122.202 -0.311 . . . . 0.0 110.397 -179.478 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 10' ' ' PHE . . . . . 0.413 ' CE2' ' HB2' ' A' ' 32' ' ' LEU . 6.5 t80 -71.23 -40.36 71.12 Favored 'General case' 0 N--CA 1.449 -0.515 0 C-N-CA 123.311 0.645 . . . . 0.0 109.499 177.511 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 89.1 t -63.6 -53.46 44.71 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.417 0 N-CA-C 108.407 -0.96 . . . . 0.0 108.407 179.071 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -59.54 -29.34 67.83 Favored 'General case' 0 N--CA 1.455 -0.221 0 C-N-CA 122.748 0.419 . . . . 0.0 111.774 -179.659 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 92.3 m -71.73 -37.12 70.64 Favored 'General case' 0 CA--C 1.531 0.216 0 N-CA-C 108.901 -0.777 . . . . 0.0 108.901 176.206 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . 0.44 ' HA ' ' CD1' ' A' ' 17' ' ' PHE . 5.6 tp -69.03 -41.05 78.22 Favored 'General case' 0 N--CA 1.452 -0.352 0 CA-C-O 120.981 0.42 . . . . 0.0 110.379 178.751 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 64.1 mm-40 -64.88 -30.98 72.0 Favored 'General case' 0 N--CA 1.45 -0.447 0 N-CA-C 108.378 -0.971 . . . . 0.0 108.378 176.668 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 23.1 t -73.48 -20.45 60.68 Favored 'General case' 0 N--CA 1.453 -0.288 0 CA-C-N 115.844 -0.616 . . . . 0.0 109.894 178.375 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 17' ' ' PHE . . . . . 0.44 ' CD1' ' HA ' ' A' ' 14' ' ' LEU . 22.9 m-85 -75.43 -35.66 60.92 Favored 'General case' 0 N--CA 1.455 -0.188 0 C-N-CA 120.181 -0.607 . . . . 0.0 110.512 168.62 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 68.2 mttt -62.0 -28.79 69.82 Favored 'General case' 0 C--N 1.339 0.127 0 CA-C-N 118.37 0.532 . . . . 0.0 109.776 179.066 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 19.7 t0 -64.31 -20.89 66.38 Favored 'General case' 0 CA--C 1.533 0.323 0 CA-C-N 115.706 -0.679 . . . . 0.0 111.885 176.86 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 43.3 mt -70.79 155.17 41.12 Favored 'General case' 0 N--CA 1.457 -0.082 0 O-C-N 121.476 -0.765 . . . . 0.0 111.885 -175.192 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 1.4 mppt? -100.99 -3.72 28.88 Favored 'General case' 0 CA--C 1.528 0.116 0 N-CA-C 109.06 -0.719 . . . . 0.0 109.06 173.168 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 82.9 p -121.83 -20.4 6.42 Favored 'General case' 0 CA--C 1.528 0.096 0 C-N-CA 124.507 1.123 . . . . 0.0 111.091 -178.924 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 82.7 -16.8 24.04 Favored Glycine 0 CA--C 1.53 0.995 0 C-N-CA 124.153 0.882 . . . . 0.0 113.499 176.213 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 81.5 mt -101.43 148.5 7.24 Favored 'Isoleucine or valine' 0 CA--C 1.528 0.113 0 CA-C-N 118.452 1.126 . . . . 0.0 110.73 -179.671 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 41.9 t -162.54 85.59 0.56 Allowed 'General case' 0 CA--C 1.519 -0.23 0 N-CA-C 110.04 -0.356 . . . . 0.0 110.04 178.82 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . 0.4 ' O ' ' HE2' ' A' ' 30' ' ' LYS . . . -51.15 -39.72 42.68 Favored Glycine 0 CA--C 1.523 0.551 0 CA-C-O 119.168 -0.795 . . . . 0.0 112.236 -175.635 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 91.4 p -66.0 -48.03 72.54 Favored 'General case' 0 N--CA 1.454 -0.243 0 CA-C-N 118.999 1.399 . . . . 0.0 110.952 -176.807 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 54.5 mtm180 -73.15 -34.57 66.14 Favored 'General case' 0 CA--C 1.527 0.09 0 CA-C-N 118.014 0.37 . . . . 0.0 110.57 -179.351 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 65.1 mt -59.05 -48.45 86.67 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.487 0 N-CA-C 109.057 -0.72 . . . . 0.0 109.057 173.584 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . 0.4 ' HE2' ' O ' ' A' ' 26' ' ' GLY . 49.2 mtmt -68.75 -23.18 64.3 Favored 'General case' 0 N--CA 1.456 -0.173 0 CA-C-O 119.012 -0.518 . . . . 0.0 111.505 -179.564 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . 0.427 ' CE ' ' HA ' ' A' ' 31' ' ' LYS . 4.1 mmpt? -66.35 -57.14 8.1 Favored 'General case' 0 C--N 1.341 0.213 0 CA-C-N 118.693 0.679 . . . . 0.0 110.443 176.255 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . 0.413 ' HB2' ' CE2' ' A' ' 10' ' ' PHE . 2.3 pp -75.43 -18.85 59.79 Favored 'General case' 0 CA--C 1.531 0.247 0 C-N-CA 119.615 -0.834 . . . . 0.0 111.505 -178.105 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 60.1 m -72.88 -38.42 66.99 Favored 'General case' 0 N--CA 1.455 -0.222 0 N-CA-C 109.077 -0.712 . . . . 0.0 109.077 175.678 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 57.9 m -69.08 -35.59 76.67 Favored 'General case' 0 N--CA 1.453 -0.312 0 N-CA-C 110.001 -0.37 . . . . 0.0 110.001 179.918 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 9.1 t80 -62.17 -39.51 92.91 Favored 'General case' 0 C--O 1.231 0.122 0 N-CA-C 109.626 -0.509 . . . . 0.0 109.626 174.446 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -71.61 -36.79 70.92 Favored 'General case' 0 N--CA 1.448 -0.526 0 CA-C-O 119.564 -0.255 . . . . 0.0 111.685 -179.644 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -70.0 -34.07 72.85 Favored 'General case' 0 N--CA 1.456 -0.168 0 CA-C-N 117.915 0.325 . . . . 0.0 111.045 -179.825 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 43.9 t0 -68.91 -23.93 64.24 Favored 'General case' 0 CA--C 1.533 0.325 0 C-N-CA 122.132 0.173 . . . . 0.0 110.633 176.934 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 97.8 m-70 -151.93 104.6 3.01 Favored 'General case' 0 N--CA 1.456 -0.167 0 N-CA-C 112.199 0.444 . . . . 0.0 112.199 -174.517 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 40' ' ' ILE . . . . . 0.531 ' H ' HD13 ' A' ' 40' ' ' ILE . 0.0 OUTLIER -79.0 -12.03 13.25 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.302 0 C-N-CA 122.736 0.414 . . . . 0.0 110.149 174.165 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 16.0 m-20 -59.44 -11.73 4.95 Favored 'General case' 0 CA--C 1.53 0.176 0 C-N-CA 123.418 0.687 . . . . 0.0 112.787 -176.794 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -119.46 18.06 6.58 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.198 0 C-N-CA 124.068 0.947 . . . . 0.0 111.667 177.799 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 3.0 pp20? -53.88 -28.91 39.19 Favored 'General case' 0 CA--C 1.53 0.193 0 O-C-N 121.379 -0.825 . . . . 0.0 111.296 178.092 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 47.1 t -65.21 -44.24 88.94 Favored 'General case' 0 CA--C 1.533 0.289 0 N-CA-C 111.899 0.333 . . . . 0.0 111.899 -177.878 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . 0.53 ' HZ1' ' HB2' ' A' ' 7' ' ' PHE . 15.0 ptpt -74.87 -25.67 59.13 Favored 'General case' 0 CA--C 1.53 0.185 0 CA-C-N 118.385 0.539 . . . . 0.0 109.816 179.012 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 67.2 mt -72.72 -51.68 26.61 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.251 0 C-N-CA 123.076 0.55 . . . . 0.0 110.314 -177.476 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 38.8 mm -67.11 -39.95 84.27 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.112 0 N-CA-C 110.119 -0.326 . . . . 0.0 110.119 -179.768 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 48.0 t -66.72 -33.59 75.98 Favored 'General case' 0 N--CA 1.453 -0.313 0 C-N-CA 120.745 -0.382 . . . . 0.0 111.201 -178.841 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 44.4 tp -78.68 -37.55 41.5 Favored 'General case' 0 N--CA 1.451 -0.397 0 N-CA-C 112.749 0.648 . . . . 0.0 112.749 -177.474 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 3.6 pt -67.4 -44.01 87.3 Favored 'Isoleucine or valine' 0 C--N 1.34 0.162 0 CA-C-N 118.924 0.784 . . . . 0.0 110.172 178.933 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 16.9 pt -65.48 -38.05 81.53 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.203 0 C-N-CA 119.858 -0.737 . . . . 0.0 111.477 178.758 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 47.6 t0 -60.86 -53.63 54.95 Favored 'General case' 0 CA--C 1.528 0.104 0 CA-C-N 118.484 0.584 . . . . 0.0 110.21 177.469 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 3.5 t80 -61.16 -32.49 72.22 Favored 'General case' 0 C--O 1.225 -0.21 0 CA-C-O 118.813 -0.613 . . . . 0.0 109.839 179.173 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 17.2 p -63.46 -35.99 82.26 Favored 'General case' 0 N--CA 1.456 -0.16 0 CA-C-N 118.693 0.679 . . . . 0.0 110.859 -179.89 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 1.9 tpp180 -79.49 -39.69 31.52 Favored 'General case' 0 N--CA 1.455 -0.195 0 C-N-CA 122.146 0.178 . . . . 0.0 111.181 -177.57 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 79.6 mt -77.75 -45.28 25.11 Favored 'General case' 0 N--CA 1.455 -0.215 0 C-N-CA 123.764 0.825 . . . . 0.0 113.196 -176.468 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 13.6 p -64.38 159.64 57.3 Favored Pre-proline 0 CA--C 1.533 0.3 0 N-CA-C 113.882 1.067 . . . . 0.0 113.882 -171.628 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 33.4 Cg_exo -58.03 175.65 0.45 Allowed 'Trans proline' 0 N--CA 1.454 -0.796 0 C-N-CA 125.012 3.808 . . . . 0.0 112.827 173.884 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 35.8 p-10 -63.6 -42.19 98.28 Favored 'General case' 0 CA--C 1.53 0.189 0 C-N-CA 123.916 0.886 . . . . 0.0 112.171 -174.945 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 20.0 m -72.57 -35.48 67.97 Favored 'General case' 0 N--CA 1.452 -0.362 0 C-N-CA 122.702 0.401 . . . . 0.0 110.015 -178.203 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 51.3 m80 -75.17 -23.72 57.78 Favored 'General case' 0 N--CA 1.452 -0.337 0 C-N-CA 122.814 0.446 . . . . 0.0 110.252 177.817 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 22.3 ttmm -71.94 -35.41 69.61 Favored 'General case' 0 N--CA 1.455 -0.184 0 N-CA-C 109.327 -0.619 . . . . 0.0 109.327 174.527 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -62.76 -44.29 96.58 Favored 'General case' 0 CA--C 1.532 0.269 0 N-CA-C 107.155 -1.424 . . . . 0.0 107.155 172.078 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -65.59 -29.69 75.73 Favored Glycine 0 CA--C 1.526 0.736 0 N-CA-C 111.474 -0.65 . . . . 0.0 111.474 179.99 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 35.3 t -65.56 -41.52 92.86 Favored 'General case' 0 N--CA 1.452 -0.351 0 CA-C-N 117.469 0.635 . . . . 0.0 109.449 176.814 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 81.4 mt -67.74 -27.44 66.79 Favored 'General case' 0 N--CA 1.453 -0.276 0 N-CA-C 110.473 -0.195 . . . . 0.0 110.473 178.157 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 67' ' ' TYR . . . . . 0.403 ' CD2' HD13 ' A' ' 127' ' ' LEU . 2.4 m-85 -70.09 -37.99 75.58 Favored 'General case' 0 C--N 1.34 0.153 0 CA-C-N 117.983 0.356 . . . . 0.0 110.731 174.873 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 68' ' ' ILE . . . . . . . . . . . . . 13.9 mt -69.95 -54.2 20.19 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.451 0 N-CA-C 109.259 -0.645 . . . . 0.0 109.259 178.297 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 68.5 mt -48.11 -37.39 6.9 Favored 'Isoleucine or valine' 0 C--N 1.34 0.154 0 C-N-CA 124.141 0.976 . . . . 0.0 111.478 173.834 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 23.9 t70 -69.18 -43.89 73.31 Favored 'General case' 0 CA--C 1.52 -0.196 0 CA-C-N 118.912 0.778 . . . . 0.0 110.909 179.386 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 25.3 m -66.96 -56.01 12.05 Favored 'General case' 0 N--CA 1.449 -0.523 0 O-C-N 123.416 0.448 . . . . 0.0 110.024 -174.506 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -74.68 -32.97 30.26 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.386 0 N-CA-C 109.948 -0.39 . . . . 0.0 109.948 -176.944 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -65.57 -58.46 9.26 Favored Glycine 0 C--N 1.339 0.71 0 N-CA-C 111.388 -0.685 . . . . 0.0 111.388 -175.412 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 46.4 mtm105 -69.26 -36.41 77.1 Favored 'General case' 0 N--CA 1.456 -0.166 0 CA-C-N 117.455 0.628 . . . . 0.0 110.542 -178.972 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -64.23 -29.38 70.48 Favored 'General case' 0 N--CA 1.45 -0.433 0 C-N-CA 119.645 -0.822 . . . . 0.0 110.707 179.658 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 1.6 m-30 -71.27 -45.98 61.94 Favored 'General case' 0 C--N 1.342 0.244 0 CA-C-N 118.594 0.634 . . . . 0.0 110.637 175.399 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -64.58 -45.11 88.39 Favored 'General case' 0 N--CA 1.45 -0.452 0 N-CA-C 108.027 -1.101 . . . . 0.0 108.027 -178.123 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 92.2 m-20 -55.92 -46.85 78.34 Favored 'General case' 0 C--O 1.231 0.082 0 N-CA-C 113.463 0.912 . . . . 0.0 113.463 173.927 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 12.4 tm-20 -64.13 -47.44 79.92 Favored 'General case' 0 N--CA 1.449 -0.48 0 CA-C-N 118.604 0.638 . . . . 0.0 111.054 -178.341 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 75.7 p -69.34 -27.23 65.17 Favored 'General case' 0 N--CA 1.453 -0.304 0 CA-C-O 119.692 -0.194 . . . . 0.0 110.685 -179.409 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 36.4 ttp-105 -70.34 -27.69 64.56 Favored 'General case' 0 N--CA 1.451 -0.395 0 CA-C-N 118.096 0.407 . . . . 0.0 110.189 172.618 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 32.2 m . . . . . 0 N--CA 1.453 -0.276 0 N-CA-C 113.025 0.75 . . . . 0.0 113.025 -176.417 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 56.3 Cg_endo . . . . . 0 N--CA 1.45 -1.047 0 N-CA-C 108.467 -1.397 . . . . 0.0 108.467 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 90.23 17.06 54.49 Favored Glycine 0 CA--C 1.524 0.628 0 CA-C-O 119.417 -0.657 . . . . 0.0 112.277 -177.289 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 38.5 p -151.61 172.5 15.95 Favored 'General case' 0 C--N 1.341 0.201 0 CA-C-N 117.946 0.873 . . . . 0.0 110.203 176.739 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 94' ' ' CYS . . . . . . . . . . . . . 26.2 p -59.98 -20.99 60.61 Favored 'General case' 0 N--CA 1.449 -0.493 0 CA-C-N 115.621 -0.718 . . . . 0.0 109.936 175.682 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -60.29 -55.26 35.84 Favored 'General case' 0 N--CA 1.448 -0.53 0 N-CA-C 109.398 -0.593 . . . . 0.0 109.398 -177.261 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 69.3 t60 -75.46 -34.74 60.95 Favored 'General case' 0 N--CA 1.448 -0.546 0 CA-C-N 116.736 -0.211 . . . . 0.0 110.906 179.68 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -66.18 -49.41 67.45 Favored 'General case' 0 N--CA 1.451 -0.413 0 O-C-N 123.09 0.244 . . . . 0.0 111.126 -176.17 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 1.7 mp -72.79 -34.62 47.4 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.251 0 CA-C-O 119.234 -0.413 . . . . 0.0 109.986 179.699 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 1.4 m120 -66.14 -40.23 90.47 Favored 'General case' 0 N--CA 1.453 -0.289 0 CA-C-N 118.612 0.642 . . . . 0.0 111.293 178.715 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 92.6 m -75.19 -34.85 61.56 Favored 'General case' 0 N--CA 1.454 -0.256 0 CA-C-N 118.008 0.367 . . . . 0.0 110.838 -178.471 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 58.8 tp -75.65 -38.77 58.58 Favored 'General case' 0 N--CA 1.451 -0.417 0 C-N-CA 122.886 0.474 . . . . 0.0 111.013 -178.589 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -67.18 -23.58 73.15 Favored Glycine 0 CA--C 1.528 0.856 0 CA-C-O 119.542 -0.588 . . . . 0.0 113.441 -173.479 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 16.3 mm-40 -74.63 -35.77 62.91 Favored 'General case' 0 CA--C 1.52 -0.188 0 CA-C-N 118.158 0.979 . . . . 0.0 111.179 179.41 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 25.9 m -101.77 -13.43 8.41 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.138 0 N-CA-C 113.379 0.881 . . . . 0.0 113.379 -176.114 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 105' ' ' ILE . . . . . . . . . . . . . 11.0 tp -61.84 -27.24 41.89 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.161 0 CA-C-N 119.18 0.9 . . . . 0.0 111.564 -175.282 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 19.8 pt20 -67.0 -29.86 69.8 Favored 'General case' 0 N--CA 1.453 -0.277 0 N-CA-C 109.994 -0.373 . . . . 0.0 109.994 176.704 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 86.1 mt-10 -75.75 -41.31 53.63 Favored 'General case' 0 N--CA 1.454 -0.265 0 N-CA-C 109.918 -0.401 . . . . 0.0 109.918 175.806 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 9.9 mp -64.66 -41.97 95.72 Favored 'General case' 0 C--N 1.34 0.164 0 N-CA-C 110.361 -0.237 . . . . 0.0 110.361 -178.472 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 72.3 mt -66.85 -50.78 61.44 Favored 'General case' 0 N--CA 1.453 -0.284 0 N-CA-C 109.833 -0.432 . . . . 0.0 109.833 178.952 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 16.8 m -59.51 -45.79 90.71 Favored 'General case' 0 C--O 1.232 0.155 0 CA-C-N 117.724 0.238 . . . . 0.0 111.022 -178.744 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 44.7 t0 -62.83 -38.44 90.77 Favored 'General case' 0 N--CA 1.454 -0.234 0 N-CA-C 108.932 -0.766 . . . . 0.0 108.932 179.258 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -68.03 -31.65 71.47 Favored 'General case' 0 N--CA 1.446 -0.645 0 CA-C-O 119.352 -0.356 . . . . 0.0 111.611 -176.531 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 113' ' ' ILE . . . . . . . . . . . . . 31.2 mm -70.38 -44.1 77.68 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.269 0 C-N-CA 118.856 -1.137 . . . . 0.0 109.362 178.011 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -72.91 -33.92 66.29 Favored 'General case' 0 N--CA 1.452 -0.334 0 N-CA-C 113.033 0.753 . . . . 0.0 113.033 -178.483 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 115' ' ' LYS . . . . . 0.448 ' HZ2' ' CA ' ' A' ' 115' ' ' LYS . 0.0 OUTLIER -79.45 -37.01 37.94 Favored 'General case' 0 C--N 1.34 0.174 0 CA-C-N 118.293 0.497 . . . . 0.0 111.805 -179.186 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 116' ' ' SER . . . . . 0.489 ' HB2' ' CB ' ' A' ' 120' ' ' HIS . 21.0 p -85.45 164.6 17.78 Favored 'General case' 0 N--CA 1.449 -0.488 0 CA-C-O 120.93 0.395 . . . . 0.0 112.019 -171.431 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 20.4 m-80 -78.43 -100.19 0.02 OUTLIER 'General case' 0 N--CA 1.455 -0.204 0 N-CA-C 113.557 0.947 . . . . 0.0 113.557 -171.095 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 118' ' ' GLN . . . . . 0.474 ' HA ' ' HE2' ' A' ' 121' ' ' LYS . 14.8 mm100 -136.84 -49.84 0.64 Allowed 'General case' 0 CA--C 1.52 -0.174 0 CA-C-O 120.862 0.363 . . . . 0.0 110.355 -179.005 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 119' ' ' ASP . . . . . 0.407 ' N ' ' OD1' ' A' ' 119' ' ' ASP . 10.3 p-10 -62.9 -39.17 93.72 Favored 'General case' 0 N--CA 1.453 -0.3 0 N-CA-C 108.471 -0.937 . . . . 0.0 108.471 175.206 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 120' ' ' HIS . . . . . 0.489 ' CB ' ' HB2' ' A' ' 116' ' ' SER . 39.9 m170 -66.04 -40.91 91.36 Favored 'General case' 0 N--CA 1.45 -0.457 0 CA-C-N 115.687 -0.688 . . . . 0.0 110.881 176.477 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 121' ' ' LYS . . . . . 0.474 ' HE2' ' HA ' ' A' ' 118' ' ' GLN . 38.2 mtmt -63.67 -34.85 78.77 Favored 'General case' 0 N--CA 1.455 -0.213 0 N-CA-C 109.795 -0.446 . . . . 0.0 109.795 179.443 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 4.8 tm-20 -64.41 -48.66 74.55 Favored 'General case' 0 N--CA 1.456 -0.131 0 CA-C-N 117.705 0.23 . . . . 0.0 110.418 178.239 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 69.7 mmtt -59.8 -30.82 69.16 Favored 'General case' 0 N--CA 1.455 -0.214 0 CA-C-N 116.786 -0.188 . . . . 0.0 111.459 179.222 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 124' ' ' ILE . . . . . . . . . . . . . 51.3 mt -74.75 -34.34 33.7 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.293 0 O-C-N 121.882 -0.511 . . . . 0.0 110.183 178.681 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 24.1 mmt180 -68.46 -35.83 78.12 Favored 'General case' 0 N--CA 1.455 -0.189 0 CA-C-O 119.361 -0.352 . . . . 0.0 111.244 178.394 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 126' ' ' MET . . . . . . . . . . . . . 27.8 ptm -71.91 -33.48 68.32 Favored 'General case' 0 C--N 1.34 0.154 0 C-N-CA 119.333 -0.947 . . . . 0.0 109.514 177.659 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 127' ' ' LEU . . . . . 0.403 HD13 ' CD2' ' A' ' 67' ' ' TYR . 65.2 mt -70.7 -25.7 63.08 Favored 'General case' 0 C--N 1.341 0.2 0 CA-C-N 118.109 0.413 . . . . 0.0 110.167 175.882 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 55.3 tp -68.99 -42.97 75.82 Favored 'General case' 0 N--CA 1.452 -0.327 0 N-CA-C 109.793 -0.447 . . . . 0.0 109.793 177.875 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 12.9 t70 -61.46 -46.2 91.04 Favored 'General case' 0 N--CA 1.456 -0.133 0 N-CA-C 109.576 -0.528 . . . . 0.0 109.576 175.641 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 72.9 mt -59.86 -40.42 82.7 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.392 0 CA-C-N 116.362 -0.381 . . . . 0.0 110.991 -177.42 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 131' ' ' TRP . . . . . . . . . . . . . 46.1 m0 . . . . . 0 N--CA 1.453 -0.306 0 N-CA-C 112.754 0.65 . . . . 0.0 112.754 178.535 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 24.1 p-10 . . . . . 0 N--CA 1.451 -0.385 0 N-CA-C 106.98 -1.489 . . . . 0.0 106.98 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 7' ' ' PHE . . . . . 0.626 ' HB2' ' HZ3' ' A' ' 45' ' ' LYS . 1.2 t80 -56.51 -34.37 66.92 Favored 'General case' 0 N--CA 1.449 -0.509 0 C-N-CA 125.144 1.378 . . . . 0.0 109.248 176.49 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 51.7 tp60 -49.77 -37.49 30.04 Favored 'General case' 0 N--CA 1.453 -0.308 0 C-N-CA 124.452 1.101 . . . . 0.0 111.861 -178.606 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 23.9 m-80 -73.02 -34.54 66.43 Favored 'General case' 0 N--CA 1.454 -0.232 0 CA-C-O 120.871 0.367 . . . . 0.0 110.23 -179.487 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 10' ' ' PHE . . . . . 0.45 ' CD2' ' HB2' ' A' ' 32' ' ' LEU . 9.1 t80 -70.05 -39.18 75.87 Favored 'General case' 0 N--CA 1.449 -0.498 0 C-N-CA 123.442 0.697 . . . . 0.0 109.454 176.777 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 98.7 t -64.56 -51.44 67.65 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.299 0 N-CA-C 108.757 -0.831 . . . . 0.0 108.757 178.978 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -59.21 -31.41 69.01 Favored 'General case' 0 N--CA 1.455 -0.175 0 CA-C-N 117.639 0.2 . . . . 0.0 111.529 179.737 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 46.8 m -71.17 -41.51 70.25 Favored 'General case' 0 N--CA 1.457 -0.111 0 N-CA-C 109.075 -0.713 . . . . 0.0 109.075 176.56 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -62.47 -41.61 98.9 Favored 'General case' 0 N--CA 1.451 -0.421 0 N-CA-C 109.482 -0.562 . . . . 0.0 109.482 177.929 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 61.4 mm-40 -66.38 -27.81 68.16 Favored 'General case' 0 N--CA 1.453 -0.314 0 C-N-CA 123.491 0.716 . . . . 0.0 110.137 179.312 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 16.0 p -70.9 -30.65 67.05 Favored 'General case' 0 N--CA 1.455 -0.19 0 N-CA-C 110.08 -0.341 . . . . 0.0 110.08 177.068 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 24.4 m-85 -71.45 -32.03 67.86 Favored 'General case' 0 N--CA 1.457 -0.123 0 C-N-CA 120.675 -0.41 . . . . 0.0 110.764 173.672 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 76.4 mttt -67.21 -28.1 67.79 Favored 'General case' 0 C--O 1.232 0.171 0 CA-C-O 121.276 0.56 . . . . 0.0 109.939 172.1 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 41.0 t0 -76.09 -38.97 56.33 Favored 'General case' 0 CA--C 1.531 0.217 0 CA-C-N 115.861 -0.609 . . . . 0.0 110.676 -179.252 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 74.5 mt -74.89 128.74 36.29 Favored 'General case' 0 N--CA 1.454 -0.245 0 N-CA-C 109.187 -0.671 . . . . 0.0 109.187 175.05 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . 0.511 ' HE3' ' HA ' ' A' ' 21' ' ' LYS . 0.4 OUTLIER -73.8 -12.48 60.71 Favored 'General case' 0 CA--C 1.53 0.177 0 O-C-N 121.857 -0.527 . . . . 0.0 110.485 176.946 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 80.7 p -88.04 -23.88 23.64 Favored 'General case' 0 N--CA 1.457 -0.105 0 C-N-CA 123.176 0.59 . . . . 0.0 110.388 174.395 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 70.63 -12.31 2.04 Favored Glycine 0 CA--C 1.531 1.051 0 C-N-CA 124.698 1.142 . . . . 0.0 113.582 177.763 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 74.4 mt -106.22 148.91 10.1 Favored 'Isoleucine or valine' 0 C--N 1.334 -0.092 0 CA-C-N 118.073 0.936 . . . . 0.0 110.858 -179.47 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 31.2 t -166.91 100.48 0.55 Allowed 'General case' 0 CA--C 1.519 -0.24 0 N-CA-C 108.755 -0.831 . . . . 0.0 108.755 174.979 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -50.38 -41.44 40.44 Favored Glycine 0 CA--C 1.523 0.586 0 CA-C-O 119.375 -0.681 . . . . 0.0 111.431 -176.85 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 29.5 t -62.89 -52.17 64.13 Favored 'General case' 0 N--CA 1.454 -0.268 0 CA-C-N 118.484 1.142 . . . . 0.0 110.895 -178.084 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 72.3 mtt180 -70.8 -35.65 72.62 Favored 'General case' 0 CA--C 1.522 -0.122 0 C-N-CA 122.82 0.448 . . . . 0.0 110.499 -176.719 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 61.3 mt -58.09 -46.73 88.13 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.575 0 N-CA-C 108.114 -1.069 . . . . 0.0 108.114 174.719 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 63.9 mttt -65.6 -28.12 68.9 Favored 'General case' 0 C--N 1.341 0.211 0 CA-C-O 118.692 -0.671 . . . . 0.0 111.858 178.433 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.3 -57.33 10.74 Favored 'General case' 0 C--N 1.342 0.264 0 CA-C-N 118.935 0.789 . . . . 0.0 109.783 179.694 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . 0.45 ' HB2' ' CD2' ' A' ' 10' ' ' PHE . 1.6 pp -75.63 -19.09 59.44 Favored 'General case' 0 N--CA 1.453 -0.279 0 C-N-CA 119.427 -0.909 . . . . 0.0 111.911 -177.356 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 52.2 m -72.46 -36.44 68.5 Favored 'General case' 0 N--CA 1.454 -0.24 0 N-CA-C 108.455 -0.942 . . . . 0.0 108.455 176.925 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 96.0 m -72.5 -36.41 68.38 Favored 'General case' 0 N--CA 1.451 -0.387 0 CA-C-N 116.613 -0.267 . . . . 0.0 110.432 -179.942 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 12.2 t80 -61.21 -40.2 93.08 Favored 'General case' 0 N--CA 1.456 -0.16 0 N-CA-C 109.608 -0.516 . . . . 0.0 109.608 174.779 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -70.1 -34.67 73.41 Favored 'General case' 0 N--CA 1.448 -0.555 0 CA-C-N 116.072 -0.513 . . . . 0.0 111.135 -179.475 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 22.1 mt -71.1 -39.97 71.8 Favored 'General case' 0 N--CA 1.453 -0.313 0 C-N-CA 122.315 0.246 . . . . 0.0 111.22 179.776 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 44.4 t0 -64.69 -24.46 67.58 Favored 'General case' 0 N--CA 1.453 -0.285 0 C-N-CA 122.447 0.299 . . . . 0.0 110.784 176.864 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 97.9 m-70 -149.82 102.06 3.11 Favored 'General case' 0 N--CA 1.454 -0.267 0 C-N-CA 122.499 0.319 . . . . 0.0 111.716 -176.082 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 40' ' ' ILE . . . . . 0.493 HD11 ' H ' ' A' ' 40' ' ' ILE . 0.0 OUTLIER -81.0 -15.49 12.58 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.279 0 C-N-CA 123.038 0.535 . . . . 0.0 110.872 177.009 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 2.9 m-20 -58.9 -20.12 48.55 Favored 'General case' 0 N--CA 1.454 -0.263 0 N-CA-C 112.546 0.572 . . . . 0.0 112.546 -177.128 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -104.35 17.65 5.14 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.258 0 C-N-CA 123.277 0.631 . . . . 0.0 111.792 176.497 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 3.0 pp20? -54.57 -27.99 42.72 Favored 'General case' 0 CA--C 1.529 0.16 0 O-C-N 121.75 -0.594 . . . . 0.0 111.281 178.299 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 32.8 t -63.93 -48.32 77.01 Favored 'General case' 0 N--CA 1.454 -0.234 0 N-CA-C 111.788 0.292 . . . . 0.0 111.788 -178.708 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . 0.626 ' HZ3' ' HB2' ' A' ' 7' ' ' PHE . 18.2 ptpt -73.77 -23.18 59.68 Favored 'General case' 0 C--N 1.339 0.152 0 CA-C-N 118.541 0.609 . . . . 0.0 110.121 179.765 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 59.2 mt -72.85 -52.51 22.31 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.343 0 C-N-CA 122.698 0.399 . . . . 0.0 110.603 -178.999 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 39.2 mm -66.52 -36.39 77.19 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.245 0 N-CA-C 109.745 -0.465 . . . . 0.0 109.745 179.546 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 31.9 m -68.66 -40.35 80.21 Favored 'General case' 0 N--CA 1.454 -0.225 0 C-N-CA 121.114 -0.234 . . . . 0.0 111.162 -178.797 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 37.2 tp -75.97 -31.65 59.12 Favored 'General case' 0 N--CA 1.45 -0.463 0 N-CA-C 112.743 0.646 . . . . 0.0 112.743 -175.971 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 3.3 pt -71.49 -43.87 71.69 Favored 'Isoleucine or valine' 0 C--N 1.34 0.163 0 CA-C-N 118.923 0.783 . . . . 0.0 110.596 177.165 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 25.1 pt -66.09 -38.14 81.34 Favored 'Isoleucine or valine' 0 C--N 1.339 0.136 0 C-N-CA 119.469 -0.892 . . . . 0.0 110.598 176.941 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 94.9 m-20 -68.87 -31.35 70.23 Favored 'General case' 0 N--CA 1.454 -0.232 0 CA-C-N 118.248 0.476 . . . . 0.0 111.34 177.471 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 7.8 t80 -60.0 -48.76 80.39 Favored 'General case' 0 N--CA 1.451 -0.376 0 N-CA-C 107.684 -1.228 . . . . 0.0 107.684 173.832 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 46.3 t -67.24 -27.76 67.49 Favored 'General case' 0 C--N 1.34 0.174 0 CA-C-N 117.82 0.282 . . . . 0.0 111.73 -179.404 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 55.2 ttp85 -75.16 -29.67 60.53 Favored 'General case' 0 N--CA 1.453 -0.309 0 N-CA-C 112.161 0.43 . . . . 0.0 112.161 -177.222 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 36.3 mt -99.37 -43.07 6.71 Favored 'General case' 0 N--CA 1.457 -0.101 0 N-CA-C 112.378 0.51 . . . . 0.0 112.378 -179.078 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 57' ' ' CYS . . . . . 0.474 ' HB2' ' HD2' ' A' ' 58' ' ' PRO . 9.0 p -67.75 161.36 67.11 Favored Pre-proline 0 CA--C 1.534 0.351 0 N-CA-C 113.226 0.824 . . . . 0.0 113.226 -173.084 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 58' ' ' PRO . . . . . 0.474 ' HD2' ' HB2' ' A' ' 57' ' ' CYS . 66.6 Cg_endo -78.5 178.47 7.53 Favored 'Trans proline' 0 N--CA 1.453 -0.871 0 C-N-CA 124.859 3.706 . . . . 0.0 111.743 178.119 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -44.49 -55.53 5.01 Favored 'General case' 0 CA--C 1.531 0.229 0 C-N-CA 126.016 1.726 . . . . 0.0 114.557 -171.182 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 47.8 m -68.93 -30.18 68.59 Favored 'General case' 0 N--CA 1.455 -0.213 0 O-C-N 122.126 -0.359 . . . . 0.0 110.827 -173.441 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 67.6 m170 -75.69 -28.5 58.68 Favored 'General case' 0 N--CA 1.451 -0.42 0 CA-C-O 119.554 -0.26 . . . . 0.0 110.412 176.795 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 61.3 mttm -65.57 -34.29 77.91 Favored 'General case' 0 C--N 1.34 0.177 0 N-CA-C 108.975 -0.75 . . . . 0.0 108.975 173.205 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . 0.48 HD13 ' HE3' ' A' ' 123' ' ' LYS . 0.2 OUTLIER -62.97 -47.54 82.73 Favored 'General case' 0 C--N 1.34 0.173 0 N-CA-C 109.088 -0.708 . . . . 0.0 109.088 175.609 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -66.42 -34.43 87.8 Favored Glycine 0 CA--C 1.524 0.6 0 CA-C-O 119.752 -0.471 . . . . 0.0 111.946 -178.287 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 27.3 t -61.3 -45.13 95.75 Favored 'General case' 0 N--CA 1.453 -0.31 0 CA-C-N 117.582 0.691 . . . . 0.0 109.543 177.452 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 80.8 mt -66.96 -27.17 67.24 Favored 'General case' 0 N--CA 1.455 -0.201 0 O-C-N 123.04 0.213 . . . . 0.0 110.517 179.363 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -71.5 -37.58 71.24 Favored 'General case' 0 C--O 1.234 0.249 0 CA-C-O 120.638 0.256 . . . . 0.0 110.964 178.198 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 68' ' ' ILE . . . . . . . . . . . . . 10.1 mt -71.5 -50.08 42.48 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.403 0 N-CA-C 109.286 -0.635 . . . . 0.0 109.286 174.498 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 52.4 mt -48.8 -41.29 12.64 Favored 'Isoleucine or valine' 0 C--O 1.227 -0.113 0 C-N-CA 123.635 0.774 . . . . 0.0 110.78 174.977 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 10.0 t70 -67.07 -44.89 78.95 Favored 'General case' 0 N--CA 1.455 -0.218 0 CA-C-O 120.698 0.285 . . . . 0.0 110.684 179.044 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 19.6 m -69.21 -49.84 52.8 Favored 'General case' 0 N--CA 1.449 -0.483 0 CA-C-N 116.374 -0.375 . . . . 0.0 111.388 -173.762 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -75.53 -31.06 22.78 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.269 0 N-CA-C 109.678 -0.49 . . . . 0.0 109.678 -179.863 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -66.0 -49.61 57.32 Favored Glycine 0 CA--C 1.526 0.737 0 N-CA-C 111.143 -0.783 . . . . 0.0 111.143 -177.14 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 37.9 mtm105 -66.83 -43.86 82.64 Favored 'General case' 0 N--CA 1.453 -0.309 0 N-CA-C 109.585 -0.524 . . . . 0.0 109.585 177.413 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -61.77 -33.35 73.93 Favored 'General case' 0 N--CA 1.45 -0.443 0 CA-C-O 119.513 -0.28 . . . . 0.0 111.112 -176.902 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 1.5 m-30 -70.93 -46.66 62.08 Favored 'General case' 0 N--CA 1.453 -0.302 0 CA-C-N 118.162 0.437 . . . . 0.0 111.114 177.966 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -68.56 -38.49 80.79 Favored 'General case' 0 N--CA 1.45 -0.434 0 C-N-CA 117.584 -1.647 . . . . 0.0 108.057 -178.807 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 78' ' ' ASP . . . . . 0.407 ' HA ' ' HE ' ' A' ' 81' ' ' ARG . 93.8 m-20 -59.71 -48.31 82.17 Favored 'General case' 0 C--N 1.34 0.159 0 N-CA-C 112.147 0.425 . . . . 0.0 112.147 178.161 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 13.0 tm-20 -65.06 -46.74 79.95 Favored 'General case' 0 N--CA 1.446 -0.649 0 CA-C-N 117.91 0.323 . . . . 0.0 111.043 -177.425 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 70.5 p -68.65 -33.17 73.54 Favored 'General case' 0 N--CA 1.454 -0.241 0 CA-C-O 119.167 -0.444 . . . . 0.0 111.933 -178.257 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 81' ' ' ARG . . . . . 0.407 ' HE ' ' HA ' ' A' ' 78' ' ' ASP . 21.7 ptt180 -78.93 -23.91 44.38 Favored 'General case' 0 C--N 1.34 0.155 0 CA-C-N 118.771 0.714 . . . . 0.0 111.899 176.88 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 31.2 t . . . . . 0 N--CA 1.454 -0.234 0 C-N-CA 123.061 0.545 . . . . 0.0 112.209 179.191 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 63.7 Cg_endo . . . . . 0 N--CA 1.451 -0.996 0 N-CA-C 107.51 -1.765 . . . . 0.0 107.51 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 114.64 16.82 7.31 Favored Glycine 0 CA--C 1.525 0.696 0 CA-C-O 119.468 -0.629 . . . . 0.0 112.457 -172.978 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 26.9 p -151.59 170.58 19.33 Favored 'General case' 0 N--CA 1.456 -0.17 0 C-N-CA 123.825 0.85 . . . . 0.0 110.34 177.35 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 94' ' ' CYS . . . . . 0.422 ' HB2' HD11 ' A' ' 98' ' ' ILE . 23.0 p -58.93 -23.86 61.83 Favored 'General case' 0 N--CA 1.451 -0.407 0 CA-C-N 115.891 -0.595 . . . . 0.0 109.469 175.582 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -60.13 -57.68 11.77 Favored 'General case' 0 N--CA 1.447 -0.606 0 N-CA-C 109.293 -0.632 . . . . 0.0 109.293 -177.178 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 52.4 t60 -75.55 -27.02 58.49 Favored 'General case' 0 N--CA 1.451 -0.419 0 C-N-CA 121.069 -0.252 . . . . 0.0 111.565 -179.893 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -69.51 -48.3 61.0 Favored 'General case' 0 N--CA 1.453 -0.307 0 CA-C-N 117.801 0.273 . . . . 0.0 110.693 -178.652 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 98' ' ' ILE . . . . . 0.422 HD11 ' HB2' ' A' ' 94' ' ' CYS . 2.0 mp -70.57 -30.94 44.62 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.226 0 N-CA-C 109.882 -0.414 . . . . 0.0 109.882 177.815 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 4.6 m120 -63.63 -49.79 71.91 Favored 'General case' 0 N--CA 1.454 -0.266 0 CA-C-N 118.337 0.517 . . . . 0.0 110.89 175.216 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 49.7 m -70.42 -24.47 62.92 Favored 'General case' 0 N--CA 1.457 -0.11 0 O-C-N 123.131 0.269 . . . . 0.0 111.085 -175.289 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 57.2 tp -83.28 -50.24 8.6 Favored 'General case' 0 N--CA 1.45 -0.467 0 C-N-CA 122.436 0.294 . . . . 0.0 110.696 179.685 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -69.53 -18.02 73.28 Favored Glycine 0 C--N 1.338 0.658 0 CA-C-O 119.507 -0.607 . . . . 0.0 112.786 -174.237 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 26.6 pt-20 -81.8 -7.44 59.6 Favored 'General case' 0 CA--C 1.533 0.29 0 CA-C-N 118.264 1.032 . . . . 0.0 112.373 -178.832 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 17.5 m -140.61 0.02 0.51 Allowed 'Isoleucine or valine' 0 N--CA 1.463 0.213 0 N-CA-C 113.315 0.858 . . . . 0.0 113.315 176.9 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 105' ' ' ILE . . . . . . . . . . . . . 9.3 tp -60.3 -28.22 41.39 Favored 'Isoleucine or valine' 0 CA--C 1.527 0.074 0 CA-C-N 119.197 0.908 . . . . 0.0 111.953 -174.521 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 10.6 pt20 -67.15 -26.89 66.89 Favored 'General case' 0 N--CA 1.453 -0.291 0 CA-C-N 118.002 0.365 . . . . 0.0 110.319 179.261 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 59.8 mm-40 -75.51 -42.02 53.76 Favored 'General case' 0 N--CA 1.456 -0.168 0 N-CA-C 110.117 -0.327 . . . . 0.0 110.117 179.897 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -72.53 -35.26 68.03 Favored 'General case' 0 N--CA 1.454 -0.265 0 N-CA-C 109.637 -0.505 . . . . 0.0 109.637 179.708 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 68.2 mt -67.01 -53.26 32.97 Favored 'General case' 0 N--CA 1.454 -0.273 0 N-CA-C 109.974 -0.38 . . . . 0.0 109.974 176.137 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 35.9 t -53.32 -42.64 66.9 Favored 'General case' 0 C--O 1.232 0.138 0 C-N-CA 122.533 0.333 . . . . 0.0 111.86 -177.247 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 47.4 t0 -66.0 -43.11 88.68 Favored 'General case' 0 N--CA 1.451 -0.378 0 N-CA-C 109.439 -0.578 . . . . 0.0 109.439 177.113 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -67.27 -35.52 79.66 Favored 'General case' 0 N--CA 1.449 -0.504 0 CA-C-O 119.557 -0.258 . . . . 0.0 111.164 -176.387 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 113' ' ' ILE . . . . . . . . . . . . . 22.0 mm -68.55 -37.29 77.49 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.326 0 CA-C-N 118.682 0.673 . . . . 0.0 109.242 178.455 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -73.64 -38.58 64.95 Favored 'General case' 0 N--CA 1.45 -0.443 0 N-CA-C 112.094 0.405 . . . . 0.0 112.094 178.553 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 115' ' ' LYS . . . . . 0.422 ' HB2' ' HZ3' ' A' ' 115' ' ' LYS . 0.0 OUTLIER -81.23 -38.68 26.55 Favored 'General case' 0 C--N 1.339 0.115 0 N-CA-C 113.075 0.769 . . . . 0.0 113.075 -175.754 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 116' ' ' SER . . . . . 0.491 ' HB2' ' CB ' ' A' ' 120' ' ' HIS . 52.5 p -81.49 158.41 24.52 Favored 'General case' 0 N--CA 1.454 -0.27 0 N-CA-C 113.314 0.857 . . . . 0.0 113.314 -169.473 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 38.9 t30 -78.92 167.92 20.44 Favored 'General case' 0 CA--C 1.531 0.224 0 C-N-CA 123.241 0.617 . . . . 0.0 110.481 -178.851 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 118' ' ' GLN . . . . . . . . . . . . . 27.8 mt-30 -56.33 -36.08 68.33 Favored 'General case' 0 CA--C 1.529 0.171 0 N-CA-C 113.054 0.761 . . . . 0.0 113.054 -171.608 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 13.3 p-10 -69.35 -37.65 77.75 Favored 'General case' 0 N--CA 1.456 -0.133 0 CA-C-O 121.176 0.512 . . . . 0.0 109.849 178.528 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 120' ' ' HIS . . . . . 0.491 ' CB ' ' HB2' ' A' ' 116' ' ' SER . 32.7 m170 -67.22 -41.14 86.22 Favored 'General case' 0 N--CA 1.45 -0.454 0 CA-C-N 115.843 -0.617 . . . . 0.0 110.112 176.63 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 50.4 mttm -58.46 -40.33 82.36 Favored 'General case' 0 C--N 1.342 0.263 0 N-CA-C 109.001 -0.741 . . . . 0.0 109.001 178.226 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 45.9 tp10 -69.91 -38.21 76.19 Favored 'General case' 0 N--CA 1.453 -0.292 0 C-N-CA 122.166 0.186 . . . . 0.0 111.202 -176.8 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 123' ' ' LYS . . . . . 0.48 ' HE3' HD13 ' A' ' 63' ' ' LEU . 50.3 mtmt -69.0 -28.21 66.39 Favored 'General case' 0 N--CA 1.453 -0.301 0 O-C-N 121.803 -0.561 . . . . 0.0 110.182 177.801 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 124' ' ' ILE . . . . . . . . . . . . . 61.5 mt -73.39 -37.68 51.65 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.297 0 N-CA-C 109.041 -0.725 . . . . 0.0 109.041 174.318 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 125' ' ' ARG . . . . . 0.429 ' HA ' HH11 ' A' ' 125' ' ' ARG . 5.7 mmm180 -60.53 -46.57 89.65 Favored 'General case' 0 N--CA 1.452 -0.331 0 CA-C-O 118.95 -0.547 . . . . 0.0 110.866 178.174 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 126' ' ' MET . . . . . . . . . . . . . 28.3 ptm -62.83 -35.75 80.95 Favored 'General case' 0 N--CA 1.452 -0.339 0 C-N-CA 118.593 -1.243 . . . . 0.0 108.736 178.12 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 2.8 mp -61.48 -35.64 78.22 Favored 'General case' 0 CA--C 1.534 0.335 0 CA-C-N 118.927 0.785 . . . . 0.0 112.033 178.59 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -70.9 -41.76 70.83 Favored 'General case' 0 CA--C 1.527 0.092 0 CA-C-N 118.858 0.754 . . . . 0.0 109.718 178.46 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 19.4 m-20 -68.05 -30.64 69.9 Favored 'General case' 0 N--CA 1.453 -0.286 0 N-CA-C 109.704 -0.48 . . . . 0.0 109.704 179.119 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 42.2 mt -64.24 -39.79 86.76 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.302 0 C-N-CA 122.745 0.418 . . . . 0.0 109.893 174.942 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 131' ' ' TRP . . . . . . . . . . . . . 47.4 m0 . . . . . 0 N--CA 1.45 -0.455 0 C-N-CA 119.783 -0.767 . . . . 0.0 111.744 177.669 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 41.8 t0 . . . . . 0 N--CA 1.45 -0.468 0 N-CA-C 107.873 -1.158 . . . . 0.0 107.873 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 7' ' ' PHE . . . . . 0.544 ' CD1' ' HD3' ' A' ' 45' ' ' LYS . 1.5 t80 -55.35 -35.3 65.08 Favored 'General case' 0 N--CA 1.451 -0.404 0 N-CA-C 108.525 -0.917 . . . . 0.0 108.525 175.996 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 51.8 tp60 -51.7 -34.0 36.79 Favored 'General case' 0 N--CA 1.452 -0.326 0 C-N-CA 124.937 1.295 . . . . 0.0 111.969 -178.778 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 79.9 m-20 -74.6 -36.14 62.98 Favored 'General case' 0 N--CA 1.453 -0.282 0 N-CA-C 109.906 -0.405 . . . . 0.0 109.906 -179.932 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 10' ' ' PHE . . . . . 0.477 ' CZ ' HG12 ' A' ' 46' ' ' ILE . 2.0 t80 -68.32 -36.43 79.28 Favored 'General case' 0 N--CA 1.449 -0.503 0 C-N-CA 123.086 0.554 . . . . 0.0 109.638 174.673 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 96.0 t -69.1 -52.79 30.24 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.234 0 N-CA-C 109.606 -0.516 . . . . 0.0 109.606 178.385 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -58.9 -28.47 66.21 Favored 'General case' 0 N--CA 1.454 -0.232 0 CA-C-N 117.747 0.248 . . . . 0.0 111.478 -179.154 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 86.7 m -72.64 -39.01 67.51 Favored 'General case' 0 N--CA 1.454 -0.242 0 N-CA-C 109.099 -0.704 . . . . 0.0 109.099 175.602 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -64.39 -43.26 95.02 Favored 'General case' 0 N--CA 1.451 -0.422 0 N-CA-C 109.018 -0.734 . . . . 0.0 109.018 177.773 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 67.6 mm-40 -65.42 -26.49 68.0 Favored 'General case' 0 N--CA 1.455 -0.22 0 C-N-CA 123.85 0.86 . . . . 0.0 110.011 178.425 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 68.1 m -70.53 -30.17 66.84 Favored 'General case' 0 N--CA 1.455 -0.183 0 N-CA-C 110.015 -0.365 . . . . 0.0 110.015 176.901 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 17' ' ' PHE . . . . . 0.419 ' CD1' HD12 ' A' ' 68' ' ' ILE . 35.9 m-85 -71.98 -32.8 67.6 Favored 'General case' 0 C--N 1.338 0.088 0 C-N-CA 119.943 -0.703 . . . . 0.0 110.76 172.41 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 72.9 mttt -66.76 -25.36 66.46 Favored 'General case' 0 CA--C 1.531 0.235 0 N-CA-C 110.037 -0.357 . . . . 0.0 110.037 174.541 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 42.6 t0 -76.56 -48.74 18.32 Favored 'General case' 0 CA--C 1.529 0.15 0 N-CA-C 110.306 -0.257 . . . . 0.0 110.306 175.439 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 16.2 mt -56.23 125.26 21.01 Favored 'General case' 0 N--CA 1.457 -0.098 0 CA-C-O 120.714 0.293 . . . . 0.0 110.467 -177.64 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . 0.474 ' H ' ' HE2' ' A' ' 21' ' ' LYS . 1.0 OUTLIER -70.74 -22.57 62.4 Favored 'General case' 0 N--CA 1.456 -0.138 0 N-CA-C 109.819 -0.437 . . . . 0.0 109.819 -179.84 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 22' ' ' SER . . . . . 0.415 ' C ' ' H ' ' A' ' 24' ' ' ILE . 61.8 m -90.69 -13.34 34.37 Favored 'General case' 0 N--CA 1.457 -0.09 0 C-N-CA 122.901 0.48 . . . . 0.0 111.059 176.299 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 70.55 -16.83 0.92 Allowed Glycine 0 CA--C 1.529 0.923 0 C-N-CA 124.135 0.874 . . . . 0.0 112.983 -179.677 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . 0.415 ' H ' ' C ' ' A' ' 22' ' ' SER . 93.6 mt -100.41 147.67 7.53 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.135 0 CA-C-N 117.773 0.786 . . . . 0.0 111.121 -179.961 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 24.3 t -161.12 104.68 1.31 Allowed 'General case' 0 CA--C 1.517 -0.294 0 N-CA-C 108.273 -1.01 . . . . 0.0 108.273 170.808 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -59.93 -28.47 66.12 Favored Glycine 0 CA--C 1.525 0.657 0 C-N-CA 119.914 -1.136 . . . . 0.0 110.829 -176.697 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 86.3 p -72.75 -49.34 31.53 Favored 'General case' 0 N--CA 1.453 -0.303 0 CA-C-N 117.854 0.827 . . . . 0.0 110.683 -179.634 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 40.5 mtt-85 -72.55 -37.35 68.27 Favored 'General case' 0 N--CA 1.453 -0.311 0 CA-C-N 117.577 0.171 . . . . 0.0 110.632 -178.534 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 63.0 mt -60.03 -46.24 94.47 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.668 0 N-CA-C 108.704 -0.85 . . . . 0.0 108.704 175.838 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 28.8 mtmm -64.89 -29.03 69.96 Favored 'General case' 0 C--N 1.338 0.091 0 CA-C-O 119.168 -0.444 . . . . 0.0 111.284 178.747 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . 0.466 ' CE ' ' HA ' ' A' ' 31' ' ' LYS . 3.5 mmpt? -66.2 -59.21 3.97 Favored 'General case' 0 N--CA 1.456 -0.155 0 CA-C-N 118.739 0.699 . . . . 0.0 111.454 -179.15 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . 0.429 HD22 ' CE1' ' A' ' 10' ' ' PHE . 0.8 OUTLIER -75.33 -16.76 60.38 Favored 'General case' 0 CA--C 1.531 0.212 0 C-N-CA 118.747 -1.181 . . . . 0.0 111.568 -179.249 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 40.5 m -71.04 -44.37 65.96 Favored 'General case' 0 N--CA 1.455 -0.194 0 N-CA-C 108.19 -1.041 . . . . 0.0 108.19 174.41 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 95.3 m -65.29 -42.74 92.79 Favored 'General case' 0 N--CA 1.453 -0.316 0 N-CA-C 109.601 -0.518 . . . . 0.0 109.601 -179.731 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 38.4 t80 -61.44 -34.31 75.2 Favored 'General case' 0 N--CA 1.453 -0.323 0 CA-C-O 120.731 0.3 . . . . 0.0 110.268 179.18 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -75.3 -25.51 57.96 Favored 'General case' 0 N--CA 1.45 -0.445 0 CA-C-O 119.378 -0.344 . . . . 0.0 111.767 177.977 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 2.2 mm? -82.93 -33.46 26.8 Favored 'General case' 0 N--CA 1.456 -0.149 0 N-CA-C 108.595 -0.891 . . . . 0.0 108.595 -178.127 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 82.7 m-20 -64.52 -28.42 69.64 Favored 'General case' 0 N--CA 1.444 -0.77 0 C-N-CA 123.595 0.758 . . . . 0.0 110.532 174.677 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 73.3 m80 -151.39 106.99 3.36 Favored 'General case' 0 N--CA 1.453 -0.286 0 C-N-CA 122.826 0.45 . . . . 0.0 111.902 -179.841 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 40' ' ' ILE . . . . . 0.563 ' H ' HD12 ' A' ' 40' ' ' ILE . 0.0 OUTLIER -78.61 -10.8 13.0 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.284 0 N-CA-C 109.593 -0.521 . . . . 0.0 109.593 172.699 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -54.85 -28.28 48.72 Favored 'General case' 0 N--CA 1.453 -0.301 0 C-N-CA 123.798 0.839 . . . . 0.0 111.75 -177.006 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -104.88 16.39 6.1 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.318 0 C-N-CA 123.47 0.708 . . . . 0.0 112.375 -179.94 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 3.1 pp20? -53.89 -31.44 49.93 Favored 'General case' 0 C--O 1.225 -0.235 0 O-C-N 121.51 -0.744 . . . . 0.0 110.375 179.66 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 37.6 t -59.42 -48.04 83.18 Favored 'General case' 0 CA--C 1.532 0.287 0 CA-C-O 119.703 -0.189 . . . . 0.0 111.32 -176.913 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . 0.544 ' HD3' ' CD1' ' A' ' 7' ' ' PHE . 18.7 ptpt -75.4 -25.48 57.62 Favored 'General case' 0 CA--C 1.531 0.23 0 CA-C-N 118.267 0.485 . . . . 0.0 110.49 179.541 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 46' ' ' ILE . . . . . 0.477 HG12 ' CZ ' ' A' ' 10' ' ' PHE . 94.5 mt -71.96 -46.45 59.88 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.254 0 N-CA-C 109.667 -0.494 . . . . 0.0 109.667 -179.339 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 39.6 mm -65.22 -34.0 67.52 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.531 0 N-CA-C 108.965 -0.754 . . . . 0.0 108.965 177.311 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 53.8 m -64.75 -35.1 79.96 Favored 'General case' 0 N--CA 1.453 -0.299 0 CA-C-O 119.649 -0.215 . . . . 0.0 111.117 178.068 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 16.1 mt -73.62 -40.58 63.7 Favored 'General case' 0 N--CA 1.452 -0.328 0 CA-C-O 118.753 -0.642 . . . . 0.0 112.528 179.516 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 9.0 pt -68.44 -40.25 81.94 Favored 'Isoleucine or valine' 0 C--N 1.339 0.124 0 CA-C-N 119.474 1.034 . . . . 0.0 111.051 -177.962 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 16.6 pt -68.99 -39.23 79.48 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.185 0 C-N-CA 120.136 -0.626 . . . . 0.0 110.709 179.333 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 50.7 t0 -64.81 -51.66 60.93 Favored 'General case' 0 N--CA 1.455 -0.194 0 N-CA-C 109.648 -0.501 . . . . 0.0 109.648 177.924 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 25.9 t80 -59.57 -53.29 59.81 Favored 'General case' 0 N--CA 1.45 -0.46 0 N-CA-C 109.543 -0.54 . . . . 0.0 109.543 -179.298 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 18.7 t -61.48 -29.53 70.03 Favored 'General case' 0 N--CA 1.452 -0.337 0 N-CA-C 111.974 0.361 . . . . 0.0 111.974 -174.344 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 5.1 tpm_? -75.5 -60.43 2.31 Favored 'General case' 0 CA--C 1.532 0.283 0 C-N-CA 122.5 0.32 . . . . 0.0 111.326 -179.5 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 9.1 mp -75.66 -28.66 58.82 Favored 'General case' 0 C--O 1.231 0.093 0 N-CA-C 114.14 1.163 . . . . 0.0 114.14 -174.966 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 57' ' ' CYS . . . . . 0.428 ' O ' ' HE2' ' A' ' 62' ' ' LYS . 13.2 p -68.28 156.74 89.47 Favored Pre-proline 0 CA--C 1.536 0.428 0 N-CA-C 112.471 0.545 . . . . 0.0 112.471 -174.713 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 58' ' ' PRO . . . . . 0.419 ' HD2' ' HB2' ' A' ' 57' ' ' CYS . 94.0 Cg_endo -74.05 175.97 10.15 Favored 'Trans proline' 0 N--CA 1.454 -0.832 0 C-N-CA 125.046 3.83 . . . . 0.0 111.593 179.203 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 32.4 p-10 -52.66 -47.2 67.29 Favored 'General case' 0 CA--C 1.529 0.145 0 C-N-CA 124.533 1.133 . . . . 0.0 113.737 -170.847 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 40.2 t -65.23 -37.63 87.87 Favored 'General case' 0 N--CA 1.456 -0.145 0 CA-C-O 121.121 0.486 . . . . 0.0 110.462 -178.758 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 66.1 m170 -75.3 -26.36 58.64 Favored 'General case' 0 N--CA 1.452 -0.375 0 CA-C-N 116.521 -0.309 . . . . 0.0 110.232 179.836 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . 0.428 ' HE2' ' O ' ' A' ' 57' ' ' CYS . 68.7 mttm -65.93 -39.43 90.5 Favored 'General case' 0 C--N 1.342 0.249 0 N-CA-C 109.29 -0.633 . . . . 0.0 109.29 174.334 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -61.15 -48.38 81.86 Favored 'General case' 0 N--CA 1.454 -0.233 0 N-CA-C 108.313 -0.995 . . . . 0.0 108.313 176.541 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -63.99 -31.89 82.36 Favored Glycine 0 CA--C 1.524 0.642 0 N-CA-C 111.668 -0.573 . . . . 0.0 111.668 -179.21 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 37.4 p -65.85 -38.53 89.1 Favored 'General case' 0 N--CA 1.454 -0.271 0 CA-C-N 117.699 0.749 . . . . 0.0 109.887 179.011 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 82.3 mt -72.61 -25.54 61.35 Favored 'General case' 0 N--CA 1.451 -0.396 0 N-CA-C 110.026 -0.361 . . . . 0.0 110.026 178.914 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -72.45 -38.59 68.24 Favored 'General case' 0 N--CA 1.454 -0.268 0 N-CA-C 110.374 -0.232 . . . . 0.0 110.374 176.335 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 68' ' ' ILE . . . . . 0.419 HD12 ' CD1' ' A' ' 17' ' ' PHE . 18.2 mt -69.19 -46.82 77.06 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.237 0 N-CA-C 109.673 -0.491 . . . . 0.0 109.673 176.0 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 70.7 mt -56.55 -32.46 36.91 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.161 0 C-N-CA 123.031 0.532 . . . . 0.0 110.814 176.252 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 6.9 t70 -69.76 -50.08 46.83 Favored 'General case' 0 N--CA 1.452 -0.354 0 CA-C-O 119.383 -0.341 . . . . 0.0 111.132 179.38 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 99.2 p -67.5 -49.89 61.41 Favored 'General case' 0 N--CA 1.455 -0.219 0 C-N-CA 120.505 -0.478 . . . . 0.0 110.663 -175.757 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -74.89 -32.44 27.72 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.182 0 N-CA-C 109.931 -0.396 . . . . 0.0 109.931 -176.508 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -69.75 -58.53 6.27 Favored Glycine 0 C--N 1.336 0.566 0 N-CA-C 111.116 -0.794 . . . . 0.0 111.116 -176.975 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 28.7 mtp-105 -61.51 -40.95 96.46 Favored 'General case' 0 N--CA 1.45 -0.426 0 N-CA-C 109.808 -0.441 . . . . 0.0 109.808 -177.799 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -67.81 -28.23 67.41 Favored 'General case' 0 N--CA 1.451 -0.411 0 C-N-CA 120.771 -0.372 . . . . 0.0 111.331 179.993 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 1.3 m-30 -69.63 -46.23 66.68 Favored 'General case' 0 N--CA 1.455 -0.221 0 CA-C-N 118.648 0.658 . . . . 0.0 111.192 178.529 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 44.2 tp -73.51 -35.83 65.65 Favored 'General case' 0 N--CA 1.449 -0.477 0 C-N-CA 117.471 -1.691 . . . . 0.0 110.219 -179.995 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 89.0 m-20 -62.52 -46.22 89.39 Favored 'General case' 0 C--O 1.231 0.122 0 N-CA-C 112.393 0.516 . . . . 0.0 112.393 178.641 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 15.1 tm-20 -65.35 -47.75 75.39 Favored 'General case' 0 N--CA 1.444 -0.759 0 CA-C-N 118.017 0.371 . . . . 0.0 110.873 -179.026 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 76.7 p -68.23 -25.04 65.0 Favored 'General case' 0 N--CA 1.452 -0.328 0 CA-C-O 119.674 -0.203 . . . . 0.0 111.49 -179.172 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 35.4 ttp-105 -75.51 -34.05 60.79 Favored 'General case' 0 N--CA 1.457 -0.093 0 C-N-CA 122.711 0.404 . . . . 0.0 111.234 172.915 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 34.6 t . . . . . 0 N--CA 1.456 -0.157 0 C-N-CA 123.839 0.856 . . . . 0.0 113.249 -177.876 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 71.6 Cg_endo . . . . . 0 N--CA 1.455 -0.787 0 N-CA-C 110.246 -0.713 . . . . 0.0 110.246 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 84.9 19.13 60.02 Favored Glycine 0 CA--C 1.523 0.567 0 CA-C-O 119.483 -0.62 . . . . 0.0 112.344 179.303 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 25.1 p -153.76 172.82 16.71 Favored 'General case' 0 N--CA 1.455 -0.195 0 C-N-CA 123.533 0.733 . . . . 0.0 110.716 178.702 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 94' ' ' CYS . . . . . . . . . . . . . 30.6 p -59.93 -21.73 61.51 Favored 'General case' 0 N--CA 1.449 -0.522 0 CA-C-N 115.467 -0.788 . . . . 0.0 110.234 175.064 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -60.22 -56.8 17.14 Favored 'General case' 0 N--CA 1.447 -0.578 0 N-CA-C 109.722 -0.473 . . . . 0.0 109.722 -176.088 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 73.7 t60 -75.17 -37.12 61.4 Favored 'General case' 0 N--CA 1.45 -0.435 0 O-C-N 122.924 0.14 . . . . 0.0 111.014 179.191 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -62.58 -50.83 69.75 Favored 'General case' 0 N--CA 1.451 -0.379 0 N-CA-C 111.821 0.304 . . . . 0.0 111.821 -177.585 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 1.8 mp -73.03 -33.14 41.98 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.165 0 CA-C-N 118.233 0.469 . . . . 0.0 110.068 -179.164 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 2.1 m120 -65.0 -40.65 95.26 Favored 'General case' 0 N--CA 1.452 -0.326 0 CA-C-N 118.547 0.612 . . . . 0.0 111.465 177.129 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 96.7 m -67.2 -42.7 83.71 Favored 'General case' 0 N--CA 1.452 -0.339 0 CA-C-O 120.514 0.197 . . . . 0.0 110.532 -178.011 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 75.7 mt -74.3 -28.49 61.2 Favored 'General case' 0 N--CA 1.45 -0.439 0 C-N-CA 120.805 -0.358 . . . . 0.0 110.871 179.997 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -59.19 -25.11 59.6 Favored Glycine 0 CA--C 1.527 0.803 0 N-CA-C 111.683 -0.567 . . . . 0.0 111.683 -177.868 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 17.4 mm-40 -84.49 -41.74 16.27 Favored 'General case' 0 N--CA 1.454 -0.272 0 CA-C-N 117.965 0.882 . . . . 0.0 112.309 179.588 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 16.5 m -104.5 -4.17 9.63 Favored 'Isoleucine or valine' 0 N--CA 1.461 0.095 0 N-CA-C 114.164 1.172 . . . . 0.0 114.164 -171.501 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 105' ' ' ILE . . . . . . . . . . . . . 11.1 tp -63.69 -33.42 61.63 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.244 0 CA-C-N 119.463 1.029 . . . . 0.0 110.913 -177.421 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 23.8 pt20 -67.15 -30.22 70.15 Favored 'General case' 0 CA--C 1.531 0.237 0 C-N-CA 122.948 0.499 . . . . 0.0 110.03 178.523 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 5.8 mm-40 -74.12 -46.67 41.22 Favored 'General case' 0 N--CA 1.454 -0.245 0 C-N-CA 123.135 0.574 . . . . 0.0 110.425 177.708 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 81.6 mt -68.66 -33.58 74.24 Favored 'General case' 0 N--CA 1.455 -0.217 0 N-CA-C 110.045 -0.354 . . . . 0.0 110.045 -178.77 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 36.4 mt -65.25 -62.13 1.72 Allowed 'General case' 0 N--CA 1.449 -0.49 0 N-CA-C 109.332 -0.618 . . . . 0.0 109.332 175.171 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 25.7 t -58.13 -35.55 71.65 Favored 'General case' 0 C--N 1.338 0.107 0 N-CA-C 112.005 0.372 . . . . 0.0 112.005 -173.463 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 62.1 t0 -61.85 -44.02 97.66 Favored 'General case' 0 N--CA 1.45 -0.47 0 N-CA-C 108.979 -0.748 . . . . 0.0 108.979 176.643 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -71.47 -37.67 71.3 Favored 'General case' 0 N--CA 1.446 -0.646 0 CA-C-N 116.434 -0.348 . . . . 0.0 110.802 -178.861 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 113' ' ' ILE . . . . . 0.481 ' O ' ' HE3' ' A' ' 121' ' ' LYS . 32.9 mm -61.25 -43.59 96.78 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.259 0 N-CA-C 109.356 -0.609 . . . . 0.0 109.356 -179.403 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -74.56 -38.83 62.6 Favored 'General case' 0 N--CA 1.451 -0.422 0 N-CA-C 112.039 0.385 . . . . 0.0 112.039 -176.701 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 115' ' ' LYS . . . . . 0.608 ' HB2' ' HZ2' ' A' ' 115' ' ' LYS . 0.0 OUTLIER -77.42 -34.44 54.7 Favored 'General case' 0 C--N 1.338 0.099 0 N-CA-C 112.106 0.41 . . . . 0.0 112.106 -177.585 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 116' ' ' SER . . . . . 0.501 ' HB2' ' CB ' ' A' ' 120' ' ' HIS . 29.3 p -87.72 157.55 19.03 Favored 'General case' 0 N--CA 1.454 -0.257 0 N-CA-C 113.084 0.772 . . . . 0.0 113.084 -169.43 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 53.2 t30 -75.48 167.8 21.22 Favored 'General case' 0 C--O 1.224 -0.268 0 C-N-CA 123.874 0.869 . . . . 0.0 111.052 -178.293 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 118' ' ' GLN . . . . . . . . . . . . . 19.6 mm100 -57.6 -32.51 67.26 Favored 'General case' 0 CA--C 1.527 0.085 0 C-N-CA 123.17 0.588 . . . . 0.0 111.405 -176.062 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 36.6 t0 -65.51 -45.37 83.81 Favored 'General case' 0 N--CA 1.454 -0.24 0 CA-C-O 121.701 0.762 . . . . 0.0 108.967 175.639 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 120' ' ' HIS . . . . . 0.501 ' CB ' ' HB2' ' A' ' 116' ' ' SER . 33.5 m170 -68.14 -37.31 80.92 Favored 'General case' 0 N--CA 1.449 -0.477 0 N-CA-C 109.731 -0.47 . . . . 0.0 109.731 179.852 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 121' ' ' LYS . . . . . 0.481 ' HE3' ' O ' ' A' ' 113' ' ' ILE . 61.6 mttp -60.21 -36.96 78.86 Favored 'General case' 0 CA--C 1.521 -0.17 0 N-CA-C 108.675 -0.861 . . . . 0.0 108.675 176.394 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 28.1 tt0 -65.43 -44.41 87.43 Favored 'General case' 0 N--CA 1.452 -0.359 0 C-N-CA 122.379 0.272 . . . . 0.0 110.791 -178.03 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 14.4 mptt -67.34 -36.4 81.33 Favored 'General case' 0 C--O 1.226 -0.149 0 C-N-CA 120.63 -0.428 . . . . 0.0 110.115 -179.209 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 124' ' ' ILE . . . . . . . . . . . . . 54.4 mt -68.67 -32.88 56.86 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.329 0 N-CA-C 109.07 -0.715 . . . . 0.0 109.07 176.474 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 125' ' ' ARG . . . . . 0.457 ' HA ' ' HD2' ' A' ' 125' ' ' ARG . 17.4 tpt85 -69.64 -35.49 75.26 Favored 'General case' 0 N--CA 1.447 -0.599 0 CA-C-O 119.214 -0.422 . . . . 0.0 111.889 -174.806 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 126' ' ' MET . . . . . . . . . . . . . 26.8 ptm -73.88 -38.69 64.32 Favored 'General case' 0 N--CA 1.453 -0.284 0 N-CA-C 109.19 -0.67 . . . . 0.0 109.19 175.656 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 6.4 mp -61.26 -36.33 79.7 Favored 'General case' 0 CA--C 1.53 0.175 0 N-CA-C 109.434 -0.58 . . . . 0.0 109.434 174.811 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 43.6 tp -65.73 -44.33 86.33 Favored 'General case' 0 N--CA 1.454 -0.273 0 O-C-N 122.108 -0.37 . . . . 0.0 110.941 -179.128 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 89.2 m-20 -68.0 -36.4 79.93 Favored 'General case' 0 N--CA 1.456 -0.158 0 N-CA-C 110.366 -0.235 . . . . 0.0 110.366 176.245 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 54.4 mt -63.13 -38.4 81.96 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.436 0 N-CA-C 109.316 -0.624 . . . . 0.0 109.316 177.733 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 131' ' ' TRP . . . . . . . . . . . . . 41.0 m0 . . . . . 0 N--CA 1.454 -0.269 0 CA-C-O 119.481 -0.295 . . . . 0.0 111.481 179.403 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 24.9 p-10 . . . . . 0 N--CA 1.455 -0.21 0 N-CA-C 109.429 -0.582 . . . . 0.0 109.429 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 7' ' ' PHE . . . . . 0.533 ' HB2' ' HZ2' ' A' ' 45' ' ' LYS . 1.5 t80 -58.07 -36.48 72.88 Favored 'General case' 0 N--CA 1.446 -0.672 0 C-N-CA 123.173 0.589 . . . . 0.0 111.403 -176.972 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 51.7 tp60 -57.92 -32.17 67.5 Favored 'General case' 0 N--CA 1.453 -0.312 0 C-N-CA 122.689 0.395 . . . . 0.0 111.473 -176.959 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 49.6 t30 -69.44 -33.97 73.74 Favored 'General case' 0 N--CA 1.454 -0.264 0 N-CA-C 109.663 -0.495 . . . . 0.0 109.663 177.826 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 10' ' ' PHE . . . . . 0.502 ' CE2' ' HB2' ' A' ' 32' ' ' LEU . 12.0 t80 -70.33 -40.89 73.87 Favored 'General case' 0 N--CA 1.45 -0.446 0 N-CA-C 109.479 -0.563 . . . . 0.0 109.479 177.427 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 91.3 t -63.0 -55.63 22.4 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.372 0 N-CA-C 108.394 -0.965 . . . . 0.0 108.394 179.544 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -57.79 -29.44 64.87 Favored 'General case' 0 N--CA 1.451 -0.384 0 C-N-CA 122.847 0.459 . . . . 0.0 112.072 179.737 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 95.2 m -72.33 -41.05 66.95 Favored 'General case' 0 CA--C 1.529 0.162 0 CA-C-N 118.864 0.756 . . . . 0.0 109.297 177.208 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . 0.515 ' HA ' ' CD1' ' A' ' 17' ' ' PHE . 10.8 tp -65.84 -42.65 90.22 Favored 'General case' 0 N--CA 1.454 -0.244 0 CA-C-O 121.053 0.454 . . . . 0.0 109.847 178.743 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 77.3 mm-40 -63.65 -32.8 74.39 Favored 'General case' 0 N--CA 1.452 -0.364 0 C-N-CA 123.947 0.899 . . . . 0.0 109.488 177.02 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 70.7 m -69.36 -22.43 63.74 Favored 'General case' 0 N--CA 1.451 -0.421 0 CA-C-O 119.011 -0.518 . . . . 0.0 110.422 177.149 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 17' ' ' PHE . . . . . 0.515 ' CD1' ' HA ' ' A' ' 14' ' ' LEU . 17.0 m-85 -74.49 -38.14 62.95 Favored 'General case' 0 C--N 1.343 0.324 0 CA-C-N 118.572 0.624 . . . . 0.0 110.83 170.303 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . 0.429 ' HG2' ' CE1' ' A' ' 53' ' ' TYR . 61.5 mttt -63.72 -23.51 67.39 Favored 'General case' 0 C--N 1.34 0.194 0 CA-C-O 120.786 0.327 . . . . 0.0 110.443 178.924 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 32.0 t0 -75.74 -9.47 58.62 Favored 'General case' 0 CA--C 1.538 0.488 0 C-N-CA 123.397 0.679 . . . . 0.0 112.711 176.315 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . 0.495 ' CD1' ' HB2' ' A' ' 25' ' ' SER . 66.9 mt -88.87 171.65 9.76 Favored 'General case' 0 N--CA 1.455 -0.188 0 O-C-N 121.556 -0.715 . . . . 0.0 112.865 -176.443 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 2.1 mppt? -77.79 -25.77 49.21 Favored 'General case' 0 N--CA 1.453 -0.295 0 CA-C-N 115.661 -0.7 . . . . 0.0 110.694 178.725 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 9.4 t -147.58 9.51 0.92 Allowed 'General case' 0 CA--C 1.522 -0.105 0 N-CA-C 113.166 0.802 . . . . 0.0 113.166 -175.879 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 70.23 -13.94 1.37 Allowed Glycine 0 CA--C 1.528 0.856 0 C-N-CA 123.819 0.723 . . . . 0.0 113.234 176.374 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 83.8 mt -65.95 129.31 30.16 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.196 0 N-CA-C 107.282 -1.377 . . . . 0.0 107.282 175.546 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 25' ' ' SER . . . . . 0.495 ' HB2' ' CD1' ' A' ' 20' ' ' LEU . 3.0 t -159.61 73.56 0.57 Allowed 'General case' 0 CA--C 1.518 -0.261 0 N-CA-C 110.198 -0.297 . . . . 0.0 110.198 -171.357 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -44.6 -51.14 8.09 Favored Glycine 0 CA--C 1.527 0.789 0 CA-C-O 118.838 -0.979 . . . . 0.0 114.126 -170.305 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 27' ' ' SER . . . . . 0.432 ' HA ' ' HE3' ' A' ' 30' ' ' LYS . 37.1 p -70.34 -39.03 74.94 Favored 'General case' 0 N--CA 1.455 -0.184 0 CA-C-N 119.615 1.707 . . . . 0.0 111.072 -173.913 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 87.5 mtt180 -74.18 -39.83 62.94 Favored 'General case' 0 N--CA 1.454 -0.259 0 CA-C-N 117.812 0.278 . . . . 0.0 110.715 -179.36 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 61.7 mt -56.63 -46.09 82.67 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.634 0 N-CA-C 108.782 -0.822 . . . . 0.0 108.782 173.753 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . 0.432 ' HE3' ' HA ' ' A' ' 27' ' ' SER . 51.4 mtmt -66.75 -29.08 68.97 Favored 'General case' 0 C--N 1.34 0.168 0 CA-C-O 118.984 -0.532 . . . . 0.0 111.332 179.261 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . 0.459 ' CE ' ' HA ' ' A' ' 31' ' ' LYS . 3.3 mmpt? -66.13 -55.64 15.41 Favored 'General case' 0 N--CA 1.458 -0.073 0 CA-C-N 118.795 0.725 . . . . 0.0 111.014 -179.075 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . 0.502 ' HB2' ' CE2' ' A' ' 10' ' ' PHE . 1.6 pp -76.12 -18.88 58.96 Favored 'General case' 0 CA--C 1.532 0.264 0 C-N-CA 119.427 -0.909 . . . . 0.0 111.702 -179.71 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 33.2 m -71.13 -40.69 71.24 Favored 'General case' 0 N--CA 1.456 -0.156 0 N-CA-C 108.746 -0.835 . . . . 0.0 108.746 174.834 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 97.9 m -66.75 -41.2 88.17 Favored 'General case' 0 N--CA 1.45 -0.444 0 N-CA-C 109.776 -0.453 . . . . 0.0 109.776 179.388 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 22.1 t80 -60.62 -34.97 75.03 Favored 'General case' 0 C--O 1.226 -0.145 0 N-CA-C 109.938 -0.393 . . . . 0.0 109.938 177.337 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -73.46 -28.45 61.95 Favored 'General case' 0 N--CA 1.449 -0.49 0 CA-C-O 119.25 -0.405 . . . . 0.0 111.522 178.817 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 2.6 mm? -82.38 -34.26 28.43 Favored 'General case' 0 CA--C 1.52 -0.193 0 N-CA-C 109.259 -0.645 . . . . 0.0 109.259 -177.564 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 83.0 m-20 -64.93 -26.74 68.44 Favored 'General case' 0 N--CA 1.442 -0.85 0 C-N-CA 123.829 0.852 . . . . 0.0 110.675 174.463 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 75.7 m80 -151.59 105.64 3.17 Favored 'General case' 0 N--CA 1.452 -0.329 0 C-N-CA 122.985 0.514 . . . . 0.0 111.264 -177.959 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 40' ' ' ILE . . . . . 0.533 ' H ' HD13 ' A' ' 40' ' ' ILE . 0.0 OUTLIER -81.22 -14.59 12.59 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.378 0 C-N-CA 123.323 0.649 . . . . 0.0 110.7 175.481 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 94.5 m-20 -61.35 -11.65 10.89 Favored 'General case' 0 CA--C 1.528 0.103 0 N-CA-C 112.924 0.713 . . . . 0.0 112.924 -178.366 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -111.12 16.15 8.08 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.163 0 C-N-CA 123.23 0.612 . . . . 0.0 111.33 176.17 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 3.0 pp20? -52.77 -32.56 44.23 Favored 'General case' 0 CA--C 1.531 0.228 0 O-C-N 121.649 -0.657 . . . . 0.0 110.668 177.236 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 40.7 t -58.71 -48.35 81.43 Favored 'General case' 0 C--O 1.234 0.267 0 N-CA-C 112.519 0.562 . . . . 0.0 112.519 -179.362 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . 0.533 ' HZ2' ' HB2' ' A' ' 7' ' ' PHE . 18.7 ptpt -72.33 -25.9 61.72 Favored 'General case' 0 CA--C 1.53 0.187 0 CA-C-N 118.35 0.523 . . . . 0.0 110.193 179.69 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 70.4 mt -72.39 -48.8 46.2 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.257 0 N-CA-C 109.969 -0.382 . . . . 0.0 109.969 -178.236 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 39.6 mm -64.34 -35.67 74.89 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.232 0 N-CA-C 109.296 -0.631 . . . . 0.0 109.296 178.766 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 49.0 m -63.73 -38.93 92.95 Favored 'General case' 0 N--CA 1.453 -0.289 0 CA-C-N 116.836 -0.166 . . . . 0.0 111.1 179.993 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 35.7 mt -76.25 -32.81 59.08 Favored 'General case' 0 N--CA 1.45 -0.467 0 N-CA-C 113.545 0.943 . . . . 0.0 113.545 -178.917 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 15.5 pt -69.81 -40.62 79.23 Favored 'Isoleucine or valine' 0 CA--C 1.523 -0.089 0 CA-C-N 119.647 1.112 . . . . 0.0 110.298 179.294 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 25.8 pt -69.05 -38.53 78.45 Favored 'Isoleucine or valine' 0 CA--C 1.527 0.095 0 C-N-CA 120.068 -0.653 . . . . 0.0 110.528 178.838 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 95.9 m-20 -70.26 -39.36 75.02 Favored 'General case' 0 N--CA 1.456 -0.172 0 CA-C-O 119.281 -0.39 . . . . 0.0 112.007 177.848 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 53' ' ' TYR . . . . . 0.429 ' CE1' ' HG2' ' A' ' 18' ' ' LYS . 13.9 t80 -65.55 -46.61 78.86 Favored 'General case' 0 N--CA 1.453 -0.3 0 N-CA-C 108.707 -0.849 . . . . 0.0 108.707 177.384 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 23.1 m -61.71 -31.9 72.08 Favored 'General case' 0 N--CA 1.455 -0.218 0 O-C-N 123.096 0.248 . . . . 0.0 110.869 -178.327 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 56.2 ttp85 -75.43 -53.34 8.85 Favored 'General case' 0 N--CA 1.451 -0.381 0 C-N-CA 123.494 0.718 . . . . 0.0 112.023 -177.181 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 38.0 mt -76.1 -41.53 50.05 Favored 'General case' 0 N--CA 1.456 -0.158 0 N-CA-C 113.025 0.75 . . . . 0.0 113.025 -173.666 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 8.5 p -64.76 157.1 76.32 Favored Pre-proline 0 CA--C 1.535 0.37 0 N-CA-C 112.842 0.682 . . . . 0.0 112.842 -172.717 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 93.7 Cg_endo -74.66 175.85 10.56 Favored 'Trans proline' 0 N--CA 1.457 -0.664 0 C-N-CA 124.777 3.652 . . . . 0.0 111.131 178.945 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 23.1 p-10 -51.65 -50.06 61.09 Favored 'General case' 0 N--CA 1.456 -0.159 0 C-N-CA 124.31 1.044 . . . . 0.0 113.606 -172.061 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 81.9 p -64.92 -35.71 82.04 Favored 'General case' 0 N--CA 1.452 -0.351 0 C-N-CA 120.066 -0.654 . . . . 0.0 110.148 -177.299 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 48.3 m170 -74.04 -24.77 59.59 Favored 'General case' 0 N--CA 1.455 -0.18 0 CA-C-O 119.033 -0.508 . . . . 0.0 110.263 178.499 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 64.8 mttm -65.96 -34.74 78.8 Favored 'General case' 0 C--N 1.339 0.144 0 CA-C-N 118.791 0.723 . . . . 0.0 109.484 173.984 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -63.65 -48.68 76.27 Favored 'General case' 0 CA--C 1.531 0.248 0 N-CA-C 108.339 -0.985 . . . . 0.0 108.339 174.385 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -66.45 -26.88 72.82 Favored Glycine 0 CA--C 1.525 0.717 0 N-CA-C 111.732 -0.547 . . . . 0.0 111.732 -178.979 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 48.9 m -68.3 -40.35 81.77 Favored 'General case' 0 N--CA 1.452 -0.369 0 CA-C-N 117.654 0.727 . . . . 0.0 109.226 177.297 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 78.0 mt -70.05 -23.84 63.16 Favored 'General case' 0 N--CA 1.449 -0.51 0 CA-C-N 116.633 -0.258 . . . . 0.0 110.502 178.417 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 2.3 m-85 -69.54 -40.77 76.66 Favored 'General case' 0 N--CA 1.456 -0.149 0 CA-C-N 117.703 0.229 . . . . 0.0 111.23 173.041 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 68' ' ' ILE . . . . . 0.44 HD12 ' CD1' ' A' ' 17' ' ' PHE . 8.3 mt -67.43 -43.96 87.2 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.236 0 N-CA-C 109.123 -0.695 . . . . 0.0 109.123 178.772 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 88.9 mt -60.22 -30.69 46.54 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.251 0 C-N-CA 122.717 0.407 . . . . 0.0 111.059 175.887 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 19.4 t70 -70.09 -45.03 67.84 Favored 'General case' 0 N--CA 1.454 -0.262 0 CA-C-N 118.276 0.489 . . . . 0.0 111.603 179.346 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 95.0 p -70.88 -50.08 39.03 Favored 'General case' 0 N--CA 1.45 -0.444 0 C-N-CA 120.857 -0.337 . . . . 0.0 110.381 -176.404 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -75.72 -35.25 30.49 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.218 0 N-CA-C 110.234 -0.284 . . . . 0.0 110.234 -178.108 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -65.32 -51.78 46.21 Favored Glycine 0 C--N 1.335 0.476 0 N-CA-C 111.461 -0.656 . . . . 0.0 111.461 -175.132 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 36.8 mtm105 -71.26 -42.97 68.1 Favored 'General case' 0 N--CA 1.452 -0.351 0 C-N-CA 120.218 -0.593 . . . . 0.0 110.253 179.674 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -60.54 -28.26 68.29 Favored 'General case' 0 N--CA 1.45 -0.443 0 C-N-CA 120.024 -0.67 . . . . 0.0 110.193 -178.692 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 1.8 m-30 -70.36 -55.31 9.43 Favored 'General case' 0 N--CA 1.453 -0.275 0 CA-C-N 118.242 0.473 . . . . 0.0 110.865 174.993 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 6.9 tt -65.94 -43.67 87.33 Favored 'General case' 0 N--CA 1.451 -0.423 0 C-N-CA 117.661 -1.616 . . . . 0.0 109.331 -175.955 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 56.5 m-20 -55.82 -51.45 67.45 Favored 'General case' 0 CA--C 1.528 0.116 0 C-N-CA 122.471 0.308 . . . . 0.0 111.438 -179.028 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 15.2 tm-20 -66.23 -46.1 78.35 Favored 'General case' 0 N--CA 1.446 -0.666 0 N-CA-C 111.618 0.229 . . . . 0.0 111.618 -178.246 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 81.4 p -70.51 -21.51 62.74 Favored 'General case' 0 N--CA 1.451 -0.38 0 CA-C-O 119.711 -0.185 . . . . 0.0 111.341 -178.263 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -75.92 -33.21 59.86 Favored 'General case' 0 N--CA 1.453 -0.309 0 CA-C-N 117.858 0.299 . . . . 0.0 110.198 172.363 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 46.1 t . . . . . 0 N--CA 1.457 -0.118 0 N-CA-C 112.68 0.622 . . . . 0.0 112.68 -178.945 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 44.5 Cg_endo . . . . . 0 N--CA 1.45 -1.031 0 N-CA-C 106.35 -2.212 . . . . 0.0 106.35 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 92' ' ' GLY . . . . . 0.407 ' HA2' ' O ' ' A' ' 40' ' ' ILE . . . 156.9 19.51 0.04 OUTLIER Glycine 0 CA--C 1.529 0.932 0 CA-C-O 118.896 -0.947 . . . . 0.0 114.019 -170.803 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 1.3 p -155.2 165.49 36.51 Favored 'General case' 0 C--O 1.231 0.129 0 CA-C-N 118.617 1.209 . . . . 0.0 109.607 179.46 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 94' ' ' CYS . . . . . . . . . . . . . 2.3 t -51.46 -28.91 14.48 Favored 'General case' 0 N--CA 1.454 -0.233 0 C-N-CA 123.462 0.705 . . . . 0.0 110.722 175.372 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -54.56 -62.54 1.59 Allowed 'General case' 0 N--CA 1.451 -0.403 0 CA-C-N 117.821 0.282 . . . . 0.0 110.357 -179.001 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 66.2 t60 -71.54 -32.6 68.33 Favored 'General case' 0 N--CA 1.451 -0.38 0 O-C-N 122.29 -0.256 . . . . 0.0 110.65 -177.585 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -68.39 -51.74 40.69 Favored 'General case' 0 N--CA 1.451 -0.398 0 N-CA-C 111.579 0.214 . . . . 0.0 111.579 -175.528 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 1.7 mp -69.43 -34.86 64.2 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.234 0 CA-C-O 119.35 -0.357 . . . . 0.0 110.116 -178.231 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 29.5 m-80 -70.89 -40.0 72.49 Favored 'General case' 0 N--CA 1.456 -0.131 0 C-N-CA 119.995 -0.682 . . . . 0.0 112.018 178.896 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 85.3 m -74.2 -25.02 59.45 Favored 'General case' 0 N--CA 1.457 -0.104 0 CA-C-N 118.348 0.522 . . . . 0.0 111.178 -177.151 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 64.6 tp -87.57 -40.73 13.99 Favored 'General case' 0 N--CA 1.451 -0.409 0 O-C-N 122.256 -0.278 . . . . 0.0 110.506 177.582 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -69.86 -20.29 75.91 Favored Glycine 0 CA--C 1.527 0.84 0 CA-C-O 119.579 -0.567 . . . . 0.0 112.52 -175.592 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 22.9 pt-20 -79.35 -4.66 51.96 Favored 'General case' 0 N--CA 1.453 -0.295 0 CA-C-N 118.168 0.984 . . . . 0.0 111.595 179.285 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 21.9 m -139.89 3.93 0.57 Allowed 'Isoleucine or valine' 0 N--CA 1.464 0.259 0 N-CA-C 112.538 0.57 . . . . 0.0 112.538 176.834 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 105' ' ' ILE . . . . . . . . . . . . . 10.9 tp -64.43 -31.04 51.9 Favored 'Isoleucine or valine' 0 C--O 1.227 -0.104 0 CA-C-N 118.912 0.778 . . . . 0.0 111.118 -175.352 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 11.7 pt20 -67.8 -28.69 67.81 Favored 'General case' 0 N--CA 1.454 -0.23 0 O-C-N 122.017 -0.427 . . . . 0.0 110.107 179.453 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 61.6 mm-40 -75.68 -42.22 51.71 Favored 'General case' 0 N--CA 1.454 -0.243 0 N-CA-C 109.791 -0.448 . . . . 0.0 109.791 -179.35 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 88.7 mt -71.37 -34.59 70.58 Favored 'General case' 0 N--CA 1.454 -0.226 0 CA-C-N 116.67 -0.241 . . . . 0.0 110.793 -178.993 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 77.2 mt -67.04 -49.44 65.19 Favored 'General case' 0 N--CA 1.452 -0.329 0 N-CA-C 109.682 -0.488 . . . . 0.0 109.682 174.967 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 47.8 m -53.67 -39.8 65.41 Favored 'General case' 0 C--O 1.232 0.173 0 C-N-CA 122.528 0.331 . . . . 0.0 110.98 -179.575 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 29.4 t0 -67.18 -41.39 86.01 Favored 'General case' 0 N--CA 1.451 -0.421 0 CA-C-O 120.916 0.389 . . . . 0.0 110.199 177.715 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -70.87 -36.96 73.04 Favored 'General case' 0 N--CA 1.449 -0.51 0 CA-C-N 116.287 -0.415 . . . . 0.0 111.316 -176.324 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 113' ' ' ILE . . . . . 0.439 ' O ' ' HE3' ' A' ' 121' ' ' LYS . 18.3 mm -68.99 -40.98 81.59 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.185 0 N-CA-C 109.441 -0.577 . . . . 0.0 109.441 179.898 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -69.63 -27.64 65.23 Favored 'General case' 0 N--CA 1.453 -0.282 0 N-CA-C 112.048 0.388 . . . . 0.0 112.048 -179.903 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 115' ' ' LYS . . . . . 0.597 ' HZ1' ' HB2' ' A' ' 115' ' ' LYS . 0.0 OUTLIER -90.09 -38.17 13.73 Favored 'General case' 0 CA--C 1.529 0.139 0 N-CA-C 112.434 0.531 . . . . 0.0 112.434 -179.472 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 116' ' ' SER . . . . . 0.414 ' HB3' ' CB ' ' A' ' 120' ' ' HIS . 2.7 m -86.51 154.33 21.18 Favored 'General case' 0 CA--C 1.528 0.125 0 N-CA-C 112.227 0.454 . . . . 0.0 112.227 -170.307 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 49.1 t30 -77.72 170.56 16.38 Favored 'General case' 0 CA--C 1.531 0.229 0 C-N-CA 123.117 0.567 . . . . 0.0 111.302 -175.954 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 118' ' ' GLN . . . . . . . . . . . . . 20.8 mm100 -57.84 -34.05 69.3 Favored 'General case' 0 N--CA 1.457 -0.079 0 C-N-CA 123.237 0.615 . . . . 0.0 112.239 -173.631 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 9.5 p30 -70.39 -40.7 73.78 Favored 'General case' 0 N--CA 1.453 -0.29 0 N-CA-C 109.377 -0.601 . . . . 0.0 109.377 176.935 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 120' ' ' HIS . . . . . 0.414 ' CB ' ' HB3' ' A' ' 116' ' ' SER . 29.0 m170 -64.41 -39.47 93.91 Favored 'General case' 0 N--CA 1.45 -0.445 0 N-CA-C 109.746 -0.464 . . . . 0.0 109.746 176.486 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 121' ' ' LYS . . . . . 0.439 ' HE3' ' O ' ' A' ' 113' ' ' ILE . 64.5 mttp -59.73 -36.39 76.5 Favored 'General case' 0 C--N 1.342 0.257 0 N-CA-C 109.725 -0.472 . . . . 0.0 109.725 176.841 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 26.8 tt0 -65.74 -43.74 88.07 Favored 'General case' 0 N--CA 1.452 -0.341 0 C-N-CA 122.625 0.37 . . . . 0.0 110.651 -178.765 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 14.3 mptt -68.28 -30.02 68.94 Favored 'General case' 0 N--CA 1.457 -0.118 0 C-N-CA 120.486 -0.486 . . . . 0.0 110.221 -179.481 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 124' ' ' ILE . . . . . . . . . . . . . 67.6 mt -73.13 -39.64 57.12 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.365 0 N-CA-C 109.385 -0.598 . . . . 0.0 109.385 177.862 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 8.1 mmm180 -61.54 -43.72 98.34 Favored 'General case' 0 N--CA 1.451 -0.416 0 CA-C-O 118.544 -0.741 . . . . 0.0 111.593 179.051 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 126' ' ' MET . . . . . . . . . . . . . 28.2 ptm -64.68 -38.93 92.67 Favored 'General case' 0 N--CA 1.454 -0.274 0 C-N-CA 118.77 -1.172 . . . . 0.0 108.897 177.816 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 4.2 mp -61.81 -44.08 97.57 Favored 'General case' 0 N--CA 1.455 -0.223 0 CA-C-N 118.076 0.398 . . . . 0.0 111.09 178.216 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 83.9 mt -65.36 -32.66 74.42 Favored 'General case' 0 N--CA 1.456 -0.145 0 CA-C-N 118.506 0.593 . . . . 0.0 111.465 -177.832 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 45.5 m-20 -75.63 -35.51 60.45 Favored 'General case' 0 N--CA 1.453 -0.31 0 CA-C-N 118.329 0.513 . . . . 0.0 109.863 177.011 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 66.9 mt -62.98 -33.3 59.84 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.25 0 N-CA-C 109.39 -0.596 . . . . 0.0 109.39 174.784 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 131' ' ' TRP . . . . . . . . . . . . . 43.0 m0 . . . . . 0 N--CA 1.452 -0.339 0 N-CA-C 112.164 0.431 . . . . 0.0 112.164 179.129 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 4.2 mpp? . . . . . 0 N--CA 1.475 0.786 0 CA-C-O 119.958 -0.067 . . . . 0.0 110.841 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 2.7 pm0 -136.17 -136.42 0.15 Allowed 'General case' 0 CA--C 1.532 0.263 0 N-CA-C 108.913 -0.773 . . . . 0.0 108.913 178.563 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . 0.406 ' HA ' ' HZ3' ' A' ' 45' ' ' LYS . 29.3 tp60 -75.96 45.25 0.34 Allowed 'General case' 0 CA--C 1.534 0.362 0 CA-C-O 121.262 0.553 . . . . 0.0 111.45 179.143 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 10.8 m-20 -83.86 -177.33 6.65 Favored 'General case' 0 N--CA 1.455 -0.192 0 C-N-CA 124.119 0.968 . . . . 0.0 110.603 177.696 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 29.8 p-10 -82.88 11.79 5.65 Favored 'General case' 0 N--CA 1.456 -0.136 0 CA-C-O 121.04 0.447 . . . . 0.0 110.48 174.999 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 30.6 p-10 -71.16 -28.92 64.6 Favored 'General case' 0 N--CA 1.453 -0.289 0 N-CA-C 108.762 -0.829 . . . . 0.0 108.762 179.248 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' PHE . . . . . 0.66 ' HB2' ' HZ2' ' A' ' 45' ' ' LYS . 1.2 t80 -53.0 -36.37 60.38 Favored 'General case' 0 N--CA 1.447 -0.594 0 C-N-CA 124.982 1.313 . . . . 0.0 110.833 -178.263 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 51.5 tp60 -51.89 -35.27 44.67 Favored 'General case' 0 N--CA 1.454 -0.246 0 C-N-CA 123.978 0.911 . . . . 0.0 112.063 -176.947 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 31.1 m-80 -73.74 -33.48 64.34 Favored 'General case' 0 N--CA 1.453 -0.308 0 N-CA-C 110.076 -0.342 . . . . 0.0 110.076 -179.106 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' PHE . . . . . 0.423 ' CZ ' HG12 ' A' ' 46' ' ' ILE . 2.2 t80 -72.24 -36.45 69.1 Favored 'General case' 0 N--CA 1.452 -0.362 0 N-CA-C 108.896 -0.779 . . . . 0.0 108.896 177.298 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 95.7 t -68.0 -54.64 20.96 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.251 0 N-CA-C 108.81 -0.811 . . . . 0.0 108.81 178.157 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -58.67 -28.87 66.14 Favored 'General case' 0 N--CA 1.452 -0.329 0 N-CA-C 112.196 0.443 . . . . 0.0 112.196 -178.961 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 96.1 m -72.29 -41.99 66.02 Favored 'General case' 0 CA--C 1.532 0.268 0 N-CA-C 109.445 -0.576 . . . . 0.0 109.445 176.188 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . 0.477 ' HA ' ' CD1' ' A' ' 17' ' ' PHE . 12.6 tp -62.98 -44.82 94.99 Favored 'General case' 0 N--CA 1.452 -0.329 0 N-CA-C 109.811 -0.44 . . . . 0.0 109.811 178.035 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 76.0 mm-40 -62.37 -32.1 72.84 Favored 'General case' 0 N--CA 1.45 -0.431 0 C-N-CA 124.588 1.155 . . . . 0.0 109.969 178.446 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 70.2 m -67.03 -29.58 69.43 Favored 'General case' 0 N--CA 1.453 -0.276 0 N-CA-C 109.726 -0.472 . . . . 0.0 109.726 177.473 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' PHE . . . . . 0.477 ' CD1' ' HA ' ' A' ' 14' ' ' LEU . 14.0 m-85 -69.11 -42.31 76.25 Favored 'General case' 0 N--CA 1.457 -0.109 0 C-N-CA 120.126 -0.629 . . . . 0.0 110.492 172.31 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 71.3 mttt -61.16 -27.6 68.52 Favored 'General case' 0 C--N 1.339 0.146 0 CA-C-O 120.583 0.23 . . . . 0.0 110.654 -177.389 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 42.3 t0 -73.56 -23.69 60.0 Favored 'General case' 0 CA--C 1.531 0.23 0 CA-C-N 115.866 -0.606 . . . . 0.0 112.245 -178.722 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . 0.41 ' C ' ' HE3' ' A' ' 21' ' ' LYS . 94.8 mt -79.16 159.86 27.23 Favored 'General case' 0 CA--C 1.528 0.126 0 O-C-N 121.836 -0.54 . . . . 0.0 110.858 -178.789 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . 0.491 ' H ' ' CG ' ' B' 2052 ' ' ASP . 0.0 OUTLIER -84.47 -34.95 23.3 Favored 'General case' 0 C--N 1.34 0.163 0 N-CA-C 109.415 -0.587 . . . . 0.0 109.415 176.027 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' SER . . . . . 0.404 ' HG ' ' CG ' ' B' 2056 ' ' ASP . 83.9 p -82.02 -22.17 36.62 Favored 'General case' 0 C--N 1.34 0.187 0 C-N-CA 122.788 0.435 . . . . 0.0 111.017 177.937 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 71.59 -8.54 5.54 Favored Glycine 0 CA--C 1.529 0.921 0 C-N-CA 123.804 0.716 . . . . 0.0 112.889 179.282 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 44.9 mt -93.22 148.42 4.78 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.177 0 CA-C-N 117.751 0.776 . . . . 0.0 110.36 176.641 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 8.6 t -162.22 83.03 0.56 Allowed 'General case' 0 C--N 1.339 0.131 0 N-CA-C 109.543 -0.54 . . . . 0.0 109.543 -179.004 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -50.79 -44.9 49.13 Favored Glycine 0 CA--C 1.524 0.645 0 CA-C-O 118.725 -1.041 . . . . 0.0 115.067 -169.466 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 31.7 t -71.35 -42.05 68.98 Favored 'General case' 0 N--CA 1.455 -0.211 0 CA-C-N 119.945 1.872 . . . . 0.0 110.529 -177.469 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 80.4 mtt85 -66.68 -39.87 88.33 Favored 'General case' 0 N--CA 1.455 -0.208 0 N-CA-C 110.203 -0.295 . . . . 0.0 110.203 179.496 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 40.8 mt -55.98 -47.13 80.54 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.505 0 N-CA-C 108.254 -1.017 . . . . 0.0 108.254 174.815 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 78.8 mttt -65.7 -24.86 67.09 Favored 'General case' 0 C--N 1.34 0.172 0 CA-C-O 118.474 -0.774 . . . . 0.0 112.584 177.055 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . 0.463 ' HA ' ' HE3' ' A' ' 31' ' ' LYS . 0.0 OUTLIER -67.7 -56.1 10.61 Favored 'General case' 0 C--N 1.343 0.298 0 CA-C-N 119.704 1.138 . . . . 0.0 110.015 -179.915 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 2.4 pp -74.69 -19.18 60.36 Favored 'General case' 0 N--CA 1.455 -0.208 0 C-N-CA 119.201 -0.999 . . . . 0.0 111.101 -178.233 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 46.2 m -72.74 -37.38 67.74 Favored 'General case' 0 N--CA 1.456 -0.163 0 N-CA-C 109.239 -0.652 . . . . 0.0 109.239 176.404 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 96.0 m -74.69 -37.8 62.55 Favored 'General case' 0 N--CA 1.452 -0.344 0 CA-C-N 116.784 -0.189 . . . . 0.0 110.53 -178.398 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 57.7 t80 -69.93 -30.93 68.44 Favored 'General case' 0 N--CA 1.456 -0.162 0 C-N-CA 120.458 -0.497 . . . . 0.0 109.886 177.927 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -69.67 -33.26 72.32 Favored 'General case' 0 N--CA 1.45 -0.434 0 N-CA-C 110.097 -0.334 . . . . 0.0 110.097 176.293 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 20.6 mt -73.55 -40.77 63.7 Favored 'General case' 0 CA--C 1.52 -0.19 0 C-N-CA 122.743 0.417 . . . . 0.0 110.657 177.685 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 42.4 t0 -63.08 -24.54 67.95 Favored 'General case' 0 N--CA 1.455 -0.202 0 C-N-CA 122.814 0.446 . . . . 0.0 110.64 176.825 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 94.8 m-70 -149.75 95.63 2.35 Favored 'General case' 0 N--CA 1.454 -0.239 0 C-N-CA 122.896 0.479 . . . . 0.0 111.622 -177.52 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 40' ' ' ILE . . . . . 0.576 HD11 ' H ' ' A' ' 40' ' ' ILE . 0.0 OUTLIER -72.21 -13.44 16.62 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.345 0 N-CA-C 109.958 -0.386 . . . . 0.0 109.958 174.25 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 18.6 m-20 -58.45 -19.94 40.93 Favored 'General case' 0 CA--C 1.529 0.172 0 C-N-CA 123.24 0.616 . . . . 0.0 112.409 -176.316 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -107.57 15.07 7.8 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.186 0 N-CA-C 112.109 0.411 . . . . 0.0 112.109 176.78 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 3.0 pp20? -51.46 -33.38 30.79 Favored 'General case' 0 C--O 1.224 -0.241 0 CA-C-N 118.864 0.757 . . . . 0.0 110.69 178.479 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 29.8 t -58.11 -50.28 74.02 Favored 'General case' 0 CA--C 1.534 0.357 0 O-C-N 122.366 -0.209 . . . . 0.0 111.257 -177.245 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . 0.66 ' HZ2' ' HB2' ' A' ' 7' ' ' PHE . 18.6 ptpt -73.81 -27.87 61.34 Favored 'General case' 0 C--N 1.34 0.161 0 O-C-N 122.034 -0.416 . . . . 0.0 110.658 -179.906 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 46' ' ' ILE . . . . . 0.423 HG12 ' CZ ' ' A' ' 10' ' ' PHE . 86.5 mt -69.55 -48.13 67.82 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.377 0 C-N-CA 122.48 0.312 . . . . 0.0 110.181 -178.85 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 40.6 mm -64.14 -34.69 70.41 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.385 0 N-CA-C 108.95 -0.759 . . . . 0.0 108.95 179.18 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 28.4 t -63.73 -36.65 84.56 Favored 'General case' 0 N--CA 1.451 -0.401 0 C-N-CA 120.397 -0.521 . . . . 0.0 111.085 177.98 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 16.0 mt -73.4 -36.1 65.98 Favored 'General case' 0 N--CA 1.451 -0.387 0 N-CA-C 113.11 0.781 . . . . 0.0 113.11 -179.416 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 7.7 pt -71.0 -41.25 76.87 Favored 'Isoleucine or valine' 0 C--O 1.226 -0.152 0 CA-C-N 119.311 0.96 . . . . 0.0 110.68 -178.244 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 20.0 pt -68.71 -38.67 79.21 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.191 0 C-N-CA 120.155 -0.618 . . . . 0.0 110.374 179.403 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 92.0 m-20 -72.26 -39.14 68.63 Favored 'General case' 0 N--CA 1.454 -0.245 0 O-C-N 121.944 -0.472 . . . . 0.0 111.586 178.893 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 29.0 t80 -65.32 -51.18 62.34 Favored 'General case' 0 N--CA 1.454 -0.253 0 N-CA-C 108.844 -0.798 . . . . 0.0 108.844 176.533 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 24.0 t -62.29 -31.92 72.57 Favored 'General case' 0 N--CA 1.455 -0.214 0 C-N-CA 122.427 0.291 . . . . 0.0 111.731 -173.988 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 74.3 mtm180 -79.93 -43.56 21.92 Favored 'General case' 0 N--CA 1.453 -0.297 0 O-C-N 121.92 -0.488 . . . . 0.0 112.197 -178.703 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 56.4 mt -81.93 -42.77 19.01 Favored 'General case' 0 N--CA 1.461 0.08 0 N-CA-C 113.163 0.801 . . . . 0.0 113.163 -175.159 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 57' ' ' CYS . . . . . 0.465 ' O ' ' HE2' ' A' ' 62' ' ' LYS . 14.0 p -60.48 159.19 25.32 Favored Pre-proline 0 CA--C 1.534 0.358 0 N-CA-C 114.064 1.135 . . . . 0.0 114.064 -172.529 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 31.3 Cg_exo -59.7 172.77 1.94 Allowed 'Trans proline' 0 N--CA 1.456 -0.709 1 C-N-CA 125.56 4.174 . . . . 0.0 113.198 175.751 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 27.6 p-10 -60.85 -42.37 97.67 Favored 'General case' 0 C--N 1.329 -0.305 0 C-N-CA 124.068 0.947 . . . . 0.0 112.535 -173.039 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 95.1 p -70.06 -36.44 74.99 Favored 'General case' 0 N--CA 1.455 -0.22 0 N-CA-C 109.541 -0.54 . . . . 0.0 109.541 179.345 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 71.4 m80 -69.98 -28.03 65.2 Favored 'General case' 0 N--CA 1.451 -0.413 0 N-CA-C 110.114 -0.328 . . . . 0.0 110.114 177.707 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . 0.465 ' HE2' ' O ' ' A' ' 57' ' ' CYS . 64.6 mttm -64.39 -41.51 96.62 Favored 'General case' 0 C--N 1.339 0.142 0 N-CA-C 109.151 -0.685 . . . . 0.0 109.151 173.069 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -59.68 -45.41 92.15 Favored 'General case' 0 CA--C 1.533 0.319 0 N-CA-C 108.693 -0.854 . . . . 0.0 108.693 176.423 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -69.09 -28.29 73.03 Favored Glycine 0 C--N 1.337 0.635 0 N-CA-C 111.755 -0.538 . . . . 0.0 111.755 -179.425 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 38.0 p -67.15 -36.27 81.46 Favored 'General case' 0 N--CA 1.453 -0.324 0 CA-C-N 117.837 0.819 . . . . 0.0 109.151 177.672 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 81.6 mt -75.42 -26.54 58.43 Favored 'General case' 0 N--CA 1.45 -0.464 0 CA-C-O 119.398 -0.334 . . . . 0.0 110.756 -179.242 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 6.9 m-30 -67.39 -39.14 85.59 Favored 'General case' 0 C--O 1.233 0.189 0 CA-C-N 118.055 0.389 . . . . 0.0 110.686 172.098 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 68' ' ' ILE . . . . . . . . . . . . . 19.7 mt -68.32 -50.85 53.51 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.643 0 N-CA-C 108.761 -0.829 . . . . 0.0 108.761 179.474 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 88.5 mt -56.93 -34.87 45.37 Favored 'Isoleucine or valine' 0 C--N 1.34 0.156 0 C-N-CA 124.103 0.961 . . . . 0.0 111.328 178.223 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 11.9 t70 -69.44 -41.5 76.21 Favored 'General case' 0 N--CA 1.451 -0.407 0 CA-C-N 118.146 0.43 . . . . 0.0 110.588 177.377 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 19.4 m -71.65 -52.88 15.67 Favored 'General case' 0 N--CA 1.452 -0.356 0 CA-C-N 116.603 -0.271 . . . . 0.0 110.423 -175.893 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -75.17 -31.61 24.87 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.244 0 N-CA-C 110.165 -0.309 . . . . 0.0 110.165 -178.136 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -68.74 -56.01 10.34 Favored Glycine 0 C--N 1.336 0.565 0 N-CA-C 110.811 -0.916 . . . . 0.0 110.811 -176.379 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 39.6 mtm105 -65.62 -42.87 91.06 Favored 'General case' 0 N--CA 1.449 -0.511 0 C-N-CA 120.345 -0.542 . . . . 0.0 110.154 -179.475 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -64.17 -28.8 70.0 Favored 'General case' 0 N--CA 1.449 -0.484 0 C-N-CA 119.969 -0.692 . . . . 0.0 110.614 -177.139 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 2.0 m-30 -68.89 -47.31 66.18 Favored 'General case' 0 CA--C 1.518 -0.253 0 CA-C-N 118.738 0.699 . . . . 0.0 110.523 175.527 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 7.3 tt -67.29 -44.61 78.86 Favored 'General case' 0 N--CA 1.449 -0.491 0 C-N-CA 118.041 -1.464 . . . . 0.0 108.726 -179.336 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 72.3 m-20 -57.86 -48.51 79.59 Favored 'General case' 0 CA--C 1.53 0.177 0 N-CA-C 112.353 0.501 . . . . 0.0 112.353 178.922 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 15.4 tm-20 -62.98 -47.02 84.96 Favored 'General case' 0 N--CA 1.452 -0.353 0 CA-C-N 118.343 0.52 . . . . 0.0 110.886 -178.368 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 69.7 p -67.72 -32.78 73.65 Favored 'General case' 0 N--CA 1.454 -0.23 0 N-CA-C 110.152 -0.314 . . . . 0.0 110.152 179.523 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 33.9 ttp180 -66.56 -24.0 66.29 Favored 'General case' 0 N--CA 1.45 -0.447 0 C-N-CA 123.434 0.694 . . . . 0.0 110.939 174.891 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 35.1 t -98.85 -6.11 29.72 Favored 'General case' 0 CA--C 1.53 0.179 0 C-N-CA 123.63 0.772 . . . . 0.0 113.015 179.089 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 24.7 t-20 -141.55 170.94 14.77 Favored 'General case' 0 CA--C 1.531 0.246 0 CA-C-O 121.364 0.602 . . . . 0.0 112.42 -170.355 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 39.0 t -71.11 -0.6 9.99 Favored 'General case' 0 N--CA 1.456 -0.163 0 C-N-CA 123.257 0.623 . . . . 0.0 111.956 -179.518 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 78.3 m-20 -70.45 -6.5 36.29 Favored 'General case' 0 N--CA 1.452 -0.341 0 O-C-N 122.078 -0.389 . . . . 0.0 111.135 178.565 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 47.7 p -88.82 2.67 53.2 Favored 'General case' 0 CA--C 1.53 0.185 0 C-N-CA 122.901 0.48 . . . . 0.0 111.074 174.135 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 96.2 p -139.59 65.01 1.44 Allowed 'General case' 0 N--CA 1.454 -0.24 0 N-CA-C 109.692 -0.484 . . . . 0.0 109.692 179.244 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 34.1 t -148.11 -171.8 3.92 Favored 'General case' 0 CA--C 1.531 0.248 0 C-N-CA 123.659 0.784 . . . . 0.0 109.536 -178.024 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -53.96 148.82 9.94 Favored 'General case' 0 CA--C 1.529 0.148 0 C-N-CA 122.804 0.442 . . . . 0.0 111.438 -178.615 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 64.4 tttp -58.94 -65.03 2.24 Favored Pre-proline 0 CA--C 1.531 0.249 0 CA-C-O 118.156 -0.926 . . . . 0.0 111.17 -174.869 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 73.1 Cg_endo -69.63 146.35 60.68 Favored 'Trans proline' 0 N--CA 1.449 -1.143 0 N-CA-C 107.716 -1.686 . . . . 0.0 107.716 174.259 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 90.46 21.39 37.82 Favored Glycine 0 CA--C 1.523 0.563 0 CA-C-O 119.57 -0.572 . . . . 0.0 111.795 -179.091 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 41.5 p -151.62 173.84 14.18 Favored 'General case' 0 N--CA 1.454 -0.259 0 C-N-CA 123.884 0.873 . . . . 0.0 110.112 176.632 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 94' ' ' CYS . . . . . 0.429 ' HB2' HD11 ' A' ' 98' ' ' ILE . 17.4 p -62.81 -21.65 66.06 Favored 'General case' 0 N--CA 1.448 -0.559 0 CA-C-N 115.741 -0.663 . . . . 0.0 109.526 175.737 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -59.92 -58.59 7.87 Favored 'General case' 0 N--CA 1.447 -0.596 0 N-CA-C 109.373 -0.603 . . . . 0.0 109.373 -176.916 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 75.0 t60 -74.58 -28.05 60.75 Favored 'General case' 0 N--CA 1.45 -0.451 0 N-CA-C 111.583 0.216 . . . . 0.0 111.583 -179.405 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -68.45 -52.52 31.63 Favored 'General case' 0 N--CA 1.452 -0.339 0 CA-C-N 116.662 -0.245 . . . . 0.0 110.785 -178.154 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 98' ' ' ILE . . . . . 0.429 HD11 ' HB2' ' A' ' 94' ' ' CYS . 2.3 mp -69.49 -27.64 34.89 Favored 'Isoleucine or valine' 0 C--N 1.339 0.141 0 C-N-CA 120.266 -0.573 . . . . 0.0 109.889 177.749 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 99' ' ' ASN . . . . . 0.401 HD22 ' C ' ' A' ' 99' ' ' ASN . 0.3 OUTLIER -65.99 -42.81 89.32 Favored 'General case' 0 N--CA 1.452 -0.347 0 CA-C-N 118.03 0.377 . . . . 0.0 110.822 176.554 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 86.5 m -66.53 -43.72 84.42 Favored 'General case' 0 CA--C 1.518 -0.272 0 N-CA-C 110.16 -0.311 . . . . 0.0 110.16 -176.818 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 90.6 mt -69.24 -30.6 68.77 Favored 'General case' 0 N--CA 1.45 -0.431 0 C-N-CA 120.903 -0.319 . . . . 0.0 110.408 179.293 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -61.46 -14.82 43.59 Favored Glycine 0 CA--C 1.528 0.852 0 CA-C-O 119.132 -0.816 . . . . 0.0 112.749 -177.31 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 22.8 mt-10 -107.65 -12.78 15.18 Favored 'General case' 0 C--N 1.339 0.145 0 CA-C-N 118.359 1.079 . . . . 0.0 112.701 -177.981 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 13.2 m -130.03 -4.0 2.72 Favored 'Isoleucine or valine' 0 N--CA 1.461 0.118 0 N-CA-C 113.203 0.816 . . . . 0.0 113.203 -175.311 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 105' ' ' ILE . . . . . . . . . . . . . 10.5 tp -59.14 -23.44 24.59 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.173 0 CA-C-N 119.159 0.89 . . . . 0.0 109.991 178.828 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 25.4 pt20 -65.96 -30.74 71.36 Favored 'General case' 0 N--CA 1.453 -0.3 0 C-N-CA 123.059 0.543 . . . . 0.0 110.27 177.088 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 69.7 mt-10 -75.03 -44.65 46.69 Favored 'General case' 0 N--CA 1.451 -0.403 0 N-CA-C 109.638 -0.505 . . . . 0.0 109.638 -179.563 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 8.3 mp -66.36 -49.53 66.58 Favored 'General case' 0 N--CA 1.452 -0.353 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.624 -176.438 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 8.8 mp -70.13 -54.23 13.85 Favored 'General case' 0 N--CA 1.45 -0.459 0 CA-C-O 119.22 -0.419 . . . . 0.0 110.595 -176.741 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 32.3 t -55.9 -41.84 75.1 Favored 'General case' 0 N--CA 1.455 -0.192 0 CA-C-N 118.461 0.573 . . . . 0.0 111.464 -175.626 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 45.8 t0 -68.58 -41.02 80.27 Favored 'General case' 0 N--CA 1.451 -0.396 0 N-CA-C 109.495 -0.557 . . . . 0.0 109.495 178.013 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -65.33 -35.02 79.71 Favored 'General case' 0 N--CA 1.446 -0.634 0 CA-C-O 119.345 -0.36 . . . . 0.0 110.849 -177.298 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 113' ' ' ILE . . . . . 0.449 ' O ' ' HE3' ' A' ' 121' ' ' LYS . 21.1 mm -68.4 -43.13 84.34 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.32 0 CA-C-N 118.714 0.688 . . . . 0.0 109.17 177.81 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -69.07 -32.76 72.45 Favored 'General case' 0 N--CA 1.451 -0.388 0 N-CA-C 112.178 0.436 . . . . 0.0 112.178 -179.845 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 115' ' ' LYS . . . . . 0.483 ' N ' ' HZ3' ' A' ' 115' ' ' LYS . 0.0 OUTLIER -85.12 -39.6 17.72 Favored 'General case' 0 C--N 1.34 0.153 0 N-CA-C 112.619 0.6 . . . . 0.0 112.619 -178.258 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 116' ' ' SER . . . . . 0.449 ' HB2' ' CB ' ' A' ' 120' ' ' HIS . 49.5 p -85.31 157.16 20.63 Favored 'General case' 0 N--CA 1.455 -0.221 0 N-CA-C 112.257 0.466 . . . . 0.0 112.257 -171.556 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 50.8 t30 -79.97 170.69 16.11 Favored 'General case' 0 N--CA 1.454 -0.237 0 C-N-CA 123.243 0.617 . . . . 0.0 111.102 -178.226 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 118' ' ' GLN . . . . . . . . . . . . . 16.0 mm100 -56.92 -35.98 69.66 Favored 'General case' 0 CA--C 1.527 0.064 0 C-N-CA 123.199 0.6 . . . . 0.0 112.542 -173.634 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 10.0 p-10 -68.93 -40.1 79.22 Favored 'General case' 0 N--CA 1.454 -0.242 0 N-CA-C 109.358 -0.608 . . . . 0.0 109.358 178.299 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 120' ' ' HIS . . . . . 0.449 ' CB ' ' HB2' ' A' ' 116' ' ' SER . 27.8 m170 -66.47 -39.38 88.76 Favored 'General case' 0 N--CA 1.452 -0.352 0 CA-C-N 116.376 -0.375 . . . . 0.0 110.091 176.819 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 121' ' ' LYS . . . . . 0.449 ' HE3' ' O ' ' A' ' 113' ' ' ILE . 64.6 mttp -57.88 -36.18 72.03 Favored 'General case' 0 C--N 1.34 0.158 0 N-CA-C 109.537 -0.542 . . . . 0.0 109.537 176.795 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 40.3 tp10 -72.63 -36.56 68.05 Favored 'General case' 0 N--CA 1.452 -0.349 0 CA-C-O 119.746 -0.168 . . . . 0.0 111.448 -179.902 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 35.6 mmtp -63.43 -39.42 94.43 Favored 'General case' 0 N--CA 1.457 -0.103 0 N-CA-C 109.23 -0.656 . . . . 0.0 109.23 177.738 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 124' ' ' ILE . . . . . . . . . . . . . 65.7 mt -66.9 -34.93 73.18 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.37 0 N-CA-C 108.62 -0.881 . . . . 0.0 108.62 178.211 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 125' ' ' ARG . . . . . 0.425 ' HD2' ' HA ' ' A' ' 125' ' ' ARG . 20.5 tpt85 -68.18 -41.76 80.95 Favored 'General case' 0 N--CA 1.441 -0.877 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.988 -174.993 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 126' ' ' MET . . . . . . . . . . . . . 26.8 ptm -66.7 -32.4 73.68 Favored 'General case' 0 N--CA 1.453 -0.291 0 N-CA-C 108.811 -0.811 . . . . 0.0 108.811 174.809 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 4.7 mp -63.13 -33.83 76.32 Favored 'General case' 0 CA--C 1.531 0.239 0 CA-C-O 118.75 -0.643 . . . . 0.0 110.683 174.852 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 39.5 mt -68.77 -40.94 79.44 Favored 'General case' 0 C--N 1.34 0.162 0 CA-C-N 119.507 1.048 . . . . 0.0 110.148 179.007 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 51.9 m-20 -63.7 -39.2 93.73 Favored 'General case' 0 CA--C 1.522 -0.116 0 C-N-CA 120.353 -0.539 . . . . 0.0 109.911 176.322 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 58.3 mt -64.24 -33.31 61.72 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.256 0 C-N-CA 123.029 0.531 . . . . 0.0 109.959 178.178 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 131' ' ' TRP . . . . . . . . . . . . . 45.9 m0 -75.35 -29.47 59.94 Favored 'General case' 0 N--CA 1.455 -0.188 0 N-CA-C 112.055 0.391 . . . . 0.0 112.055 176.379 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 71.5 m-20 -74.98 -24.08 58.38 Favored 'General case' 0 C--N 1.333 -0.121 0 CA-C-N 118.126 0.421 . . . . 0.0 110.547 176.043 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 3.7 mtt180 -75.44 -38.34 59.81 Favored 'General case' 0 N--CA 1.453 -0.315 0 C-N-CA 123.129 0.572 . . . . 0.0 110.325 173.919 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 34.1 t -75.74 -31.9 59.78 Favored 'General case' 0 N--CA 1.456 -0.154 0 C-N-CA 122.312 0.245 . . . . 0.0 111.377 178.651 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 135' ' ' GLY . . . . . . . . . . . . . . . 91.98 16.92 49.6 Favored Glycine 0 CA--C 1.529 0.949 0 CA-C-O 119.353 -0.693 . . . . 0.0 112.85 178.882 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 136' ' ' LEU . . . . . . . . . . . . . 33.3 mt -56.59 133.18 53.43 Favored 'General case' 0 C--N 1.339 0.122 0 CA-C-N 118.401 1.1 . . . . 0.0 109.498 177.02 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 137' ' ' PHE . . . . . 0.412 ' C ' ' H ' ' A' ' 139' ' ' LYS . 81.4 t80 -76.33 -6.79 53.09 Favored 'General case' 0 CA--C 1.533 0.292 0 N-CA-C 113.286 0.847 . . . . 0.0 113.286 -173.979 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 138' ' ' GLN . . . . . . . . . . . . . 16.7 pt20 -73.39 32.67 0.07 Allowed 'General case' 0 CA--C 1.537 0.457 0 C-N-CA 123.013 0.525 . . . . 0.0 112.24 -177.422 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 139' ' ' LYS . . . . . 0.412 ' H ' ' C ' ' A' ' 137' ' ' PHE . 49.0 mttm -78.35 46.8 0.65 Allowed 'General case' 0 C--N 1.338 0.101 0 C-N-CA 124.079 0.952 . . . . 0.0 112.46 -176.598 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 140' ' ' SER . . . . . . . . . . . . . 43.5 t -73.8 51.24 0.37 Allowed 'General case' 0 CA--C 1.533 0.3 0 C-N-CA 123.495 0.718 . . . . 0.0 110.199 177.251 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 141' ' ' TYR . . . . . . . . . . . . . 16.5 m-30 -72.47 45.21 0.13 Allowed 'General case' 0 CA--C 1.531 0.237 0 C-N-CA 125.571 1.549 . . . . 0.0 112.538 -175.918 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 142' ' ' LEU . . . . . . . . . . . . . 80.9 mt -66.9 172.61 4.24 Favored 'General case' 0 N--CA 1.455 -0.194 0 C-N-CA 123.836 0.854 . . . . 0.0 110.446 177.243 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 14.6 p30 -63.25 -19.29 64.42 Favored 'General case' 0 CA--C 1.533 0.29 0 O-C-N 122.106 -0.371 . . . . 0.0 111.379 -178.101 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . -63.92 -30.02 71.14 Favored 'General case' 0 N--CA 1.453 -0.313 0 N-CA-C 109.654 -0.498 . . . . 0.0 109.654 177.605 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 145' ' ' ILE . . . . . . . . . . . . . 33.3 mm -72.71 -25.73 22.84 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.406 0 C-N-CA 122.565 0.346 . . . . 0.0 110.37 177.398 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 146' ' ' ARG . . . . . . . . . . . . . 42.9 mmt-85 -73.59 -28.9 62.07 Favored 'General case' 0 N--CA 1.457 -0.105 0 N-CA-C 109.103 -0.703 . . . . 0.0 109.103 176.968 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 147' ' ' SER . . . . . . . . . . . . . 43.4 t 53.25 30.38 9.91 Favored 'General case' 0 C--N 1.34 0.188 0 C-N-CA 123.264 0.626 . . . . 0.0 112.254 173.64 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.58 -17.08 29.93 Favored 'General case' 0 CA--C 1.533 0.304 0 C-N-CA 123.404 0.682 . . . . 0.0 112.651 -177.994 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 149' ' ' CYS . . . . . . . . . . . . . 61.3 m -69.23 -51.15 40.54 Favored 'General case' 0 N--CA 1.456 -0.143 0 N-CA-C 109.38 -0.6 . . . . 0.0 109.38 179.014 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 150' ' ' PHE . . . . . . . . . . . . . 95.9 m-85 -70.43 -16.55 62.95 Favored 'General case' 0 N--CA 1.451 -0.416 0 N-CA-C 110.673 -0.121 . . . . 0.0 110.673 -179.988 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 151' ' ' ALA . . . . . . . . . . . . . . . -75.27 -36.49 61.22 Favored 'General case' 0 N--CA 1.452 -0.373 0 N-CA-C 109.839 -0.43 . . . . 0.0 109.839 174.777 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 152' ' ' MET . . . . . . . . . . . . . 71.6 mtm -75.81 -22.88 55.91 Favored 'General case' 0 CA--C 1.53 0.179 0 CA-C-N 117.562 0.165 . . . . 0.0 111.177 176.043 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 153' ' ' ASP . . . . . . . . . . . . . 62.1 m-20 -73.94 -4.79 37.27 Favored 'General case' 0 CA--C 1.529 0.162 0 C-N-CA 122.77 0.428 . . . . 0.0 111.945 176.492 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 154' ' ' LEU . . . . . . . . . . . . . 75.9 mt -130.72 161.65 31.2 Favored 'General case' 0 N--CA 1.455 -0.198 0 C-N-CA 123.023 0.529 . . . . 0.0 110.695 -177.721 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 155' ' ' GLU . . . . . . . . . . . . . 79.5 mm-40 -73.0 151.11 41.92 Favored 'General case' 0 N--CA 1.454 -0.231 0 CA-C-O 120.843 0.354 . . . . 0.0 110.693 178.333 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 156' ' ' HIS . . . . . . . . . . . . . 79.6 t60 -158.88 156.24 29.22 Favored 'General case' 0 N--CA 1.453 -0.282 0 C-N-CA 122.851 0.46 . . . . 0.0 109.86 179.272 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 157' ' ' HIS . . . . . . . . . . . . . 70.6 t60 -155.84 145.2 20.87 Favored 'General case' 0 N--CA 1.451 -0.412 0 N-CA-C 109.622 -0.51 . . . . 0.0 109.622 176.616 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 158' ' ' HIS . . . . . . . . . . . . . 0.9 OUTLIER -159.17 28.64 0.21 Allowed 'General case' 0 CA--C 1.53 0.179 0 C-N-CA 122.359 0.264 . . . . 0.0 110.826 -179.771 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 159' ' ' HIS . . . . . . . . . . . . . 42.2 p-80 . . . . . 0 C--O 1.25 1.131 0 CA-C-O 116.928 -1.511 . . . . 0.0 110.438 -175.752 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' B' B 2052 ' ' ASP . . . . . 0.491 ' CG ' ' H ' ' A' ' 21' ' ' LYS . 0.2 OUTLIER . . . . . 0 N--CA 1.475 0.81 0 N-CA-C 109.552 -0.536 . . . . 0.0 109.552 . . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B 2053 ' ' ASP . . . . . . . . . . . . . 32.3 t0 -83.46 175.29 9.92 Favored 'General case' 0 N--CA 1.453 -0.309 0 C-N-CA 124.795 1.238 . . . . 0.0 109.513 175.046 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B 2054 ' ' ASP . . . . . . . . . . . . . 43.6 t0 61.8 -173.3 0.14 Allowed 'General case' 0 CA--C 1.533 0.319 0 C-N-CA 123.571 0.748 . . . . 0.0 112.672 174.91 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B 2055 ' ' GLU . . . . . . . . . . . . . 93.9 mt-10 -66.14 68.1 0.05 Allowed 'General case' 0 N--CA 1.452 -0.347 0 C-N-CA 125.489 1.515 . . . . 0.0 109.267 173.0 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B 2056 ' ' ASP . . . . . 0.404 ' CG ' ' HG ' ' A' ' 22' ' ' SER . 31.4 t0 -61.15 151.31 31.65 Favored 'General case' 0 N--CA 1.451 -0.386 0 C-N-CA 122.919 0.488 . . . . 0.0 110.141 178.788 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B 2057 ' ' ASP . . . . . . . . . . . . . 38.9 t0 48.76 51.55 15.59 Favored 'General case' 0 N--CA 1.454 -0.271 0 C-N-CA 123.766 0.826 . . . . 0.0 112.594 -174.609 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B 2058 ' ' TYR . . . . . . . . . . . . . 7.6 t80 -50.55 152.25 2.01 Favored 'General case' 0 CA--C 1.534 0.354 0 C-N-CA 123.813 0.845 . . . . 0.0 110.599 173.593 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B 2059 ' ' THR . . . . . . . . . . . . . 68.0 p -138.11 110.45 8.45 Favored Pre-proline 0 C--O 1.232 0.182 0 O-C-N 122.111 -0.368 . . . . 0.0 111.292 -177.979 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B 2060 ' ' PRO . . . . . . . . . . . . . 97.3 Cg_endo -74.52 161.18 40.4 Favored 'Trans proline' 0 N--CA 1.452 -0.953 0 C-N-CA 123.106 2.537 . . . . 0.0 108.937 169.82 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B 2061 ' ' SER . . . . . . . . . . . . . 97.8 p -158.62 154.49 26.59 Favored 'General case' 0 N--CA 1.455 -0.221 0 O-C-N 122.044 -0.41 . . . . 0.0 111.063 179.807 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B 2062 ' ' ILE . . . . . . . . . . . . . 56.1 mt -151.53 148.1 14.92 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.364 0 C-N-CA 124.995 1.318 . . . . 0.0 107.769 177.789 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B 2063 ' ' SER . . . . . . . . . . . . . 90.5 p . . . . . 0 C--O 1.252 1.19 0 CA-C-O 117.048 -1.453 . . . . 0.0 109.377 173.789 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 89.9 mmm . . . . . 0 N--CA 1.474 0.732 0 CA-C-O 120.471 0.177 . . . . 0.0 110.61 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 22.7 mp0 -144.71 -170.86 3.49 Favored 'General case' 0 CA--C 1.531 0.238 0 N-CA-C 108.693 -0.854 . . . . 0.0 108.693 -178.219 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 59.3 tt0 -60.87 -21.2 63.03 Favored 'General case' 0 CA--C 1.528 0.128 0 N-CA-C 109.718 -0.475 . . . . 0.0 109.718 175.198 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' ASP . . . . . 0.554 ' CG ' ' HZ1' ' A' ' 45' ' ' LYS . 8.8 p30 -150.15 125.07 9.88 Favored 'General case' 0 N--CA 1.448 -0.527 0 C-N-CA 124.728 1.211 . . . . 0.0 108.347 173.819 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 85.1 m-20 -81.97 17.98 1.44 Allowed 'General case' 0 N--CA 1.455 -0.176 0 N-CA-C 114.019 1.118 . . . . 0.0 114.019 -173.538 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 16.0 p-10 -80.94 -34.03 33.57 Favored 'General case' 0 C--N 1.331 -0.219 0 N-CA-C 106.692 -1.596 . . . . 0.0 106.692 171.467 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' PHE . . . . . 0.599 ' HB2' ' HZ3' ' A' ' 45' ' ' LYS . 1.1 t80 -63.01 -32.45 73.82 Favored 'General case' 0 N--CA 1.444 -0.764 0 C-N-CA 125.063 1.345 . . . . 0.0 110.141 -179.662 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 58.2 tp60 -48.38 -39.49 22.52 Favored 'General case' 0 N--CA 1.454 -0.229 0 C-N-CA 124.322 1.049 . . . . 0.0 111.765 -177.948 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 16.2 m-80 -71.75 -35.17 70.02 Favored 'General case' 0 N--CA 1.455 -0.177 0 N-CA-C 110.145 -0.317 . . . . 0.0 110.145 -178.261 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 1.7 t80 -72.29 -38.97 68.64 Favored 'General case' 0 N--CA 1.449 -0.483 0 C-N-CA 123.731 0.812 . . . . 0.0 109.514 178.148 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 93.0 t -66.24 -52.1 51.52 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.271 0 N-CA-C 108.608 -0.886 . . . . 0.0 108.608 178.601 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -60.36 -29.27 68.8 Favored 'General case' 0 N--CA 1.452 -0.367 0 C-N-CA 122.665 0.386 . . . . 0.0 111.848 179.902 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 59.8 m -73.96 -36.62 64.61 Favored 'General case' 0 CA--C 1.53 0.207 0 N-CA-C 109.055 -0.72 . . . . 0.0 109.055 176.484 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . 0.52 ' HA ' ' CD1' ' A' ' 17' ' ' PHE . 4.8 tp -66.57 -46.53 75.71 Favored 'General case' 0 N--CA 1.453 -0.287 0 CA-C-O 121.284 0.564 . . . . 0.0 109.776 177.899 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 67.8 mm-40 -62.01 -28.09 69.33 Favored 'General case' 0 N--CA 1.447 -0.579 0 C-N-CA 124.167 0.987 . . . . 0.0 109.189 178.485 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 48.2 t -70.99 -28.5 64.48 Favored 'General case' 0 N--CA 1.449 -0.517 0 CA-C-N 116.109 -0.496 . . . . 0.0 109.856 177.31 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' PHE . . . . . 0.52 ' CD1' ' HA ' ' A' ' 14' ' ' LEU . 19.4 m-85 -72.42 -35.55 68.39 Favored 'General case' 0 N--CA 1.455 -0.19 0 CA-C-N 118.584 0.629 . . . . 0.0 110.951 171.161 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . 0.468 ' HA ' ' CE1' ' A' ' 61' ' ' HIS . 84.7 mttt -62.93 -26.47 68.83 Favored 'General case' 0 C--N 1.339 0.132 0 N-CA-C 109.643 -0.503 . . . . 0.0 109.643 177.521 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 43.6 t0 -76.71 -15.28 59.82 Favored 'General case' 0 CA--C 1.537 0.478 0 CA-C-N 115.17 -0.923 . . . . 0.0 111.837 176.348 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . 0.408 ' C ' ' H ' ' A' ' 22' ' ' SER . 87.8 mt -86.06 144.68 27.43 Favored 'General case' 0 N--CA 1.45 -0.432 0 O-C-N 121.243 -0.91 . . . . 0.0 111.276 -179.143 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . 0.566 ' H ' ' HE2' ' A' ' 21' ' ' LYS . 1.6 mppt? -83.51 15.04 3.29 Favored 'General case' 0 CA--C 1.531 0.219 0 CA-C-N 115.116 -0.947 . . . . 0.0 108.849 177.316 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' SER . . . . . 0.408 ' H ' ' C ' ' A' ' 20' ' ' LEU . 86.0 p -141.73 -26.05 0.68 Allowed 'General case' 0 N--CA 1.454 -0.263 0 C-N-CA 124.735 1.214 . . . . 0.0 111.796 -175.416 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 75.83 -15.46 4.98 Favored Glycine 0 CA--C 1.526 0.731 0 C-N-CA 123.804 0.716 . . . . 0.0 113.141 175.965 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 81.5 mt -97.07 147.07 6.63 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.383 0 C-N-CA 123.395 0.678 . . . . 0.0 109.904 176.948 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 41.4 t -166.03 99.1 0.64 Allowed 'General case' 0 N--CA 1.455 -0.213 0 N-CA-C 109.055 -0.721 . . . . 0.0 109.055 171.296 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -55.2 -48.71 66.93 Favored Glycine 0 CA--C 1.523 0.544 0 CA-C-O 119.428 -0.651 . . . . 0.0 112.591 -172.65 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' SER . . . . . 0.426 ' HA ' ' HE3' ' A' ' 30' ' ' LYS . 16.5 m -63.05 -43.17 99.37 Favored 'General case' 0 N--CA 1.454 -0.251 0 CA-C-N 118.546 1.173 . . . . 0.0 111.08 -177.346 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 81.2 mtt180 -69.55 -42.31 74.77 Favored 'General case' 0 N--CA 1.457 -0.11 0 C-N-CA 122.509 0.324 . . . . 0.0 110.507 -179.888 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 62.6 mt -58.11 -41.78 81.47 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.616 0 N-CA-C 108.467 -0.938 . . . . 0.0 108.467 175.29 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . 0.426 ' HE3' ' HA ' ' A' ' 27' ' ' SER . 46.9 mtmt -69.37 -22.11 63.75 Favored 'General case' 0 N--CA 1.456 -0.171 0 CA-C-O 118.427 -0.797 . . . . 0.0 111.979 177.853 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . 0.51 ' HA ' ' HE2' ' A' ' 31' ' ' LYS . 8.3 mmpt? -67.1 -56.6 9.34 Favored 'General case' 0 C--N 1.34 0.172 0 CA-C-N 119.621 1.1 . . . . 0.0 109.295 175.352 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 4.6 pp -70.88 -25.73 62.92 Favored 'General case' 0 CA--C 1.528 0.107 0 C-N-CA 120.121 -0.632 . . . . 0.0 110.914 -177.603 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 60.4 m -71.72 -35.61 70.24 Favored 'General case' 0 N--CA 1.457 -0.103 0 N-CA-C 109.94 -0.392 . . . . 0.0 109.94 178.855 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 76.2 m -73.41 -37.33 65.97 Favored 'General case' 0 N--CA 1.454 -0.236 0 N-CA-C 110.414 -0.217 . . . . 0.0 110.414 -178.251 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 42.8 t80 -68.43 -33.22 73.81 Favored 'General case' 0 N--CA 1.457 -0.089 0 C-N-CA 119.852 -0.739 . . . . 0.0 110.087 176.619 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -69.4 -33.6 73.25 Favored 'General case' 0 N--CA 1.448 -0.567 0 CA-C-O 119.775 -0.155 . . . . 0.0 110.617 177.951 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 16.7 mt -73.14 -39.48 65.66 Favored 'General case' 0 N--CA 1.455 -0.209 0 C-N-CA 122.513 0.325 . . . . 0.0 110.684 177.919 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 44.3 t0 -63.61 -26.24 68.59 Favored 'General case' 0 N--CA 1.452 -0.356 0 C-N-CA 122.267 0.227 . . . . 0.0 110.78 176.39 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 97.1 m-70 -149.38 99.84 2.95 Favored 'General case' 0 N--CA 1.454 -0.261 0 C-N-CA 122.658 0.383 . . . . 0.0 111.476 -177.028 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 40' ' ' ILE . . . . . 0.552 ' H ' HD11 ' A' ' 40' ' ' ILE . 0.0 OUTLIER -75.39 -19.26 15.97 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.485 0 CA-C-O 118.844 -0.598 . . . . 0.0 110.79 178.0 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 71.1 m-20 -62.21 -9.16 6.97 Favored 'General case' 0 CA--C 1.531 0.212 0 N-CA-C 113.455 0.909 . . . . 0.0 113.455 -175.567 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -110.4 13.9 8.52 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.168 0 CA-C-N 118.187 0.449 . . . . 0.0 111.655 173.447 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 3.1 pp20? -52.89 -33.4 49.95 Favored 'General case' 0 CA--C 1.529 0.143 0 O-C-N 121.507 -0.746 . . . . 0.0 111.306 177.61 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 3.3 m -64.9 -40.69 95.47 Favored 'General case' 0 CA--C 1.533 0.304 0 CA-C-O 119.053 -0.499 . . . . 0.0 111.911 -176.369 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . 0.599 ' HZ3' ' HB2' ' A' ' 7' ' ' PHE . 15.3 ptpt -73.17 -27.06 61.43 Favored 'General case' 0 C--N 1.341 0.236 0 CA-C-N 119.346 0.975 . . . . 0.0 109.51 176.803 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 78.7 mt -72.34 -47.15 54.03 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.396 0 C-N-CA 122.715 0.406 . . . . 0.0 110.036 -177.427 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 42.2 mm -65.24 -38.16 81.93 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.203 0 N-CA-C 109.658 -0.497 . . . . 0.0 109.658 179.41 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 37.6 t -65.7 -32.49 74.07 Favored 'General case' 0 N--CA 1.455 -0.192 0 C-N-CA 120.38 -0.528 . . . . 0.0 110.478 177.513 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 29.4 tp -75.87 -32.71 59.84 Favored 'General case' 0 N--CA 1.452 -0.364 0 N-CA-C 112.691 0.626 . . . . 0.0 112.691 -177.061 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 11.6 pt -73.97 -38.5 49.74 Favored 'Isoleucine or valine' 0 C--N 1.338 0.098 0 CA-C-N 118.995 0.816 . . . . 0.0 110.956 177.819 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 46.9 pt -66.31 -37.06 78.86 Favored 'Isoleucine or valine' 0 C--O 1.227 -0.084 0 C-N-CA 119.484 -0.886 . . . . 0.0 109.991 178.351 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 95.1 m-20 -67.39 -36.91 82.27 Favored 'General case' 0 N--CA 1.454 -0.263 0 CA-C-N 117.559 0.163 . . . . 0.0 111.113 176.415 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 53' ' ' TYR . . . . . 0.411 ' CE1' ' HB3' ' A' ' 61' ' ' HIS . 18.5 t80 -67.67 -36.55 80.91 Favored 'General case' 0 C--O 1.226 -0.154 0 N-CA-C 109.908 -0.404 . . . . 0.0 109.908 176.172 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 15.2 m -75.59 -22.3 57.06 Favored 'General case' 0 N--CA 1.452 -0.352 0 C-N-CA 122.503 0.321 . . . . 0.0 111.532 -178.464 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 28.9 ttp-105 -86.69 -47.01 9.51 Favored 'General case' 0 N--CA 1.455 -0.199 0 N-CA-C 112.666 0.617 . . . . 0.0 112.666 -177.354 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 46.7 mt -84.95 -47.19 10.52 Favored 'General case' 0 N--CA 1.455 -0.196 0 N-CA-C 112.728 0.64 . . . . 0.0 112.728 -174.242 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 57' ' ' CYS . . . . . 0.512 ' HB3' ' HD2' ' A' ' 58' ' ' PRO . 59.5 m -74.62 160.01 81.99 Favored Pre-proline 0 CA--C 1.534 0.338 0 C-N-CA 122.97 0.508 . . . . 0.0 112.176 -173.573 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 58' ' ' PRO . . . . . 0.512 ' HD2' ' HB3' ' A' ' 57' ' ' CYS . 68.0 Cg_endo -79.01 -176.17 3.14 Favored 'Trans proline' 0 N--CA 1.455 -0.775 0 C-N-CA 125.174 3.916 . . . . 0.0 112.252 -170.073 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 59' ' ' ASP . . . . . 0.433 ' HB2' ' HA ' ' A' ' 116' ' ' SER . 26.0 p-10 -51.15 -50.13 59.5 Favored 'General case' 0 N--CA 1.457 -0.083 0 C-N-CA 124.605 1.162 . . . . 0.0 113.439 -172.837 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 24.5 m -66.18 -33.75 76.48 Favored 'General case' 0 N--CA 1.453 -0.309 0 N-CA-C 109.881 -0.415 . . . . 0.0 109.881 -175.405 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 61' ' ' HIS . . . . . 0.468 ' CE1' ' HA ' ' A' ' 18' ' ' LYS . 33.6 m170 -75.92 -27.44 57.64 Favored 'General case' 0 N--CA 1.451 -0.42 0 N-CA-C 110.051 -0.351 . . . . 0.0 110.051 179.283 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . 0.416 ' HB3' ' HE3' ' A' ' 62' ' ' LYS . 29.4 mtpp -73.58 -34.83 65.29 Favored 'General case' 0 C--N 1.339 0.115 0 N-CA-C 110.008 -0.367 . . . . 0.0 110.008 174.48 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -62.85 -43.77 97.91 Favored 'General case' 0 CA--C 1.535 0.402 0 N-CA-C 107.733 -1.21 . . . . 0.0 107.733 175.894 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -70.01 -24.74 76.31 Favored Glycine 0 C--N 1.34 0.751 0 CA-C-N 116.032 -0.531 . . . . 0.0 111.78 179.071 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 42.9 t -69.29 -37.44 77.83 Favored 'General case' 0 N--CA 1.452 -0.348 0 CA-C-N 117.972 0.886 . . . . 0.0 109.707 175.546 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 77.0 mt -72.96 -25.05 60.88 Favored 'General case' 0 N--CA 1.451 -0.412 0 CA-C-O 119.41 -0.329 . . . . 0.0 110.341 178.789 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 3.1 m-30 -70.23 -37.43 74.98 Favored 'General case' 0 CA--C 1.52 -0.204 0 CA-C-N 118.078 0.399 . . . . 0.0 110.5 171.016 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 68' ' ' ILE . . . . . 0.422 HD13 ' CE1' ' A' ' 17' ' ' PHE . 32.2 mt -67.4 -52.94 36.73 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.6 0 N-CA-C 108.389 -0.967 . . . . 0.0 108.389 178.189 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 71.6 mt -52.86 -35.42 21.78 Favored 'Isoleucine or valine' 0 C--N 1.339 0.145 0 C-N-CA 123.6 0.76 . . . . 0.0 111.6 175.88 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 18.4 t70 -69.61 -41.2 76.0 Favored 'General case' 0 C--N 1.333 -0.113 0 CA-C-N 118.538 0.608 . . . . 0.0 110.73 177.907 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 20.2 m -70.66 -56.5 6.29 Favored 'General case' 0 N--CA 1.45 -0.439 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.251 -176.509 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 72' ' ' ILE . . . . . 0.436 HD11 ' CZ ' ' A' ' 76' ' ' TYR . 0.0 OUTLIER -75.01 -29.89 22.73 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.247 0 N-CA-C 110.077 -0.342 . . . . 0.0 110.077 -176.85 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -69.72 -56.72 7.97 Favored Glycine 0 C--N 1.336 0.562 0 N-CA-C 111.533 -0.627 . . . . 0.0 111.533 -176.421 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 39.7 mtm105 -68.94 -38.46 79.5 Favored 'General case' 0 N--CA 1.453 -0.288 0 CA-C-N 117.48 0.64 . . . . 0.0 110.309 -179.395 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -64.36 -29.47 70.54 Favored 'General case' 0 N--CA 1.45 -0.449 0 C-N-CA 119.6 -0.84 . . . . 0.0 110.468 -179.219 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 76' ' ' TYR . . . . . 0.436 ' CZ ' HD11 ' A' ' 72' ' ' ILE . 2.1 m-30 -71.78 -46.36 58.57 Favored 'General case' 0 N--CA 1.455 -0.203 0 CA-C-N 118.427 0.558 . . . . 0.0 110.847 176.65 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -65.07 -41.21 95.3 Favored 'General case' 0 N--CA 1.45 -0.432 0 C-N-CA 118.427 -1.309 . . . . 0.0 107.896 -178.357 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 94.3 m-20 -65.55 -42.54 91.76 Favored 'General case' 0 C--O 1.23 0.064 0 N-CA-C 113.377 0.88 . . . . 0.0 113.377 178.161 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 15.5 tm-20 -64.29 -41.86 96.68 Favored 'General case' 0 N--CA 1.448 -0.541 0 CA-C-N 118.45 0.568 . . . . 0.0 110.746 178.322 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 71.5 p -74.36 -21.34 59.72 Favored 'General case' 0 N--CA 1.456 -0.146 0 CA-C-O 119.783 -0.151 . . . . 0.0 111.057 -179.737 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 64.6 mtt180 -68.35 -36.81 79.8 Favored 'General case' 0 CA--C 1.526 0.054 0 N-CA-C 109.835 -0.432 . . . . 0.0 109.835 169.124 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 35.4 t -88.37 -8.45 55.04 Favored 'General case' 0 N--CA 1.457 -0.105 0 C-N-CA 123.958 0.903 . . . . 0.0 113.226 -176.19 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 33.8 t-20 -130.59 156.32 45.06 Favored 'General case' 0 N--CA 1.456 -0.154 0 CA-C-N 118.047 0.385 . . . . 0.0 111.346 -171.767 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 37.7 t -82.09 7.87 12.29 Favored 'General case' 0 N--CA 1.452 -0.345 0 C-N-CA 123.464 0.706 . . . . 0.0 111.895 -177.985 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 48.2 p30 -77.11 1.47 18.07 Favored 'General case' 0 CA--C 1.533 0.303 0 C-N-CA 122.69 0.396 . . . . 0.0 111.754 -179.733 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 41.4 t -55.88 145.23 25.4 Favored 'General case' 0 N--CA 1.456 -0.171 0 CA-C-O 120.594 0.235 . . . . 0.0 110.531 -179.634 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 67.5 m -152.98 -179.93 8.11 Favored 'General case' 0 N--CA 1.456 -0.154 0 C-N-CA 123.305 0.642 . . . . 0.0 109.955 -174.405 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 79.0 p -148.52 -2.72 0.49 Allowed 'General case' 0 N--CA 1.454 -0.252 0 N-CA-C 111.959 0.355 . . . . 0.0 111.959 178.724 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 10.7 m120 -147.96 32.02 0.85 Allowed 'General case' 0 CA--C 1.531 0.215 0 C-N-CA 122.655 0.382 . . . . 0.0 111.216 -174.932 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 49.4 tttm -142.4 127.69 10.35 Favored Pre-proline 0 CA--C 1.53 0.197 0 CA-C-O 119.282 -0.39 . . . . 0.0 111.398 -176.356 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 71.9 Cg_endo -71.97 143.0 39.79 Favored 'Trans proline' 0 N--CA 1.451 -1.012 0 C-N-CA 122.869 2.38 . . . . 0.0 106.435 168.657 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 92' ' ' GLY . . . . . 0.442 ' HA2' ' O ' ' A' ' 40' ' ' ILE . . . 105.98 24.98 6.66 Favored Glycine 0 CA--C 1.527 0.81 0 C-N-CA 120.386 -0.911 . . . . 0.0 112.436 -172.902 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 37.9 p -153.94 171.93 18.22 Favored 'General case' 0 CA--C 1.522 -0.121 0 CA-C-N 117.908 0.854 . . . . 0.0 109.951 177.09 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 94' ' ' CYS . . . . . 0.425 ' HB2' HD11 ' A' ' 98' ' ' ILE . 19.6 p -62.24 -22.46 65.99 Favored 'General case' 0 N--CA 1.448 -0.541 0 N-CA-C 109.183 -0.673 . . . . 0.0 109.183 176.381 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -63.16 -58.03 8.59 Favored 'General case' 0 N--CA 1.445 -0.691 0 N-CA-C 109.352 -0.61 . . . . 0.0 109.352 -175.609 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 65.2 t60 -71.51 -33.38 69.16 Favored 'General case' 0 N--CA 1.45 -0.459 0 N-CA-C 110.228 -0.286 . . . . 0.0 110.228 -179.973 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -65.88 -53.95 32.96 Favored 'General case' 0 N--CA 1.448 -0.537 0 CA-C-O 119.831 -0.128 . . . . 0.0 111.104 -176.741 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 98' ' ' ILE . . . . . 0.425 HD11 ' HB2' ' A' ' 94' ' ' CYS . 2.5 mp -70.29 -29.57 39.78 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.336 0 C-N-CA 120.474 -0.49 . . . . 0.0 110.926 -178.375 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 13.4 m-80 -70.45 -38.15 74.44 Favored 'General case' 0 N--CA 1.456 -0.165 0 CA-C-N 118.737 0.698 . . . . 0.0 111.522 176.53 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 89.2 m -67.18 -31.93 72.66 Favored 'General case' 0 CA--C 1.519 -0.221 0 N-CA-C 109.577 -0.527 . . . . 0.0 109.577 179.528 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 83.5 mt -72.22 -42.15 66.05 Favored 'General case' 0 N--CA 1.446 -0.656 0 N-CA-C 109.124 -0.695 . . . . 0.0 109.124 174.874 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -59.38 -14.66 28.0 Favored Glycine 0 CA--C 1.526 0.76 0 CA-C-O 119.155 -0.803 . . . . 0.0 112.849 -177.392 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 21.6 pt-20 -104.28 -2.93 24.91 Favored 'General case' 0 CA--C 1.533 0.289 0 CA-C-N 118.557 1.178 . . . . 0.0 113.502 -177.56 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 34.9 m -143.58 -7.6 0.27 Allowed 'Isoleucine or valine' 0 N--CA 1.466 0.325 0 CA-C-N 118.977 0.808 . . . . 0.0 113.133 176.557 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 105' ' ' ILE . . . . . . . . . . . . . 10.8 tp -64.39 -24.87 36.64 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.169 0 CA-C-N 118.741 0.7 . . . . 0.0 111.018 -176.339 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 23.0 pt20 -69.72 -40.36 76.28 Favored 'General case' 0 N--CA 1.452 -0.33 0 CA-C-O 119.557 -0.258 . . . . 0.0 111.299 -175.591 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 76.4 mm-40 -80.1 -24.97 40.2 Favored 'General case' 0 N--CA 1.453 -0.313 0 CA-C-N 118.401 0.546 . . . . 0.0 110.8 175.958 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 9.1 tt -68.2 -41.62 81.1 Favored 'General case' 0 N--CA 1.452 -0.337 0 N-CA-C 108.908 -0.775 . . . . 0.0 108.908 177.195 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 55.6 mt -68.91 -52.25 31.42 Favored 'General case' 0 N--CA 1.453 -0.298 0 N-CA-C 109.016 -0.735 . . . . 0.0 109.016 174.893 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 34.5 t -42.28 -48.67 5.02 Favored 'General case' 0 C--O 1.234 0.24 0 C-N-CA 123.455 0.702 . . . . 0.0 112.527 175.333 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 35.6 t0 -67.8 -41.25 83.46 Favored 'General case' 0 N--CA 1.455 -0.224 0 N-CA-C 109.937 -0.394 . . . . 0.0 109.937 179.26 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -67.69 -32.94 73.95 Favored 'General case' 0 N--CA 1.446 -0.674 0 C-N-CA 120.848 -0.341 . . . . 0.0 110.794 -176.981 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 113' ' ' ILE . . . . . . . . . . . . . 40.9 mm -70.21 -38.82 75.8 Favored 'Isoleucine or valine' 0 C--N 1.339 0.144 0 CA-C-N 118.474 0.579 . . . . 0.0 109.941 178.766 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -74.27 -47.73 33.09 Favored 'General case' 0 N--CA 1.453 -0.322 0 N-CA-C 111.469 0.174 . . . . 0.0 111.469 179.792 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 115' ' ' LYS . . . . . 0.411 ' HE3' ' HB2' ' A' ' 115' ' ' LYS . 30.4 ttmt -76.98 -30.83 56.14 Favored 'General case' 0 N--CA 1.452 -0.331 0 C-N-CA 124.262 1.025 . . . . 0.0 113.619 -172.492 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 116' ' ' SER . . . . . 0.433 ' HA ' ' HB2' ' A' ' 59' ' ' ASP . 1.5 m -90.05 150.57 22.04 Favored 'General case' 0 CA--C 1.528 0.134 0 CA-C-N 118.177 0.444 . . . . 0.0 111.383 -174.185 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 19.1 t30 -71.21 169.31 15.42 Favored 'General case' 0 C--O 1.225 -0.213 0 C-N-CA 122.802 0.441 . . . . 0.0 110.685 -174.2 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 118' ' ' GLN . . . . . . . . . . . . . 17.1 mt-30 -55.39 -36.23 66.17 Favored 'General case' 0 CA--C 1.528 0.103 0 N-CA-C 111.947 0.351 . . . . 0.0 111.947 -173.616 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -66.59 -34.29 77.56 Favored 'General case' 0 N--CA 1.456 -0.14 0 N-CA-C 109.64 -0.504 . . . . 0.0 109.64 178.331 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 120' ' ' HIS . . . . . 0.411 ' CB ' ' HB3' ' A' ' 116' ' ' SER . 19.4 m170 -75.48 -41.3 55.86 Favored 'General case' 0 N--CA 1.448 -0.549 0 N-CA-C 109.178 -0.675 . . . . 0.0 109.178 179.07 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 49.4 mttm -54.75 -43.6 72.86 Favored 'General case' 0 N--CA 1.456 -0.165 0 N-CA-C 108.824 -0.806 . . . . 0.0 108.824 177.2 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 39.1 tp10 -66.17 -41.81 89.82 Favored 'General case' 0 N--CA 1.454 -0.266 0 CA-C-O 119.62 -0.228 . . . . 0.0 110.633 -179.269 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 88.9 mttt -66.6 -28.64 68.66 Favored 'General case' 0 N--CA 1.452 -0.342 0 C-N-CA 119.721 -0.792 . . . . 0.0 111.112 178.801 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 124' ' ' ILE . . . . . . . . . . . . . 58.1 mt -72.27 -38.22 61.1 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.198 0 CA-C-N 118.52 0.6 . . . . 0.0 109.897 177.906 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 27.9 mmt180 -64.62 -40.37 95.36 Favored 'General case' 0 N--CA 1.455 -0.216 0 O-C-N 121.887 -0.508 . . . . 0.0 110.819 -179.744 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 126' ' ' MET . . . . . . . . . . . . . 28.3 ptm -71.8 -30.69 65.79 Favored 'General case' 0 CA--C 1.528 0.117 0 C-N-CA 120.181 -0.608 . . . . 0.0 110.827 -179.648 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 66.7 mt -64.74 -35.85 82.4 Favored 'General case' 0 N--CA 1.456 -0.128 0 CA-C-N 118.392 0.542 . . . . 0.0 110.103 175.347 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 95.4 mt -69.4 -35.74 76.07 Favored 'General case' 0 CA--C 1.529 0.159 0 CA-C-N 118.193 0.451 . . . . 0.0 110.64 178.12 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 14.9 t0 -63.29 -44.52 94.8 Favored 'General case' 0 N--CA 1.456 -0.172 0 N-CA-C 109.367 -0.605 . . . . 0.0 109.367 176.368 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 65.4 mt -60.93 -34.27 58.95 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.251 0 N-CA-C 109.993 -0.373 . . . . 0.0 109.993 -179.981 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 131' ' ' TRP . . . . . . . . . . . . . 43.4 m0 -75.31 -33.1 61.13 Favored 'General case' 0 N--CA 1.452 -0.334 0 C-N-CA 120.057 -0.657 . . . . 0.0 112.617 -179.271 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 94.2 m-20 -74.64 -27.42 60.43 Favored 'General case' 0 N--CA 1.454 -0.25 0 CA-C-N 118.352 0.524 . . . . 0.0 111.171 178.651 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 133' ' ' ARG . . . . . 0.499 HH21 ' C ' ' B' 2063 ' ' SER . 13.4 mtp180 -72.58 -35.74 68.01 Favored 'General case' 0 N--CA 1.456 -0.154 0 N-CA-C 109.097 -0.705 . . . . 0.0 109.097 174.557 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 38.1 t -76.88 -14.62 59.86 Favored 'General case' 0 CA--C 1.533 0.317 0 C-N-CA 122.969 0.508 . . . . 0.0 111.138 176.856 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 135' ' ' GLY . . . . . . . . . . . . . . . 82.64 16.14 71.53 Favored Glycine 0 CA--C 1.53 0.992 0 CA-C-O 118.929 -0.928 . . . . 0.0 114.579 172.659 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 136' ' ' LEU . . . . . . . . . . . . . 9.4 mp -70.99 168.19 17.57 Favored 'General case' 0 CA--C 1.537 0.46 0 CA-C-N 119.16 1.48 . . . . 0.0 110.42 178.931 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 137' ' ' PHE . . . . . 0.441 ' C ' ' H ' ' A' ' 139' ' ' LYS . 8.4 m-30 -83.55 12.34 5.82 Favored 'General case' 0 CA--C 1.533 0.317 0 N-CA-C 115.636 1.717 . . . . 0.0 115.636 -169.103 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 138' ' ' GLN . . . . . . . . . . . . . 27.2 mp0 -73.07 31.88 0.07 Allowed 'General case' 0 CA--C 1.537 0.459 0 CA-C-N 120.231 1.378 . . . . 0.0 112.384 178.866 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 139' ' ' LYS . . . . . 0.441 ' H ' ' C ' ' A' ' 137' ' ' PHE . 45.9 mmtm -73.8 15.96 0.25 Allowed 'General case' 0 CA--C 1.532 0.271 0 C-N-CA 124.384 1.073 . . . . 0.0 112.403 -177.894 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 140' ' ' SER . . . . . 0.459 ' C ' ' H ' ' A' ' 142' ' ' LEU . 95.8 p -75.35 63.31 1.4 Allowed 'General case' 0 N--CA 1.455 -0.198 0 C-N-CA 123.97 0.908 . . . . 0.0 110.406 179.007 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 141' ' ' TYR . . . . . . . . . . . . . 42.7 m-85 -67.23 27.52 0.02 OUTLIER 'General case' 0 CA--C 1.533 0.311 0 C-N-CA 124.267 1.027 . . . . 0.0 113.312 -179.583 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 142' ' ' LEU . . . . . 0.459 ' H ' ' C ' ' A' ' 140' ' ' SER . 76.1 mt -70.13 168.22 16.09 Favored 'General case' 0 N--CA 1.451 -0.39 0 CA-C-N 118.045 0.384 . . . . 0.0 110.553 -178.316 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 4.3 m120 -57.58 -15.05 6.27 Favored 'General case' 0 C--O 1.231 0.129 0 C-N-CA 123.055 0.542 . . . . 0.0 111.36 179.609 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . -61.45 -40.66 95.31 Favored 'General case' 0 N--CA 1.449 -0.513 0 N-CA-C 109.328 -0.619 . . . . 0.0 109.328 177.101 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 145' ' ' ILE . . . . . . . . . . . . . 17.3 mm -75.55 -24.1 16.99 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.219 0 CA-C-N 118.234 0.47 . . . . 0.0 110.393 -178.273 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 146' ' ' ARG . . . . . 0.4 HH21 ' CE1' ' A' ' 157' ' ' HIS . 16.9 tpt180 -74.71 -14.82 60.78 Favored 'General case' 0 N--CA 1.455 -0.223 0 N-CA-C 109.17 -0.678 . . . . 0.0 109.17 171.717 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 147' ' ' SER . . . . . . . . . . . . . 25.2 t 61.87 72.12 0.52 Allowed 'General case' 0 N--CA 1.452 -0.358 0 C-N-CA 125.351 1.46 . . . . 0.0 110.822 178.699 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 148' ' ' LYS . . . . . 0.579 ' HD3' ' H ' ' A' ' 148' ' ' LYS . 0.0 OUTLIER -46.99 -26.43 1.01 Allowed 'General case' 0 N--CA 1.452 -0.355 0 CA-C-N 114.532 -1.213 . . . . 0.0 111.861 174.282 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 149' ' ' CYS . . . . . . . . . . . . . 50.5 t -69.6 -48.96 58.31 Favored 'General case' 0 N--CA 1.452 -0.332 0 N-CA-C 109.291 -0.633 . . . . 0.0 109.291 179.04 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 150' ' ' PHE . . . . . . . . . . . . . 33.2 t80 -63.94 -28.82 70.08 Favored 'General case' 0 N--CA 1.453 -0.302 0 N-CA-C 110.449 -0.204 . . . . 0.0 110.449 -178.074 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 151' ' ' ALA . . . . . . . . . . . . . . . -75.64 -27.32 58.35 Favored 'General case' 0 N--CA 1.452 -0.374 0 C-N-CA 122.692 0.397 . . . . 0.0 111.226 177.545 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 152' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER -83.05 -27.17 30.49 Favored 'General case' 0 N--CA 1.455 -0.179 0 O-C-N 122.233 -0.292 . . . . 0.0 110.43 173.85 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 153' ' ' ASP . . . . . . . . . . . . . 69.0 m-20 -74.58 -44.2 51.99 Favored 'General case' 0 N--CA 1.454 -0.253 0 C-N-CA 123.024 0.529 . . . . 0.0 111.022 178.175 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 154' ' ' LEU . . . . . . . . . . . . . 47.4 mt -143.82 155.77 44.25 Favored 'General case' 0 C--N 1.339 0.124 0 C-N-CA 123.886 0.874 . . . . 0.0 110.59 -179.457 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 155' ' ' GLU . . . . . . . . . . . . . 37.3 mp0 -75.14 13.78 0.65 Allowed 'General case' 0 CA--C 1.531 0.217 0 C-N-CA 123.667 0.787 . . . . 0.0 111.73 -179.905 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 156' ' ' HIS . . . . . . . . . . . . . 39.9 m170 -68.59 137.66 54.44 Favored 'General case' 0 N--CA 1.454 -0.27 0 CA-C-O 121.003 0.43 . . . . 0.0 112.004 -175.487 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 157' ' ' HIS . . . . . 0.4 ' CE1' HH21 ' A' ' 146' ' ' ARG . 85.9 t60 -143.67 1.88 1.2 Allowed 'General case' 0 CA--C 1.529 0.143 0 C-N-CA 123.66 0.784 . . . . 0.0 110.534 178.457 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 158' ' ' HIS . . . . . . . . . . . . . 40.7 p-80 -79.59 40.43 0.44 Allowed 'General case' 0 CA--C 1.53 0.211 0 C-N-CA 123.873 0.869 . . . . 0.0 110.396 178.068 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 159' ' ' HIS . . . . . . . . . . . . . 32.0 p80 . . . . . 0 C--O 1.249 1.037 0 CA-C-O 117.558 -1.21 . . . . 0.0 109.721 -176.631 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' B' B 2052 ' ' ASP . . . . . 0.449 ' HA ' ' OD1' ' B' 2056 ' ' ASP . 1.5 m-20 . . . . . 0 N--CA 1.471 0.615 0 CA-C-O 119.397 -0.335 . . . . 0.0 110.248 . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B 2053 ' ' ASP . . . . . . . . . . . . . 5.7 m-20 -118.72 -28.8 5.54 Favored 'General case' 0 CA--C 1.531 0.218 0 O-C-N 123.344 0.402 . . . . 0.0 111.219 -178.662 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B 2054 ' ' ASP . . . . . . . . . . . . . 67.7 t0 -166.47 89.31 0.38 Allowed 'General case' 0 CA--C 1.53 0.205 0 CA-C-N 118.092 0.405 . . . . 0.0 110.851 -177.965 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B 2055 ' ' GLU . . . . . . . . . . . . . 68.1 tt0 53.34 45.51 28.28 Favored 'General case' 0 CA--C 1.531 0.243 0 C-N-CA 123.731 0.812 . . . . 0.0 111.766 177.113 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B 2056 ' ' ASP . . . . . 0.449 ' OD1' ' HA ' ' B' 2052 ' ' ASP . 1.0 OUTLIER -66.1 16.15 0.03 OUTLIER 'General case' 0 CA--C 1.534 0.365 0 N-CA-C 114.769 1.396 . . . . 0.0 114.769 -175.98 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' B' B 2057 ' ' ASP . . . . . . . . . . . . . 27.3 t0 -153.04 65.71 0.78 Allowed 'General case' 0 N--CA 1.455 -0.205 0 CA-C-N 119.385 0.993 . . . . 0.0 111.723 175.252 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B 2058 ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -52.33 124.96 14.58 Favored 'General case' 0 N--CA 1.453 -0.293 0 N-CA-C 108.435 -0.95 . . . . 0.0 108.435 173.467 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B 2059 ' ' THR . . . . . . . . . . . . . 55.1 m -108.75 110.02 61.2 Favored Pre-proline 0 N--CA 1.453 -0.315 0 N-CA-C 109.214 -0.662 . . . . 0.0 109.214 -177.881 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B 2060 ' ' PRO . . . . . . . . . . . . . 31.6 Cg_exo -61.52 166.81 10.83 Favored 'Trans proline' 0 N--CA 1.452 -0.955 0 C-N-CA 123.574 2.85 . . . . 0.0 112.155 177.51 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B 2061 ' ' SER . . . . . . . . . . . . . 72.4 m -147.72 134.21 19.73 Favored 'General case' 0 N--CA 1.452 -0.352 0 N-CA-C 107.844 -1.169 . . . . 0.0 107.844 175.19 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B 2062 ' ' ILE . . . . . . . . . . . . . 19.0 tt -163.06 152.65 3.16 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.219 0 CA-C-O 120.492 0.187 . . . . 0.0 110.599 -176.256 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B 2063 ' ' SER . . . . . 0.499 ' C ' HH21 ' A' ' 133' ' ' ARG . 40.8 m . . . . . 0 C--O 1.247 0.972 0 CA-C-O 116.917 -1.516 . . . . 0.0 109.703 175.846 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 4.0 mpp? . . . . . 0 N--CA 1.472 0.632 0 N-CA-C 110.078 -0.341 . . . . 0.0 110.078 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 4.4 pm0 -152.16 -28.04 0.17 Allowed 'General case' 0 N--CA 1.454 -0.262 0 CA-C-N 116.846 -0.161 . . . . 0.0 111.289 179.955 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . 0.502 ' C ' ' H ' ' A' ' 5' ' ' ASP . 46.7 tp60 -157.01 24.41 0.31 Allowed 'General case' 0 N--CA 1.454 -0.253 0 CA-C-O 121.739 0.78 . . . . 0.0 108.919 178.205 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' ASP . . . . . 0.408 ' N ' ' OD1' ' A' ' 4' ' ' ASP . 0.1 OUTLIER -75.31 29.58 0.1 Allowed 'General case' 0 N--CA 1.454 -0.24 0 C-N-CA 125.377 1.471 . . . . 0.0 110.684 -178.247 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . 0.502 ' H ' ' C ' ' A' ' 3' ' ' GLN . 48.0 m-20 57.85 18.55 5.03 Favored 'General case' 0 N--CA 1.455 -0.191 0 C-N-CA 125.167 1.387 . . . . 0.0 110.378 -168.291 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 20.7 p-10 -78.61 -26.65 45.41 Favored 'General case' 0 N--CA 1.449 -0.488 0 CA-C-N 115.196 -0.911 . . . . 0.0 108.928 175.806 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' PHE . . . . . 0.497 ' HB2' ' HZ1' ' A' ' 45' ' ' LYS . 1.5 t80 -49.73 -39.6 37.87 Favored 'General case' 0 N--CA 1.456 -0.145 0 C-N-CA 124.028 0.931 . . . . 0.0 110.089 177.416 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 50.8 tp60 -51.79 -34.63 40.67 Favored 'General case' 0 N--CA 1.455 -0.189 0 C-N-CA 124.061 0.944 . . . . 0.0 111.919 -177.183 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 30.7 m-80 -74.2 -30.7 62.33 Favored 'General case' 0 N--CA 1.451 -0.394 0 N-CA-C 109.916 -0.401 . . . . 0.0 109.916 -179.175 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' PHE . . . . . 0.415 ' CE2' ' HB2' ' A' ' 32' ' ' LEU . 3.2 t80 -71.04 -38.99 72.53 Favored 'General case' 0 N--CA 1.451 -0.414 0 N-CA-C 109.125 -0.695 . . . . 0.0 109.125 176.221 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 65.2 t -64.69 -56.47 15.85 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.307 0 N-CA-C 108.948 -0.76 . . . . 0.0 108.948 178.409 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -59.49 -27.17 65.89 Favored 'General case' 0 N--CA 1.451 -0.393 0 C-N-CA 123.109 0.564 . . . . 0.0 112.247 -179.933 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 81.8 m -73.38 -41.4 63.42 Favored 'General case' 0 N--CA 1.456 -0.162 0 CA-C-N 118.785 0.721 . . . . 0.0 109.262 177.163 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . 0.488 ' HA ' ' CD1' ' A' ' 17' ' ' PHE . 11.8 tp -64.06 -48.0 77.94 Favored 'General case' 0 N--CA 1.452 -0.345 0 CA-C-O 121.357 0.599 . . . . 0.0 109.643 177.728 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 61.7 mm-40 -62.33 -30.48 71.19 Favored 'General case' 0 N--CA 1.452 -0.359 0 C-N-CA 124.209 1.003 . . . . 0.0 109.886 179.303 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 31.4 t -67.84 -31.42 71.24 Favored 'General case' 0 N--CA 1.45 -0.458 0 CA-C-O 119.011 -0.519 . . . . 0.0 110.033 177.476 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' PHE . . . . . 0.488 ' CD1' ' HA ' ' A' ' 14' ' ' LEU . 13.8 m-85 -67.85 -39.91 83.74 Favored 'General case' 0 C--N 1.339 0.132 0 CA-C-N 118.495 0.589 . . . . 0.0 110.439 172.999 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . 0.438 ' HG2' ' CE1' ' A' ' 53' ' ' TYR . 65.8 mttt -64.8 -27.88 69.19 Favored 'General case' 0 C--N 1.338 0.106 0 CA-C-O 120.468 0.175 . . . . 0.0 110.864 -178.008 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 36.3 t0 -75.29 -14.72 60.52 Favored 'General case' 0 CA--C 1.533 0.293 0 C-N-CA 123.634 0.774 . . . . 0.0 112.186 179.865 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 48.7 mt -77.12 168.84 19.39 Favored 'General case' 0 N--CA 1.457 -0.124 0 O-C-N 121.714 -0.616 . . . . 0.0 111.758 -178.992 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 8.3 mtmp? -99.41 -27.19 13.86 Favored 'General case' 0 N--CA 1.455 -0.215 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.049 174.698 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 80.7 p -90.56 -25.33 20.27 Favored 'General case' 0 CA--C 1.529 0.167 0 C-N-CA 122.913 0.485 . . . . 0.0 110.597 176.03 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 77.47 -22.28 2.7 Favored Glycine 0 CA--C 1.529 0.93 0 C-N-CA 123.631 0.634 . . . . 0.0 113.793 176.155 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 66.6 mt -84.72 151.86 3.76 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.215 0 CA-C-N 118.086 0.943 . . . . 0.0 108.912 172.927 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 5.1 t -159.09 79.84 0.76 Allowed 'General case' 0 N--CA 1.453 -0.312 0 CA-C-N 118.46 0.573 . . . . 0.0 110.895 -179.52 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . 0.413 ' O ' ' HE2' ' A' ' 30' ' ' LYS . . . -47.11 -51.22 14.56 Favored Glycine 0 CA--C 1.524 0.606 0 CA-C-O 118.932 -0.927 . . . . 0.0 114.059 -171.954 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 14.6 m -63.98 -49.04 74.04 Favored 'General case' 0 CA--C 1.52 -0.19 0 CA-C-N 119.044 1.422 . . . . 0.0 110.647 -175.511 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 15.2 mtm180 -70.38 -34.04 72.11 Favored 'General case' 0 C--O 1.234 0.26 0 CA-C-O 119.704 -0.189 . . . . 0.0 111.128 -176.737 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' ILE . . . . . 0.4 HG12 ' CG1' ' A' ' 68' ' ' ILE . 54.4 mt -58.73 -45.84 90.89 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.592 0 N-CA-C 108.006 -1.109 . . . . 0.0 108.006 173.133 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . 0.413 ' HE2' ' O ' ' A' ' 26' ' ' GLY . 53.1 mtmt -67.25 -23.6 65.72 Favored 'General case' 0 CA--C 1.529 0.166 0 CA-C-O 118.776 -0.63 . . . . 0.0 111.592 178.579 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . 0.541 ' HA ' ' HE2' ' A' ' 31' ' ' LYS . 8.4 mmpt? -67.85 -58.39 4.66 Favored 'General case' 0 C--N 1.342 0.25 0 CA-C-N 119.218 0.917 . . . . 0.0 110.595 178.047 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . 0.415 ' HB2' ' CE2' ' A' ' 10' ' ' PHE . 1.8 pp -74.94 -17.32 60.58 Favored 'General case' 0 CA--C 1.531 0.247 0 C-N-CA 119.286 -0.966 . . . . 0.0 111.552 -177.329 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 54.2 m -74.44 -38.13 63.1 Favored 'General case' 0 N--CA 1.455 -0.225 0 N-CA-C 109.509 -0.552 . . . . 0.0 109.509 177.211 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 98.4 m -73.15 -38.07 66.37 Favored 'General case' 0 N--CA 1.45 -0.46 0 N-CA-C 110.153 -0.314 . . . . 0.0 110.153 -178.555 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 27.3 t80 -64.23 -37.08 86.21 Favored 'General case' 0 N--CA 1.456 -0.149 0 N-CA-C 109.942 -0.392 . . . . 0.0 109.942 175.997 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -72.03 -38.63 69.51 Favored 'General case' 0 N--CA 1.448 -0.529 0 CA-C-O 119.462 -0.304 . . . . 0.0 111.429 178.081 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 9.9 mt -67.71 -36.1 80.0 Favored 'General case' 0 C--O 1.231 0.1 0 CA-C-N 118.217 0.462 . . . . 0.0 110.796 -179.757 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 42.6 t0 -71.0 -20.03 62.46 Favored 'General case' 0 N--CA 1.453 -0.291 0 C-N-CA 122.451 0.3 . . . . 0.0 111.358 177.199 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 97.9 m-70 -148.69 97.74 2.77 Favored 'General case' 0 C--N 1.339 0.125 0 C-N-CA 122.852 0.461 . . . . 0.0 111.34 -175.036 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 40' ' ' ILE . . . . . 0.563 ' H ' HD13 ' A' ' 40' ' ' ILE . 0.0 OUTLIER -76.02 -12.29 14.42 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.454 0 C-N-CA 123.205 0.602 . . . . 0.0 110.866 176.551 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 19.7 m-20 -58.56 -21.11 51.73 Favored 'General case' 0 C--N 1.339 0.111 0 C-N-CA 122.925 0.49 . . . . 0.0 112.295 -176.793 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -104.1 12.93 7.61 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.208 0 C-N-CA 123.104 0.562 . . . . 0.0 112.211 178.353 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 2.9 pp20? -50.37 -33.32 20.09 Favored 'General case' 0 CA--C 1.53 0.21 0 CA-C-N 118.587 0.631 . . . . 0.0 111.766 -179.764 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 39.5 t -62.05 -49.93 74.01 Favored 'General case' 0 C--O 1.233 0.184 0 N-CA-C 111.912 0.338 . . . . 0.0 111.912 -178.047 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . 0.497 ' HZ1' ' HB2' ' A' ' 7' ' ' PHE . 18.8 ptpt -70.98 -28.18 64.26 Favored 'General case' 0 C--N 1.339 0.128 0 O-C-N 121.85 -0.531 . . . . 0.0 109.778 -179.531 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 46' ' ' ILE . . . . . 0.412 HG12 ' CZ ' ' A' ' 10' ' ' PHE . 88.1 mt -68.7 -45.03 81.92 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.205 0 N-CA-C 110.049 -0.352 . . . . 0.0 110.049 -178.559 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 30.5 mm -62.72 -36.58 75.97 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.257 0 N-CA-C 109.024 -0.732 . . . . 0.0 109.024 177.309 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 39.4 t -64.63 -31.74 73.1 Favored 'General case' 0 CA--C 1.531 0.224 0 C-N-CA 120.984 -0.286 . . . . 0.0 111.729 179.023 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 6.7 mp -80.04 -31.97 39.5 Favored 'General case' 0 N--CA 1.451 -0.409 0 N-CA-C 113.265 0.839 . . . . 0.0 113.265 -179.698 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 12.5 pt -72.32 -38.46 61.45 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.207 0 CA-C-N 119.874 1.215 . . . . 0.0 110.708 177.558 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 24.4 pt -68.62 -35.22 69.13 Favored 'Isoleucine or valine' 0 CA--C 1.528 0.115 0 C-N-CA 120.336 -0.545 . . . . 0.0 110.032 176.981 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 21.0 t70 -59.3 -53.25 60.39 Favored 'General case' 0 C--N 1.339 0.134 0 CA-C-N 118.417 0.553 . . . . 0.0 110.053 174.858 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 53' ' ' TYR . . . . . 0.438 ' CE1' ' HG2' ' A' ' 18' ' ' LYS . 8.5 t80 -61.63 -44.53 96.81 Favored 'General case' 0 N--CA 1.451 -0.422 0 N-CA-C 109.836 -0.431 . . . . 0.0 109.836 -177.323 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 15.5 m -71.14 -23.03 62.0 Favored 'General case' 0 N--CA 1.453 -0.305 0 N-CA-C 112.196 0.443 . . . . 0.0 112.196 -175.264 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 18.4 tpp180 -84.11 -38.33 20.88 Favored 'General case' 0 N--CA 1.455 -0.216 0 CA-C-N 118.219 0.463 . . . . 0.0 110.642 179.359 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 95.9 mt -85.01 -50.01 7.82 Favored 'General case' 0 N--CA 1.452 -0.333 0 N-CA-C 113.188 0.81 . . . . 0.0 113.188 -175.884 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 5.8 p -66.33 153.87 91.71 Favored Pre-proline 0 CA--C 1.534 0.358 0 N-CA-C 113.647 0.981 . . . . 0.0 113.647 -170.39 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 67.8 Cg_endo -76.87 -170.72 0.96 Allowed 'Trans proline' 0 N--CA 1.455 -0.741 0 C-N-CA 124.837 3.691 . . . . 0.0 111.474 178.866 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 23.6 p-10 -53.82 -60.0 3.89 Favored 'General case' 0 CA--C 1.53 0.189 0 N-CA-C 114.55 1.315 . . . . 0.0 114.55 -170.732 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 22.6 t -67.64 -32.48 73.21 Favored 'General case' 0 N--CA 1.456 -0.134 0 CA-C-N 118.038 0.381 . . . . 0.0 110.947 -173.679 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 39.4 m80 -72.46 -26.55 61.86 Favored 'General case' 0 N--CA 1.453 -0.279 0 N-CA-C 110.035 -0.357 . . . . 0.0 110.035 177.131 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 17.1 ttmt -75.59 -28.52 58.96 Favored 'General case' 0 N--CA 1.451 -0.391 0 N-CA-C 110.113 -0.328 . . . . 0.0 110.113 177.041 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -65.05 -44.36 89.3 Favored 'General case' 0 N--CA 1.454 -0.227 0 N-CA-C 107.479 -1.304 . . . . 0.0 107.479 172.312 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -68.93 -25.3 75.42 Favored Glycine 0 C--N 1.34 0.758 0 N-CA-C 111.398 -0.681 . . . . 0.0 111.398 178.532 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 22.8 t -72.97 -40.32 65.42 Favored 'General case' 0 N--CA 1.452 -0.352 0 CA-C-N 117.782 0.791 . . . . 0.0 109.977 175.843 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 60.0 mt -68.57 -27.39 66.03 Favored 'General case' 0 N--CA 1.452 -0.342 0 N-CA-C 109.813 -0.44 . . . . 0.0 109.813 177.892 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 3.0 m-30 -66.01 -41.39 91.05 Favored 'General case' 0 CA--C 1.518 -0.269 0 N-CA-C 109.918 -0.401 . . . . 0.0 109.918 171.839 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 68' ' ' ILE . . . . . 0.4 ' CG1' HG12 ' A' ' 29' ' ' ILE . 21.0 mt -67.24 -45.32 86.49 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.585 0 N-CA-C 109.261 -0.644 . . . . 0.0 109.261 178.539 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 86.9 mt -58.87 -36.01 59.2 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.321 0 C-N-CA 123.273 0.629 . . . . 0.0 111.62 178.595 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 28.2 t70 -72.58 -40.82 66.29 Favored 'General case' 0 CA--C 1.517 -0.302 0 CA-C-N 119.015 0.825 . . . . 0.0 109.309 174.007 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 42.3 m -59.58 -66.63 0.48 Allowed 'General case' 0 N--CA 1.448 -0.547 0 N-CA-C 108.926 -0.768 . . . . 0.0 108.926 -178.36 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -73.98 -44.4 50.86 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.363 0 CA-C-N 117.845 0.293 . . . . 0.0 111.014 -176.372 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -72.22 -49.8 19.55 Favored Glycine 0 CA--C 1.521 0.446 0 N-CA-C 112.418 -0.273 . . . . 0.0 112.418 -171.207 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 7.8 tmm_? -79.38 -30.26 42.46 Favored 'General case' 0 N--CA 1.445 -0.711 0 C-N-CA 119.814 -0.754 . . . . 0.0 110.256 -176.95 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -70.36 -25.54 63.32 Favored 'General case' 0 C--N 1.342 0.268 0 C-N-CA 118.646 -1.222 . . . . 0.0 109.795 173.458 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 1.4 m-30 -64.84 -49.3 71.15 Favored 'General case' 0 CA--C 1.515 -0.373 0 CA-C-N 118.75 0.704 . . . . 0.0 109.811 175.023 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 2.2 tm? -66.2 -43.95 85.33 Favored 'General case' 0 N--CA 1.447 -0.587 0 C-N-CA 118.219 -1.393 . . . . 0.0 108.711 -178.892 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 88.2 m-20 -59.3 -46.27 89.02 Favored 'General case' 0 CA--C 1.529 0.171 0 N-CA-C 112.318 0.488 . . . . 0.0 112.318 178.895 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 15.1 tm-20 -67.44 -48.89 65.91 Favored 'General case' 0 N--CA 1.45 -0.428 0 CA-C-N 118.34 0.518 . . . . 0.0 112.034 -178.081 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 64.4 p -64.57 -26.98 68.65 Favored 'General case' 0 N--CA 1.456 -0.147 0 CA-C-N 117.709 0.232 . . . . 0.0 111.312 179.965 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 11.9 ttm105 -75.5 -30.73 59.94 Favored 'General case' 0 N--CA 1.451 -0.392 0 CA-C-N 117.757 0.253 . . . . 0.0 110.341 175.383 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 35.3 t -80.45 -38.01 30.83 Favored 'General case' 0 N--CA 1.455 -0.207 0 N-CA-C 112.408 0.521 . . . . 0.0 112.408 179.702 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 9.1 m-20 -134.06 147.87 50.97 Favored 'General case' 0 N--CA 1.454 -0.227 0 CA-C-O 120.742 0.306 . . . . 0.0 111.732 -170.405 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 77.9 p -86.29 119.8 26.95 Favored 'General case' 0 N--CA 1.454 -0.274 0 N-CA-C 109.72 -0.474 . . . . 0.0 109.72 177.719 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 22.9 p30 -156.55 26.58 0.34 Allowed 'General case' 0 N--CA 1.456 -0.16 0 C-N-CA 122.928 0.491 . . . . 0.0 110.662 179.964 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 20.9 m -60.76 144.34 52.59 Favored 'General case' 0 N--CA 1.452 -0.326 0 C-N-CA 122.719 0.407 . . . . 0.0 112.067 -175.05 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 87' ' ' SER . . . . . 0.402 ' H ' ' CG2' ' A' ' 93' ' ' THR . 90.6 p -78.32 172.98 12.8 Favored 'General case' 0 N--CA 1.451 -0.386 0 C-N-CA 123.475 0.71 . . . . 0.0 110.146 177.624 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 67.7 p -76.68 2.89 12.89 Favored 'General case' 0 CA--C 1.53 0.204 0 C-N-CA 123.389 0.676 . . . . 0.0 112.293 179.509 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 10.4 m120 -147.8 179.62 7.57 Favored 'General case' 0 N--CA 1.456 -0.165 0 CA-C-N 118.367 0.53 . . . . 0.0 110.113 -174.624 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 90' ' ' LYS . . . . . 0.416 ' N ' ' HD2' ' A' ' 91' ' ' PRO . 60.5 tttm -64.79 -51.01 60.68 Favored Pre-proline 0 CA--C 1.535 0.38 0 CA-C-O 118.716 -0.659 . . . . 0.0 111.582 177.878 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 91' ' ' PRO . . . . . 0.416 ' HD2' ' N ' ' A' ' 90' ' ' LYS . 73.5 Cg_endo -68.4 161.03 46.61 Favored 'Trans proline' 0 N--CA 1.455 -0.775 0 C-N-CA 122.46 2.107 . . . . 0.0 110.237 174.771 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 89.7 19.48 47.98 Favored Glycine 0 CA--C 1.527 0.79 0 CA-C-O 119.362 -0.688 . . . . 0.0 112.242 179.925 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 93' ' ' THR . . . . . 0.402 ' CG2' ' H ' ' A' ' 87' ' ' SER . 20.3 p -153.16 168.87 24.49 Favored 'General case' 0 CA--C 1.521 -0.162 0 CA-C-N 117.89 0.845 . . . . 0.0 110.75 178.052 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 94' ' ' CYS . . . . . . . . . . . . . 29.5 p -57.94 -23.67 54.56 Favored 'General case' 0 N--CA 1.449 -0.515 0 CA-C-N 115.698 -0.683 . . . . 0.0 110.176 174.402 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -58.95 -57.85 11.23 Favored 'General case' 0 N--CA 1.451 -0.42 0 N-CA-C 109.361 -0.607 . . . . 0.0 109.361 -177.339 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 62.2 t60 -75.74 -32.01 59.81 Favored 'General case' 0 N--CA 1.451 -0.376 0 C-N-CA 121.094 -0.242 . . . . 0.0 111.639 -179.506 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -65.36 -48.88 71.42 Favored 'General case' 0 N--CA 1.45 -0.457 0 O-C-N 122.959 0.162 . . . . 0.0 111.053 -178.895 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 1.8 mp -74.44 -27.71 21.63 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.162 0 CA-C-O 119.507 -0.282 . . . . 0.0 110.583 -179.886 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 3.9 m120 -64.23 -48.9 74.05 Favored 'General case' 0 N--CA 1.452 -0.339 0 CA-C-N 118.605 0.639 . . . . 0.0 110.163 173.902 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 26.4 m -74.64 -27.52 60.48 Favored 'General case' 0 N--CA 1.456 -0.164 0 N-CA-C 110.553 -0.166 . . . . 0.0 110.553 -175.947 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 57.0 tp -75.46 -47.97 24.79 Favored 'General case' 0 N--CA 1.448 -0.534 0 N-CA-C 110.272 -0.27 . . . . 0.0 110.272 177.027 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -65.81 -14.48 60.84 Favored Glycine 0 CA--C 1.528 0.846 0 CA-C-O 119.521 -0.6 . . . . 0.0 113.063 -173.33 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 24.2 pt-20 -95.98 -7.51 36.25 Favored 'General case' 0 CA--C 1.531 0.229 0 CA-C-N 118.297 1.049 . . . . 0.0 112.5 -178.482 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 27.3 m -129.97 -14.3 2.12 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.147 0 CA-C-N 118.542 0.61 . . . . 0.0 112.264 176.911 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 105' ' ' ILE . . . . . . . . . . . . . 9.7 tp -61.24 -22.62 27.86 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.137 0 CA-C-N 118.473 0.579 . . . . 0.0 110.7 -179.938 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 22.9 pt20 -64.79 -33.06 75.08 Favored 'General case' 0 N--CA 1.452 -0.359 0 C-N-CA 122.912 0.485 . . . . 0.0 110.445 177.145 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 82.9 mt-10 -75.61 -36.04 60.37 Favored 'General case' 0 N--CA 1.455 -0.218 0 CA-C-O 120.769 0.319 . . . . 0.0 110.171 177.991 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 50.2 mt -75.37 -37.42 60.61 Favored 'General case' 0 N--CA 1.448 -0.549 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.925 -177.359 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 67.0 mt -69.55 -57.13 5.59 Favored 'General case' 0 N--CA 1.452 -0.361 0 N-CA-C 109.909 -0.404 . . . . 0.0 109.909 177.377 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 6.4 p -46.07 -53.35 10.39 Favored 'General case' 0 CA--C 1.522 -0.121 0 C-N-CA 122.606 0.362 . . . . 0.0 111.434 179.294 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 34.4 t0 -61.66 -43.74 98.29 Favored 'General case' 0 N--CA 1.443 -0.784 0 N-CA-C 109.987 -0.375 . . . . 0.0 109.987 -179.954 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -65.6 -32.92 74.76 Favored 'General case' 0 N--CA 1.446 -0.636 0 C-N-CA 120.038 -0.665 . . . . 0.0 110.895 -176.984 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 113' ' ' ILE . . . . . . . . . . . . . 27.8 mm -68.28 -41.55 83.83 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.115 0 CA-C-N 118.984 0.811 . . . . 0.0 109.944 179.931 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -75.95 -39.39 56.15 Favored 'General case' 0 N--CA 1.454 -0.268 0 N-CA-C 112.033 0.383 . . . . 0.0 112.033 -179.711 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 1.3 tppp? -77.13 -33.03 56.8 Favored 'General case' 0 N--CA 1.449 -0.477 0 C-N-CA 123.966 0.906 . . . . 0.0 113.148 -175.086 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 116' ' ' SER . . . . . 0.466 ' HB2' ' CB ' ' A' ' 120' ' ' HIS . 51.7 p -84.89 160.68 20.1 Favored 'General case' 0 CA--C 1.53 0.2 0 N-CA-C 111.952 0.353 . . . . 0.0 111.952 -174.082 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 48.9 t30 -80.03 167.71 20.09 Favored 'General case' 0 CA--C 1.534 0.349 0 C-N-CA 122.901 0.48 . . . . 0.0 110.445 -179.618 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 118' ' ' GLN . . . . . . . . . . . . . 24.6 mm100 -52.64 -42.83 65.01 Favored 'General case' 0 CA--C 1.529 0.144 0 N-CA-C 112.954 0.724 . . . . 0.0 112.954 -173.047 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 11.1 p-10 -66.39 -35.71 81.01 Favored 'General case' 0 N--CA 1.456 -0.165 0 N-CA-C 110.223 -0.288 . . . . 0.0 110.223 179.296 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 120' ' ' HIS . . . . . 0.466 ' CB ' ' HB2' ' A' ' 116' ' ' SER . 25.6 m170 -68.98 -41.65 77.6 Favored 'General case' 0 N--CA 1.451 -0.423 0 CA-C-N 116.416 -0.357 . . . . 0.0 110.092 177.351 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 45.9 mttm -58.57 -39.24 79.74 Favored 'General case' 0 C--N 1.34 0.184 0 N-CA-C 109.371 -0.603 . . . . 0.0 109.371 178.813 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 1.8 tm-20 -65.51 -46.0 81.34 Favored 'General case' 0 N--CA 1.452 -0.331 0 C-N-CA 122.885 0.474 . . . . 0.0 110.756 -179.115 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 62.8 mttp -66.3 -31.45 72.25 Favored 'General case' 0 N--CA 1.455 -0.215 0 CA-C-N 117.741 0.246 . . . . 0.0 111.31 -179.782 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 124' ' ' ILE . . . . . . . . . . . . . 61.7 mt -74.59 -32.94 30.77 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.239 0 O-C-N 121.952 -0.468 . . . . 0.0 109.9 176.473 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -71.7 -36.86 70.68 Favored 'General case' 0 N--CA 1.455 -0.209 0 CA-C-O 119.163 -0.446 . . . . 0.0 111.492 179.032 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 126' ' ' MET . . . . . . . . . . . . . 28.2 ptm -68.14 -32.68 73.12 Favored 'General case' 0 CA--C 1.53 0.184 0 C-N-CA 119.148 -1.021 . . . . 0.0 109.243 174.648 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 4.0 mp -65.24 -32.73 74.55 Favored 'General case' 0 C--N 1.342 0.247 0 CA-C-O 119.474 -0.298 . . . . 0.0 110.321 171.926 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 44.2 tp -68.24 -43.09 78.68 Favored 'General case' 0 N--CA 1.455 -0.208 0 CA-C-N 118.165 0.439 . . . . 0.0 109.83 179.098 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 35.6 m-20 -60.06 -41.54 92.57 Favored 'General case' 0 N--CA 1.455 -0.208 0 N-CA-C 109.889 -0.411 . . . . 0.0 109.889 176.511 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 130' ' ' ILE . . . . . 0.456 ' HA ' ' HD3' ' A' ' 133' ' ' ARG . 65.0 mt -63.26 -36.7 77.12 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.273 0 N-CA-C 109.989 -0.374 . . . . 0.0 109.989 179.116 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 131' ' ' TRP . . . . . . . . . . . . . 42.2 m0 -75.8 -30.77 59.17 Favored 'General case' 0 N--CA 1.451 -0.406 0 N-CA-C 112.589 0.589 . . . . 0.0 112.589 -179.382 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 70.7 m-20 -70.31 -30.15 67.07 Favored 'General case' 0 CA--C 1.533 0.318 0 CA-C-N 118.443 0.565 . . . . 0.0 109.928 175.861 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 133' ' ' ARG . . . . . 0.456 ' HD3' ' HA ' ' A' ' 130' ' ' ILE . 21.9 mtp180 -75.49 -35.16 60.87 Favored 'General case' 0 N--CA 1.454 -0.23 0 C-N-CA 123.68 0.792 . . . . 0.0 111.628 178.587 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 46.0 t -73.14 -19.0 61.22 Favored 'General case' 0 N--CA 1.454 -0.242 0 N-CA-C 111.794 0.294 . . . . 0.0 111.794 -176.992 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 135' ' ' GLY . . . . . . . . . . . . . . . 93.5 15.3 50.91 Favored Glycine 0 CA--C 1.529 0.907 0 N-CA-C 111.965 -0.454 . . . . 0.0 111.965 -178.381 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 136' ' ' LEU . . . . . . . . . . . . . 86.5 mt -69.34 172.5 6.98 Favored 'General case' 0 CA--C 1.532 0.284 0 CA-C-N 117.373 0.587 . . . . 0.0 110.09 176.808 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 137' ' ' PHE . . . . . 0.429 ' C ' ' H ' ' A' ' 139' ' ' LYS . 63.7 m-85 -127.1 39.84 3.83 Favored 'General case' 0 C--O 1.232 0.163 0 N-CA-C 112.711 0.634 . . . . 0.0 112.711 -172.604 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 138' ' ' GLN . . . . . 0.469 ' CD ' ' H ' ' A' ' 138' ' ' GLN . 7.9 pm0 -66.5 17.13 0.02 OUTLIER 'General case' 0 CA--C 1.534 0.346 0 C-N-CA 124.631 1.172 . . . . 0.0 113.637 178.36 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 139' ' ' LYS . . . . . 0.429 ' H ' ' C ' ' A' ' 137' ' ' PHE . 43.0 mmtm 56.35 41.91 28.41 Favored 'General case' 0 N--CA 1.456 -0.155 0 C-N-CA 123.466 0.707 . . . . 0.0 112.343 176.974 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 140' ' ' SER . . . . . . . . . . . . . 17.2 m -56.0 -19.35 12.25 Favored 'General case' 0 CA--C 1.528 0.119 0 C-N-CA 122.927 0.491 . . . . 0.0 112.076 -179.631 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 141' ' ' TYR . . . . . . . . . . . . . 54.5 m-85 -79.87 -8.46 59.31 Favored 'General case' 0 N--CA 1.453 -0.287 0 C-N-CA 122.83 0.452 . . . . 0.0 112.061 179.73 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 142' ' ' LEU . . . . . 0.511 ' HG ' ' H ' ' A' ' 144' ' ' ALA . 48.1 tp -87.2 144.35 26.87 Favored 'General case' 0 N--CA 1.455 -0.217 0 CA-C-N 118.398 0.544 . . . . 0.0 110.538 -177.924 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 84.4 m-20 -66.55 -15.25 63.27 Favored 'General case' 0 N--CA 1.456 -0.151 0 N-CA-C 111.806 0.298 . . . . 0.0 111.806 -178.316 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 144' ' ' ALA . . . . . 0.511 ' H ' ' HG ' ' A' ' 142' ' ' LEU . . . -67.51 -34.21 76.65 Favored 'General case' 0 N--CA 1.452 -0.368 0 CA-C-N 117.737 0.244 . . . . 0.0 110.675 -179.096 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 145' ' ' ILE . . . . . . . . . . . . . 13.2 mm -75.33 -29.71 21.7 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.298 0 CA-C-N 117.677 0.217 . . . . 0.0 110.797 -179.738 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 146' ' ' ARG . . . . . . . . . . . . . 49.1 mtm-85 -74.91 -39.89 61.18 Favored 'General case' 0 N--CA 1.455 -0.193 0 N-CA-C 109.51 -0.552 . . . . 0.0 109.51 176.545 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 147' ' ' SER . . . . . . . . . . . . . 46.9 t 55.69 44.96 25.51 Favored 'General case' 0 N--CA 1.456 -0.149 0 C-N-CA 124.083 0.953 . . . . 0.0 112.105 172.642 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 148' ' ' LYS . . . . . 0.51 ' HE2' ' HA ' ' A' ' 148' ' ' LYS . 7.1 mmpt? -60.86 -14.27 20.97 Favored 'General case' 0 N--CA 1.454 -0.237 0 C-N-CA 123.552 0.741 . . . . 0.0 112.131 -178.139 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 149' ' ' CYS . . . . . . . . . . . . . 59.4 m -60.21 -31.69 70.4 Favored 'General case' 0 N--CA 1.452 -0.359 0 CA-C-N 118.252 0.478 . . . . 0.0 110.15 177.978 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 150' ' ' PHE . . . . . . . . . . . . . 52.0 t80 -66.44 -32.61 74.08 Favored 'General case' 0 N--CA 1.453 -0.282 0 N-CA-C 110.062 -0.348 . . . . 0.0 110.062 178.538 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 151' ' ' ALA . . . . . . . . . . . . . . . -75.75 -25.71 56.76 Favored 'General case' 0 N--CA 1.453 -0.314 0 C-N-CA 122.426 0.29 . . . . 0.0 111.022 179.272 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 152' ' ' MET . . . . . . . . . . . . . 97.1 mmm -76.48 -31.84 57.99 Favored 'General case' 0 N--CA 1.455 -0.188 0 N-CA-C 110.165 -0.309 . . . . 0.0 110.165 173.954 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 153' ' ' ASP . . . . . . . . . . . . . 74.4 m-20 -75.97 -46.32 30.29 Favored 'General case' 0 N--CA 1.453 -0.286 0 C-N-CA 123.143 0.577 . . . . 0.0 111.971 178.752 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 154' ' ' LEU . . . . . . . . . . . . . 48.7 mt -142.81 161.94 36.77 Favored 'General case' 0 N--CA 1.457 -0.1 0 C-N-CA 123.722 0.809 . . . . 0.0 110.063 -177.643 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 155' ' ' GLU . . . . . . . . . . . . . 20.3 pt-20 -70.88 162.2 29.68 Favored 'General case' 0 N--CA 1.454 -0.226 0 N-CA-C 109.756 -0.461 . . . . 0.0 109.756 176.501 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 156' ' ' HIS . . . . . . . . . . . . . 56.8 p-80 -137.34 16.67 2.96 Favored 'General case' 0 CA--C 1.529 0.169 0 N-CA-C 111.787 0.291 . . . . 0.0 111.787 -176.208 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 157' ' ' HIS . . . . . . . . . . . . . 69.0 m-70 -72.87 -12.14 60.86 Favored 'General case' 0 CA--C 1.53 0.206 0 N-CA-C 112.104 0.409 . . . . 0.0 112.104 -177.414 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 158' ' ' HIS . . . . . . . . . . . . . 90.3 m-70 -84.67 163.73 19.05 Favored 'General case' 0 C--O 1.231 0.103 0 C-N-CA 122.989 0.515 . . . . 0.0 111.398 -179.193 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 159' ' ' HIS . . . . . . . . . . . . . 20.5 t-160 . . . . . 0 C--O 1.249 1.032 0 CA-C-O 116.776 -1.583 . . . . 0.0 109.561 179.741 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' B' B 2052 ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 N--CA 1.473 0.703 0 CA-C-O 120.565 0.221 . . . . 0.0 110.448 . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B 2053 ' ' ASP . . . . . . . . . . . . . 17.4 p-10 -80.62 31.51 0.3 Allowed 'General case' 0 CA--C 1.533 0.31 0 C-N-CA 125.217 1.407 . . . . 0.0 111.065 178.273 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B 2054 ' ' ASP . . . . . . . . . . . . . 29.8 t0 -152.62 -177.12 6.04 Favored 'General case' 0 N--CA 1.454 -0.27 0 N-CA-C 109.337 -0.616 . . . . 0.0 109.337 -175.622 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B 2055 ' ' GLU . . . . . . . . . . . . . 85.3 mt-10 -59.16 -23.38 62.15 Favored 'General case' 0 N--CA 1.454 -0.234 0 C-N-CA 123.749 0.82 . . . . 0.0 111.213 179.308 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B 2056 ' ' ASP . . . . . . . . . . . . . 10.6 m-20 48.12 16.67 0.09 Allowed 'General case' 0 C--N 1.341 0.226 0 C-N-CA 124.882 1.273 . . . . 0.0 113.777 -176.105 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B 2057 ' ' ASP . . . . . . . . . . . . . 35.0 t0 -154.0 169.27 23.91 Favored 'General case' 0 N--CA 1.447 -0.588 0 N-CA-C 109.171 -0.677 . . . . 0.0 109.171 174.684 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B 2058 ' ' TYR . . . . . . . . . . . . . 0.9 OUTLIER -153.97 136.61 15.18 Favored 'General case' 0 N--CA 1.452 -0.367 0 N-CA-C 108.714 -0.847 . . . . 0.0 108.714 -178.841 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B 2059 ' ' THR . . . . . . . . . . . . . 63.5 m -108.16 106.71 59.15 Favored Pre-proline 0 N--CA 1.452 -0.349 0 C-N-CA 123.192 0.597 . . . . 0.0 109.48 -178.461 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B 2060 ' ' PRO . . . . . . . . . . . . . 24.0 Cg_exo -65.87 164.62 26.42 Favored 'Trans proline' 0 N--CA 1.451 -0.971 0 C-N-CA 123.242 2.628 . . . . 0.0 112.055 177.42 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B 2061 ' ' SER . . . . . . . . . . . . . 93.7 p -150.29 137.96 19.9 Favored 'General case' 0 N--CA 1.451 -0.414 0 N-CA-C 108.696 -0.853 . . . . 0.0 108.696 173.082 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B 2062 ' ' ILE . . . . . . . . . . . . . 13.7 tt -167.27 150.27 1.46 Allowed 'Isoleucine or valine' 0 N--CA 1.454 -0.253 0 C-N-CA 123.424 0.69 . . . . 0.0 109.296 -178.777 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B 2063 ' ' SER . . . . . . . . . . . . . 42.9 t . . . . . 0 C--O 1.25 1.107 0 CA-C-O 116.938 -1.506 . . . . 0.0 111.149 176.913 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 49.6 tpp . . . . . 0 N--CA 1.472 0.63 0 N-CA-C 110.28 -0.267 . . . . 0.0 110.28 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 12.6 pt20 53.4 24.86 4.18 Favored 'General case' 0 CA--C 1.529 0.166 0 C-N-CA 125.583 1.553 . . . . 0.0 113.49 176.517 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 20.9 pt20 -143.87 28.2 1.43 Allowed 'General case' 0 CA--C 1.532 0.252 0 C-N-CA 122.992 0.517 . . . . 0.0 110.01 177.077 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 51.8 m-20 58.38 16.37 4.06 Favored 'General case' 0 C--N 1.338 0.079 0 C-N-CA 125.617 1.567 . . . . 0.0 115.049 179.003 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 40.1 p-10 -88.66 -5.23 58.27 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 122.161 0.982 . . . . 0.0 109.8 171.646 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 3.8 p30 -97.12 -33.72 11.41 Favored 'General case' 0 N--CA 1.447 -0.607 0 CA-C-N 113.848 -1.524 . . . . 0.0 107.13 175.669 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' PHE . . . . . 0.657 ' HB2' ' HZ2' ' A' ' 45' ' ' LYS . 1.3 t80 -62.55 -34.21 76.49 Favored 'General case' 0 N--CA 1.45 -0.475 0 C-N-CA 124.482 1.113 . . . . 0.0 108.998 172.657 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 51.5 tp60 -49.64 -36.37 24.33 Favored 'General case' 0 N--CA 1.453 -0.281 0 C-N-CA 124.953 1.301 . . . . 0.0 112.167 -177.481 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 22.9 m-80 -71.8 -34.48 69.41 Favored 'General case' 0 N--CA 1.454 -0.264 0 CA-C-O 120.801 0.334 . . . . 0.0 110.176 -179.524 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' PHE . . . . . 0.438 ' CZ ' HG12 ' A' ' 46' ' ' ILE . 1.6 t80 -70.98 -39.57 72.43 Favored 'General case' 0 N--CA 1.45 -0.45 0 C-N-CA 123.787 0.835 . . . . 0.0 109.107 177.451 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 95.2 t -66.42 -52.21 49.3 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.353 0 N-CA-C 109.164 -0.68 . . . . 0.0 109.164 178.666 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -59.12 -31.16 68.68 Favored 'General case' 0 N--CA 1.451 -0.389 0 C-N-CA 122.428 0.291 . . . . 0.0 111.486 -178.86 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 78.6 m -69.88 -37.45 76.05 Favored 'General case' 0 CA--C 1.531 0.214 0 N-CA-C 108.753 -0.832 . . . . 0.0 108.753 176.061 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . 0.476 ' HA ' ' CD1' ' A' ' 17' ' ' PHE . 6.2 tp -66.73 -41.43 87.89 Favored 'General case' 0 N--CA 1.455 -0.203 0 CA-C-O 121.485 0.66 . . . . 0.0 110.488 178.742 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . 0.419 ' CD ' ' HZ2' ' A' ' 18' ' ' LYS . 63.3 mm-40 -64.82 -27.79 69.12 Favored 'General case' 0 N--CA 1.451 -0.417 0 C-N-CA 123.698 0.799 . . . . 0.0 109.08 178.027 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 5.3 p -71.75 -29.3 64.35 Favored 'General case' 0 N--CA 1.452 -0.346 0 N-CA-C 109.966 -0.383 . . . . 0.0 109.966 177.596 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' PHE . . . . . 0.476 ' CD1' ' HA ' ' A' ' 14' ' ' LEU . 24.3 m-85 -68.85 -34.32 75.27 Favored 'General case' 0 N--CA 1.457 -0.124 0 C-N-CA 119.718 -0.793 . . . . 0.0 110.395 171.536 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . 0.433 ' HA ' ' CE1' ' A' ' 61' ' ' HIS . 55.1 mttt -65.76 -26.3 67.66 Favored 'General case' 0 C--N 1.338 0.103 0 C-N-CA 120.395 -0.522 . . . . 0.0 110.153 176.112 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 40.3 t0 -73.48 -43.73 59.54 Favored 'General case' 0 CA--C 1.532 0.26 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.637 177.137 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 87.6 mt -65.12 146.66 54.69 Favored 'General case' 0 N--CA 1.456 -0.148 0 O-C-N 121.862 -0.524 . . . . 0.0 110.001 179.546 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -81.54 -32.5 32.25 Favored 'General case' 0 C--N 1.334 -0.076 0 N-CA-C 109.737 -0.468 . . . . 0.0 109.737 -179.916 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' SER . . . . . 0.433 ' C ' ' H ' ' A' ' 24' ' ' ILE . 14.1 m -79.22 -21.55 46.1 Favored 'General case' 0 N--CA 1.453 -0.289 0 C-N-CA 123.166 0.586 . . . . 0.0 110.738 175.487 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 72.74 -26.93 0.75 Allowed Glycine 0 CA--C 1.527 0.826 0 C-N-CA 124.578 1.085 . . . . 0.0 112.328 -178.792 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . 0.433 ' H ' ' C ' ' A' ' 22' ' ' SER . 74.3 mt -81.61 147.37 6.23 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.441 0 C-N-CA 123.396 0.678 . . . . 0.0 110.413 178.916 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 37.8 t -165.67 97.4 0.66 Allowed 'General case' 0 CA--C 1.517 -0.305 0 N-CA-C 108.42 -0.956 . . . . 0.0 108.42 173.606 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . 0.434 ' O ' ' HE2' ' A' ' 30' ' ' LYS . . . -55.84 -36.83 67.35 Favored Glycine 0 CA--C 1.527 0.796 0 N-CA-C 110.313 -1.115 . . . . 0.0 110.313 -176.497 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' SER . . . . . 0.452 ' H ' ' HB3' ' B' 2055 ' ' GLU . 88.5 p -62.27 -51.76 66.41 Favored 'General case' 0 N--CA 1.454 -0.274 0 CA-C-N 117.502 0.651 . . . . 0.0 110.123 -177.817 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 83.7 mtt180 -70.86 -40.97 72.0 Favored 'General case' 0 N--CA 1.455 -0.188 0 C-N-CA 123.626 0.77 . . . . 0.0 110.737 -178.71 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 64.0 mt -56.43 -42.01 73.74 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.707 0 N-CA-C 109.101 -0.703 . . . . 0.0 109.101 174.861 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . 0.434 ' HE2' ' O ' ' A' ' 26' ' ' GLY . 48.8 mtmt -67.81 -26.88 66.29 Favored 'General case' 0 C--N 1.34 0.194 0 CA-C-O 118.79 -0.624 . . . . 0.0 111.385 177.554 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . 0.438 ' HE3' ' HA ' ' A' ' 31' ' ' LYS . 0.0 OUTLIER -63.93 -56.56 14.32 Favored 'General case' 0 C--N 1.339 0.112 0 CA-C-N 119.187 0.903 . . . . 0.0 110.146 176.568 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 3.3 pp -75.21 -20.63 59.17 Favored 'General case' 0 CA--C 1.531 0.222 0 C-N-CA 119.662 -0.815 . . . . 0.0 111.419 -177.532 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 31.3 m -69.8 -41.68 74.71 Favored 'General case' 0 C--O 1.231 0.107 0 N-CA-C 108.28 -1.007 . . . . 0.0 108.28 175.96 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 97.5 m -68.44 -41.82 79.75 Favored 'General case' 0 N--CA 1.45 -0.46 0 N-CA-C 109.876 -0.416 . . . . 0.0 109.876 -178.751 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 52.7 t80 -62.89 -32.12 73.32 Favored 'General case' 0 C--N 1.337 0.046 0 N-CA-C 109.972 -0.381 . . . . 0.0 109.972 177.475 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -72.97 -28.72 62.57 Favored 'General case' 0 N--CA 1.447 -0.62 0 CA-C-O 119.491 -0.29 . . . . 0.0 111.061 178.999 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 2.2 mm? -79.78 -33.93 40.14 Favored 'General case' 0 CA--C 1.519 -0.224 0 N-CA-C 109.009 -0.737 . . . . 0.0 109.009 -178.371 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 81.2 m-20 -66.32 -17.25 64.65 Favored 'General case' 0 N--CA 1.443 -0.818 0 C-N-CA 123.892 0.877 . . . . 0.0 111.188 173.966 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 96.5 m-70 -152.52 90.78 1.52 Allowed 'General case' 0 N--CA 1.453 -0.286 0 C-N-CA 123.904 0.882 . . . . 0.0 110.681 -176.87 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 40' ' ' ILE . . . . . 0.497 ' H ' HD11 ' A' ' 40' ' ' ILE . 0.0 OUTLIER -71.23 -18.39 20.4 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.29 0 CA-C-N 119.235 0.925 . . . . 0.0 108.526 172.374 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 7.7 m-20 -44.84 -41.78 7.36 Favored 'General case' 0 N--CA 1.455 -0.212 0 C-N-CA 125.817 1.647 . . . . 0.0 112.806 -179.525 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 1.4 pp -101.07 16.73 4.14 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.57 0 C-N-CA 124.151 0.98 . . . . 0.0 111.742 -173.283 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 3.0 pp20? -52.97 -32.96 48.95 Favored 'General case' 0 CA--C 1.529 0.14 0 O-C-N 122.076 -0.39 . . . . 0.0 111.205 176.759 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 47.8 t -59.71 -46.14 90.0 Favored 'General case' 0 CA--C 1.53 0.211 0 O-C-N 122.273 -0.267 . . . . 0.0 111.654 -177.326 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . 0.657 ' HZ2' ' HB2' ' A' ' 7' ' ' PHE . 18.4 ptpt -75.09 -23.03 57.91 Favored 'General case' 0 C--N 1.341 0.223 0 C-N-CA 121.006 -0.278 . . . . 0.0 110.547 179.434 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 46' ' ' ILE . . . . . 0.438 HG12 ' CZ ' ' A' ' 10' ' ' PHE . 77.0 mt -73.88 -50.13 30.67 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.253 0 N-CA-C 110.18 -0.304 . . . . 0.0 110.18 -179.92 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 46.0 mm -67.32 -37.25 78.69 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.431 0 O-C-N 123.357 0.41 . . . . 0.0 110.364 -177.302 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 22.6 t -67.5 -39.7 85.19 Favored 'General case' 0 N--CA 1.452 -0.346 0 C-N-CA 119.351 -0.94 . . . . 0.0 109.818 176.939 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 53.4 tp -69.33 -35.48 75.98 Favored 'General case' 0 N--CA 1.449 -0.507 0 CA-C-O 119.162 -0.447 . . . . 0.0 111.832 -174.444 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 3.9 pt -72.07 -44.68 65.36 Favored 'Isoleucine or valine' 0 C--N 1.34 0.163 0 CA-C-N 118.834 0.743 . . . . 0.0 110.855 178.032 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 30.9 pt -66.16 -39.06 83.35 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.141 0 C-N-CA 119.559 -0.856 . . . . 0.0 111.064 179.628 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 88.9 m-20 -64.86 -45.21 87.01 Favored 'General case' 0 N--CA 1.452 -0.338 0 CA-C-N 117.958 0.344 . . . . 0.0 110.749 178.959 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 3.2 t80 -65.04 -34.79 79.27 Favored 'General case' 0 N--CA 1.456 -0.16 0 N-CA-C 109.326 -0.62 . . . . 0.0 109.326 175.867 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 28.7 t -62.37 -34.72 77.24 Favored 'General case' 0 N--CA 1.454 -0.261 0 CA-C-N 117.878 0.308 . . . . 0.0 111.082 -178.692 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . 0.415 ' NE ' ' HA ' ' A' ' 55' ' ' ARG . 11.8 mmp_? -75.42 -46.41 32.94 Favored 'General case' 0 C--N 1.34 0.183 0 CA-C-N 118.489 0.586 . . . . 0.0 111.525 177.709 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 30.5 mt -75.23 -41.25 57.98 Favored 'General case' 0 C--O 1.227 -0.085 0 N-CA-C 112.92 0.711 . . . . 0.0 112.92 -173.253 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 13.2 p -63.66 155.53 75.93 Favored Pre-proline 0 CA--C 1.535 0.391 0 N-CA-C 112.607 0.595 . . . . 0.0 112.607 -174.857 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 87.2 Cg_endo -74.57 173.04 15.0 Favored 'Trans proline' 0 N--CA 1.453 -0.876 0 C-N-CA 124.746 3.631 . . . . 0.0 111.668 -179.433 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -46.57 -52.8 12.71 Favored 'General case' 0 N--CA 1.452 -0.328 0 C-N-CA 125.407 1.483 . . . . 0.0 113.952 -170.744 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 95.1 p -68.14 -31.86 71.74 Favored 'General case' 0 N--CA 1.457 -0.089 0 O-C-N 121.915 -0.491 . . . . 0.0 110.111 -177.154 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 61' ' ' HIS . . . . . 0.433 ' CE1' ' HA ' ' A' ' 18' ' ' LYS . 37.0 m170 -75.34 -24.93 57.43 Favored 'General case' 0 N--CA 1.45 -0.431 0 N-CA-C 109.923 -0.399 . . . . 0.0 109.923 179.395 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 67.7 mttm -67.05 -40.4 87.14 Favored 'General case' 0 C--N 1.34 0.184 0 N-CA-C 109.246 -0.65 . . . . 0.0 109.246 173.292 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -60.79 -40.8 93.97 Favored 'General case' 0 CA--C 1.533 0.29 0 N-CA-C 108.458 -0.941 . . . . 0.0 108.458 175.548 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -67.62 -30.58 74.94 Favored Glycine 0 CA--C 1.528 0.876 0 N-CA-C 111.727 -0.549 . . . . 0.0 111.727 178.442 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 35.6 p -66.94 -35.12 79.27 Favored 'General case' 0 N--CA 1.456 -0.153 0 CA-C-N 117.805 0.803 . . . . 0.0 109.637 178.217 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 43.0 mt -73.94 -30.51 62.59 Favored 'General case' 0 N--CA 1.453 -0.277 0 C-N-CA 122.346 0.258 . . . . 0.0 110.579 177.424 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 2.6 m-85 -68.93 -36.44 77.97 Favored 'General case' 0 CA--C 1.518 -0.265 0 CA-C-N 117.75 0.25 . . . . 0.0 110.776 176.577 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 68' ' ' ILE . . . . . . . . . . . . . 16.3 mt -69.51 -51.52 41.15 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.484 0 C-N-CA 119.631 -0.827 . . . . 0.0 108.776 178.536 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 77.2 mt -48.47 -37.45 7.98 Favored 'Isoleucine or valine' 0 C--N 1.341 0.224 0 O-C-N 123.574 0.546 . . . . 0.0 111.161 172.355 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 19.9 t70 -70.9 -48.16 55.23 Favored 'General case' 0 C--O 1.233 0.202 0 CA-C-N 118.863 0.756 . . . . 0.0 111.096 179.418 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 30.8 t -65.11 -51.45 61.25 Favored 'General case' 0 N--CA 1.451 -0.404 0 C-N-CA 122.447 0.299 . . . . 0.0 111.251 -176.4 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 72' ' ' ILE . . . . . 0.422 HD13 ' CZ ' ' A' ' 76' ' ' TYR . 0.0 OUTLIER -75.82 -32.62 24.25 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.234 0 N-CA-C 109.89 -0.411 . . . . 0.0 109.89 -178.557 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -69.19 -46.49 57.56 Favored Glycine 0 CA--C 1.523 0.558 0 N-CA-C 111.419 -0.672 . . . . 0.0 111.419 -176.531 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 37.5 mtm105 -69.47 -42.01 75.41 Favored 'General case' 0 CA--C 1.515 -0.395 0 CA-C-N 117.694 0.747 . . . . 0.0 110.09 177.641 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -62.83 -31.32 72.31 Favored 'General case' 0 N--CA 1.448 -0.528 0 C-N-CA 119.996 -0.682 . . . . 0.0 110.306 -179.194 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 76' ' ' TYR . . . . . 0.422 ' CZ ' HD13 ' A' ' 72' ' ' ILE . 2.3 m-30 -72.29 -56.38 5.6 Favored 'General case' 0 CA--C 1.518 -0.281 0 CA-C-N 118.149 0.431 . . . . 0.0 111.065 175.428 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 53.8 tp -63.87 -40.88 97.58 Favored 'General case' 0 N--CA 1.447 -0.577 0 C-N-CA 117.885 -1.526 . . . . 0.0 109.948 -175.265 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 95.8 m-20 -60.69 -50.97 71.35 Favored 'General case' 0 N--CA 1.454 -0.24 0 CA-C-O 118.693 -0.67 . . . . 0.0 112.389 -179.843 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 68.0 mm-40 -72.52 -35.73 68.16 Favored 'General case' 0 N--CA 1.455 -0.196 0 CA-C-N 119.385 0.993 . . . . 0.0 112.078 -177.357 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 80.5 p -72.11 -30.63 65.26 Favored 'General case' 0 N--CA 1.451 -0.404 0 C-N-CA 120.18 -0.608 . . . . 0.0 110.579 179.493 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 7.4 ttm105 -82.71 -29.6 29.74 Favored 'General case' 0 CA--C 1.531 0.224 0 C-N-CA 123.649 0.78 . . . . 0.0 112.159 177.76 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 44.2 m -79.21 -15.11 58.55 Favored 'General case' 0 CA--C 1.528 0.111 0 N-CA-C 112.645 0.609 . . . . 0.0 112.645 -179.102 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 50.1 m-80 -130.22 -1.59 4.53 Favored 'General case' 0 N--CA 1.455 -0.213 0 N-CA-C 112.304 0.483 . . . . 0.0 112.304 -174.93 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 47.8 t -162.85 179.18 7.81 Favored 'General case' 0 N--CA 1.451 -0.384 0 N-CA-C 110.005 -0.369 . . . . 0.0 110.005 -179.842 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 85' ' ' ASN . . . . . 0.423 ' C ' ' H ' ' A' ' 87' ' ' SER . 10.1 m120 -76.92 3.26 12.51 Favored 'General case' 0 CA--C 1.533 0.303 0 C-N-CA 122.676 0.391 . . . . 0.0 110.97 176.451 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 33.4 p 62.26 -9.58 0.09 Allowed 'General case' 0 CA--C 1.533 0.297 0 C-N-CA 126.315 1.846 . . . . 0.0 114.259 -177.749 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 87' ' ' SER . . . . . 0.423 ' H ' ' C ' ' A' ' 85' ' ' ASN . 48.2 t 58.69 175.69 0.07 Allowed 'General case' 0 CA--C 1.534 0.339 0 C-N-CA 124.468 1.107 . . . . 0.0 112.533 -178.912 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 47.9 t -139.56 5.87 2.25 Favored 'General case' 0 N--CA 1.455 -0.191 0 C-N-CA 123.553 0.741 . . . . 0.0 110.931 179.306 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 70.4 m-80 -145.52 173.46 12.01 Favored 'General case' 0 CA--C 1.531 0.225 0 C-N-CA 124.486 1.114 . . . . 0.0 109.752 179.969 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 90' ' ' LYS . . . . . 0.405 ' HB3' ' HE3' ' A' ' 90' ' ' LYS . 20.2 ttpp 67.72 134.59 0.04 OUTLIER Pre-proline 0 CA--C 1.536 0.406 0 C-N-CA 125.926 1.691 . . . . 0.0 113.386 -179.51 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 82.1 Cg_endo -70.3 168.92 20.87 Favored 'Trans proline' 0 N--CA 1.454 -0.809 0 C-N-CA 124.31 3.34 . . . . 0.0 110.522 173.894 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 83.59 20.63 59.66 Favored Glycine 0 CA--C 1.526 0.773 0 CA-C-O 119.775 -0.458 . . . . 0.0 112.448 177.442 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -158.28 167.16 30.51 Favored 'General case' 0 N--CA 1.451 -0.392 0 C-N-CA 124.281 1.033 . . . . 0.0 109.528 179.94 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 94' ' ' CYS . . . . . . . . . . . . . 2.0 t -52.37 -28.06 18.07 Favored 'General case' 0 N--CA 1.454 -0.241 0 C-N-CA 123.82 0.848 . . . . 0.0 110.816 175.176 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -52.94 -62.57 1.57 Allowed 'General case' 0 N--CA 1.448 -0.548 0 O-C-N 122.497 -0.127 . . . . 0.0 111.086 -178.239 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 76.4 t60 -73.56 -32.98 64.45 Favored 'General case' 0 N--CA 1.453 -0.323 0 O-C-N 122.27 -0.269 . . . . 0.0 110.954 -178.308 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -64.04 -53.58 47.66 Favored 'General case' 0 N--CA 1.451 -0.397 0 O-C-N 122.934 0.147 . . . . 0.0 111.183 -177.252 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 1.7 mp -69.88 -34.55 60.77 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.166 0 N-CA-C 109.83 -0.433 . . . . 0.0 109.83 -179.81 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 59.6 m-20 -62.07 -42.39 99.15 Favored 'General case' 0 N--CA 1.456 -0.168 0 O-C-N 122.163 -0.336 . . . . 0.0 110.6 178.102 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 98.0 m -64.23 -41.28 97.08 Favored 'General case' 0 N--CA 1.454 -0.249 0 N-CA-C 109.9 -0.407 . . . . 0.0 109.9 -178.653 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 90.8 mt -68.98 -24.1 64.2 Favored 'General case' 0 N--CA 1.452 -0.329 0 CA-C-N 116.426 -0.352 . . . . 0.0 111.389 179.882 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -73.73 -25.59 71.63 Favored Glycine 0 CA--C 1.527 0.833 0 CA-C-O 119.551 -0.583 . . . . 0.0 113.518 -178.212 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 74.1 mm-40 -81.08 -45.55 16.32 Favored 'General case' 0 N--CA 1.453 -0.294 0 CA-C-N 118.3 1.05 . . . . 0.0 111.996 179.35 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 18.1 m -85.26 6.69 2.19 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.14 0 C-N-CA 123.641 0.777 . . . . 0.0 111.097 -175.79 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 105' ' ' ILE . . . . . . . . . . . . . 9.7 tp -62.0 -37.0 77.25 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.354 0 C-N-CA 122.125 0.17 . . . . 0.0 110.795 -174.464 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 16.5 pt20 -76.05 -35.67 59.35 Favored 'General case' 0 N--CA 1.451 -0.404 0 CA-C-O 119.14 -0.457 . . . . 0.0 111.153 -177.231 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 59.3 mp0 -74.7 -39.36 61.99 Favored 'General case' 0 N--CA 1.451 -0.382 0 CA-C-N 118.814 0.734 . . . . 0.0 110.449 -179.684 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 7.6 tt -73.5 -41.38 63.17 Favored 'General case' 0 N--CA 1.45 -0.475 0 CA-C-O 119.672 -0.204 . . . . 0.0 111.326 -174.774 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 9.6 mp -73.43 -49.9 24.53 Favored 'General case' 0 C--O 1.225 -0.203 0 C-N-CA 120.534 -0.466 . . . . 0.0 110.012 179.148 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 23.3 t -55.32 -39.47 70.0 Favored 'General case' 0 N--CA 1.454 -0.231 0 CA-C-N 118.334 0.515 . . . . 0.0 111.109 -177.452 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 36.9 t0 -62.4 -49.33 75.94 Favored 'General case' 0 N--CA 1.454 -0.264 0 N-CA-C 109.067 -0.716 . . . . 0.0 109.067 175.423 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -66.69 -35.72 80.8 Favored 'General case' 0 N--CA 1.446 -0.657 0 CA-C-O 119.031 -0.509 . . . . 0.0 112.097 -175.457 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 113' ' ' ILE . . . . . . . . . . . . . 20.6 mm -70.26 -40.71 78.28 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.213 0 CA-C-N 119.315 0.961 . . . . 0.0 110.209 -178.936 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -74.35 -40.38 62.19 Favored 'General case' 0 N--CA 1.451 -0.377 0 C-N-CA 121.288 -0.165 . . . . 0.0 111.385 -179.421 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 115' ' ' LYS . . . . . 0.623 ' HE2' ' HA ' ' A' ' 115' ' ' LYS . 0.6 OUTLIER -75.58 -39.31 58.25 Favored 'General case' 0 N--CA 1.449 -0.485 0 N-CA-C 113.341 0.867 . . . . 0.0 113.341 -178.516 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 116' ' ' SER . . . . . 0.478 ' HB2' ' CB ' ' A' ' 120' ' ' HIS . 44.4 p -80.5 161.3 24.91 Favored 'General case' 0 N--CA 1.455 -0.198 0 N-CA-C 112.425 0.528 . . . . 0.0 112.425 -172.52 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 22.6 m120 -88.64 178.02 6.61 Favored 'General case' 0 C--O 1.227 -0.1 0 C-N-CA 123.435 0.694 . . . . 0.0 112.59 -177.367 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 118' ' ' GLN . . . . . . . . . . . . . 2.9 pt20 -49.21 -55.09 13.65 Favored 'General case' 0 N--CA 1.456 -0.128 0 C-N-CA 123.633 0.773 . . . . 0.0 112.937 -177.661 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 21.9 t70 -56.59 -33.98 66.75 Favored 'General case' 0 C--O 1.23 0.052 0 CA-C-N 118.451 0.569 . . . . 0.0 110.104 -179.993 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 120' ' ' HIS . . . . . 0.478 ' CB ' ' HB2' ' A' ' 116' ' ' SER . 15.9 m170 -75.05 -41.41 59.17 Favored 'General case' 0 N--CA 1.449 -0.489 0 N-CA-C 109.932 -0.395 . . . . 0.0 109.932 -177.571 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 62.1 mttp -58.08 -37.97 75.48 Favored 'General case' 0 N--CA 1.455 -0.202 0 N-CA-C 110.228 -0.286 . . . . 0.0 110.228 179.88 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 81.6 mm-40 -68.86 -46.24 69.0 Favored 'General case' 0 N--CA 1.449 -0.486 0 C-N-CA 122.72 0.408 . . . . 0.0 110.299 179.033 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 97.4 mttt -64.55 -31.33 72.5 Favored 'General case' 0 N--CA 1.453 -0.307 0 CA-C-N 115.75 -0.659 . . . . 0.0 111.07 -178.698 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 124' ' ' ILE . . . . . . . . . . . . . 58.4 mt -75.62 -38.47 38.4 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.242 0 O-C-N 121.791 -0.568 . . . . 0.0 110.132 176.761 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 22.9 mtp180 -67.49 -33.11 74.44 Favored 'General case' 0 N--CA 1.453 -0.277 0 N-CA-C 112.385 0.513 . . . . 0.0 112.385 178.14 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 126' ' ' MET . . . . . . . . . . . . . 28.1 ptm -72.5 -33.82 67.2 Favored 'General case' 0 N--CA 1.455 -0.207 0 C-N-CA 119.489 -0.884 . . . . 0.0 108.686 174.328 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 2.6 mp -63.33 -38.23 90.34 Favored 'General case' 0 C--N 1.34 0.163 0 N-CA-C 109.896 -0.409 . . . . 0.0 109.896 175.19 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 57.4 tp -64.24 -42.62 96.45 Favored 'General case' 0 N--CA 1.453 -0.285 0 CA-C-N 117.747 0.249 . . . . 0.0 110.335 179.614 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 18.9 t0 -63.82 -46.64 84.19 Favored 'General case' 0 N--CA 1.455 -0.178 0 N-CA-C 109.855 -0.424 . . . . 0.0 109.855 177.697 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 54.8 mt -56.37 -35.81 44.72 Favored 'Isoleucine or valine' 0 C--O 1.235 0.296 0 N-CA-C 110.257 -0.275 . . . . 0.0 110.257 179.931 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 131' ' ' TRP . . . . . . . . . . . . . 47.6 m0 -73.17 -43.72 61.0 Favored 'General case' 0 N--CA 1.45 -0.462 0 N-CA-C 112.635 0.606 . . . . 0.0 112.635 -179.536 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 76.7 m-20 -64.83 -27.56 68.96 Favored 'General case' 0 N--CA 1.453 -0.279 0 CA-C-N 118.462 0.574 . . . . 0.0 110.916 -179.088 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 12.3 mtp180 -75.67 -36.59 60.06 Favored 'General case' 0 C--O 1.226 -0.137 0 C-N-CA 123.313 0.645 . . . . 0.0 110.551 177.079 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 39.7 m -75.13 -13.95 60.52 Favored 'General case' 0 N--CA 1.455 -0.177 0 C-N-CA 123.019 0.528 . . . . 0.0 112.272 -178.246 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 135' ' ' GLY . . . . . . . . . . . . . . . 94.03 5.69 62.31 Favored Glycine 0 CA--C 1.529 0.944 0 N-CA-C 110.969 -0.853 . . . . 0.0 110.969 -175.183 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 136' ' ' LEU . . . . . . . . . . . . . 81.5 mt -82.65 12.62 4.47 Favored 'General case' 0 N--CA 1.454 -0.271 0 C-N-CA 123.743 0.817 . . . . 0.0 111.253 177.76 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 137' ' ' PHE . . . . . . . . . . . . . 21.6 p90 -59.03 151.08 23.0 Favored 'General case' 0 C--N 1.341 0.208 0 CA-C-N 118.217 0.462 . . . . 0.0 110.409 -178.898 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 138' ' ' GLN . . . . . . . . . . . . . 70.7 mm-40 -137.58 173.45 11.65 Favored 'General case' 0 CA--C 1.523 -0.061 0 CA-C-O 121.445 0.641 . . . . 0.0 111.333 -176.145 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 139' ' ' LYS . . . . . . . . . . . . . 63.2 pttt -79.43 174.92 11.08 Favored 'General case' 0 N--CA 1.452 -0.333 0 CA-C-N 114.983 -1.008 . . . . 0.0 111.335 178.926 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 140' ' ' SER . . . . . 0.511 ' C ' ' H ' ' A' ' 142' ' ' LEU . 9.5 t 59.51 37.87 22.69 Favored 'General case' 0 CA--C 1.533 0.316 0 N-CA-C 114.358 1.244 . . . . 0.0 114.358 174.719 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 141' ' ' TYR . . . . . . . . . . . . . 9.9 m-30 -73.24 35.72 0.08 Allowed 'General case' 0 CA--C 1.535 0.402 0 O-C-N 121.71 -0.619 . . . . 0.0 110.159 171.084 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 142' ' ' LEU . . . . . 0.511 ' H ' ' C ' ' A' ' 140' ' ' SER . 82.0 mt -80.25 -174.68 4.68 Favored 'General case' 0 N--CA 1.454 -0.24 0 C-N-CA 124.539 1.136 . . . . 0.0 111.531 -175.722 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 68.5 m-80 -55.71 -17.26 5.52 Favored 'General case' 0 N--CA 1.456 -0.171 0 C-N-CA 123.828 0.851 . . . . 0.0 112.566 -179.7 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . -66.2 -30.89 71.44 Favored 'General case' 0 N--CA 1.452 -0.369 0 CA-C-N 118.245 0.475 . . . . 0.0 110.416 179.587 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 145' ' ' ILE . . . . . . . . . . . . . 47.6 mm -74.6 -35.83 39.11 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.233 0 N-CA-C 110.048 -0.353 . . . . 0.0 110.048 179.678 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 146' ' ' ARG . . . . . . . . . . . . . 15.3 mmm180 -75.9 -22.87 55.64 Favored 'General case' 0 N--CA 1.453 -0.299 0 O-C-N 122.243 -0.286 . . . . 0.0 110.86 179.278 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 147' ' ' SER . . . . . . . . . . . . . 74.4 p 42.36 48.96 4.5 Favored 'General case' 0 C--N 1.341 0.221 0 C-N-CA 124.892 1.277 . . . . 0.0 112.642 174.625 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 148' ' ' LYS . . . . . 0.533 ' H ' ' HD2' ' A' ' 148' ' ' LYS . 0.0 OUTLIER -55.35 -14.93 2.11 Favored 'General case' 0 N--CA 1.453 -0.278 0 C-N-CA 124.047 0.939 . . . . 0.0 112.587 178.586 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 149' ' ' CYS . . . . . . . . . . . . . 59.6 m -60.88 -30.52 70.2 Favored 'General case' 0 N--CA 1.451 -0.402 0 O-C-N 121.804 -0.56 . . . . 0.0 109.72 175.887 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 150' ' ' PHE . . . . . . . . . . . . . 92.7 t80 -65.0 -29.45 70.37 Favored 'General case' 0 N--CA 1.454 -0.233 0 N-CA-C 110.018 -0.364 . . . . 0.0 110.018 178.774 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 151' ' ' ALA . . . . . . . . . . . . . . . -75.9 -33.76 59.92 Favored 'General case' 0 N--CA 1.449 -0.502 0 C-N-CA 122.401 0.28 . . . . 0.0 110.752 177.024 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 152' ' ' MET . . . . . . . . . . . . . 89.4 mtp -73.96 -31.04 62.83 Favored 'General case' 0 N--CA 1.454 -0.259 0 N-CA-C 110.225 -0.287 . . . . 0.0 110.225 178.454 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 153' ' ' ASP . . . . . . . . . . . . . 79.7 m-20 -75.42 -23.91 57.05 Favored 'General case' 0 N--CA 1.454 -0.23 0 N-CA-C 113.105 0.78 . . . . 0.0 113.105 -179.571 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 154' ' ' LEU . . . . . . . . . . . . . 84.3 mt -131.32 18.13 4.9 Favored 'General case' 0 C--N 1.339 0.119 0 C-N-CA 123.032 0.533 . . . . 0.0 111.891 -174.176 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 155' ' ' GLU . . . . . . . . . . . . . 94.0 mt-10 51.53 8.99 0.06 Allowed 'General case' 0 CA--C 1.535 0.381 0 C-N-CA 126.19 1.796 . . . . 0.0 114.227 -179.054 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 156' ' ' HIS . . . . . . . . . . . . . 73.2 t60 -161.96 145.92 12.38 Favored 'General case' 0 N--CA 1.454 -0.235 0 N-CA-C 108.169 -1.048 . . . . 0.0 108.169 -178.638 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 157' ' ' HIS . . . . . . . . . . . . . 62.1 t60 -98.47 -25.23 14.85 Favored 'General case' 0 C--N 1.338 0.103 0 N-CA-C 113.326 0.861 . . . . 0.0 113.326 -172.955 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 158' ' ' HIS . . . . . . . . . . . . . 88.1 m-70 -91.37 40.92 1.05 Allowed 'General case' 0 N--CA 1.455 -0.204 0 N-CA-C 112.97 0.73 . . . . 0.0 112.97 -171.911 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 159' ' ' HIS . . . . . . . . . . . . . 97.6 m-70 . . . . . 0 C--O 1.251 1.134 0 CA-C-O 117.759 -1.115 . . . . 0.0 108.956 169.097 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' B' B 2052 ' ' ASP . . . . . . . . . . . . . 23.9 m-20 . . . . . 0 N--CA 1.47 0.541 0 N-CA-C 109.637 -0.505 . . . . 0.0 109.637 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' B' B 2053 ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER 57.43 35.28 25.74 Favored 'General case' 0 N--CA 1.454 -0.243 0 N-CA-C 113.415 0.894 . . . . 0.0 113.415 168.582 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B 2054 ' ' ASP . . . . . . . . . . . . . 55.2 t0 -142.18 69.16 1.32 Allowed 'General case' 0 CA--C 1.533 0.293 0 C-N-CA 123.047 0.539 . . . . 0.0 110.05 -177.03 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B 2055 ' ' GLU . . . . . 0.452 ' HB3' ' H ' ' A' ' 27' ' ' SER . 60.9 tt0 55.11 49.02 18.35 Favored 'General case' 0 CA--C 1.531 0.224 0 C-N-CA 124.319 1.048 . . . . 0.0 110.42 -177.209 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B 2056 ' ' ASP . . . . . . . . . . . . . 17.1 m-20 -57.96 -6.66 0.6 Allowed 'General case' 0 C--N 1.341 0.199 0 C-N-CA 125.231 1.412 . . . . 0.0 114.675 -172.77 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B 2057 ' ' ASP . . . . . . . . . . . . . 24.6 t0 -150.62 112.43 4.52 Favored 'General case' 0 N--CA 1.452 -0.339 0 CA-C-N 119.166 0.893 . . . . 0.0 110.267 173.621 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B 2058 ' ' TYR . . . . . . . . . . . . . 3.4 t80 -66.99 -25.27 66.23 Favored 'General case' 0 N--CA 1.455 -0.219 0 C-N-CA 125.19 1.396 . . . . 0.0 110.451 179.112 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B 2059 ' ' THR . . . . . . . . . . . . . 8.1 t 34.33 55.38 1.76 Allowed Pre-proline 0 C--N 1.344 0.357 0 C-N-CA 124.984 1.314 . . . . 0.0 112.315 178.924 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B 2060 ' ' PRO . . . . . . . . . . . . . 42.1 Cg_endo -62.22 157.71 43.55 Favored 'Trans proline' 0 N--CA 1.451 -1.001 0 C-N-CA 123.257 2.638 . . . . 0.0 111.735 -171.194 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B 2061 ' ' SER . . . . . . . . . . . . . 45.7 t -149.45 168.45 23.4 Favored 'General case' 0 N--CA 1.452 -0.352 0 CA-C-N 115.703 -0.68 . . . . 0.0 109.725 -178.207 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B 2062 ' ' ILE . . . . . . . . . . . . . 11.6 tt -158.61 153.64 5.63 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.174 0 N-CA-C 109.237 -0.653 . . . . 0.0 109.237 -174.559 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B 2063 ' ' SER . . . . . . . . . . . . . 48.4 t . . . . . 0 C--O 1.252 1.196 0 CA-C-O 117.992 -1.004 . . . . 0.0 111.9 179.452 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 56.5 ttp . . . . . 0 N--CA 1.474 0.726 0 CA-C-O 119.248 -0.406 . . . . 0.0 111.565 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 41.7 tp60 60.77 35.19 19.63 Favored 'General case' 0 CA--C 1.531 0.245 0 CA-C-O 121.748 0.785 . . . . 0.0 110.818 178.204 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 12.0 tt0 -153.43 164.14 38.71 Favored 'General case' 0 N--CA 1.45 -0.44 0 N-CA-C 108.58 -0.896 . . . . 0.0 108.58 -179.237 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 14.0 m-20 55.09 26.28 8.02 Favored 'General case' 0 C--O 1.23 0.074 0 C-N-CA 123.567 0.747 . . . . 0.0 112.899 179.572 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 31.5 t0 56.35 38.15 29.48 Favored 'General case' 0 C--N 1.331 -0.227 0 C-N-CA 124.022 0.929 . . . . 0.0 111.534 -179.68 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 31.3 p-10 -57.65 -34.06 68.95 Favored 'General case' 0 N--CA 1.454 -0.256 0 N-CA-C 110.283 -0.265 . . . . 0.0 110.283 179.456 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' PHE . . . . . 0.505 ' CD1' ' HD3' ' A' ' 45' ' ' LYS . 1.3 t80 -57.28 -41.84 80.53 Favored 'General case' 0 N--CA 1.451 -0.376 0 C-N-CA 123.496 0.718 . . . . 0.0 111.714 -179.658 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 46.1 tp60 -53.73 -33.94 57.27 Favored 'General case' 0 N--CA 1.456 -0.127 0 C-N-CA 122.777 0.431 . . . . 0.0 111.653 -176.537 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 18.8 m-80 -70.92 -31.12 67.63 Favored 'General case' 0 N--CA 1.451 -0.398 0 N-CA-C 109.944 -0.391 . . . . 0.0 109.944 -179.964 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' PHE . . . . . 0.464 ' CE2' ' HB2' ' A' ' 32' ' ' LEU . 10.9 t80 -71.54 -39.02 70.97 Favored 'General case' 0 N--CA 1.452 -0.343 0 N-CA-C 109.419 -0.586 . . . . 0.0 109.419 176.189 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 57.5 t -63.15 -55.83 21.01 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.359 0 N-CA-C 109.18 -0.674 . . . . 0.0 109.18 179.059 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -60.24 -29.22 68.62 Favored 'General case' 0 N--CA 1.453 -0.291 0 C-N-CA 123.277 0.631 . . . . 0.0 112.161 -179.922 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 99.9 m -72.62 -39.74 67.02 Favored 'General case' 0 CA--C 1.53 0.211 0 CA-C-N 118.904 0.775 . . . . 0.0 109.403 177.268 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . 0.476 ' HA ' ' CD1' ' A' ' 17' ' ' PHE . 14.2 tp -65.23 -46.71 79.51 Favored 'General case' 0 N--CA 1.454 -0.233 0 CA-C-O 121.644 0.735 . . . . 0.0 109.467 178.192 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 69.0 mm-40 -63.4 -29.58 70.85 Favored 'General case' 0 N--CA 1.45 -0.443 0 C-N-CA 124.136 0.974 . . . . 0.0 110.048 178.898 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 42.3 t -69.46 -32.24 71.04 Favored 'General case' 0 N--CA 1.452 -0.336 0 N-CA-C 109.679 -0.489 . . . . 0.0 109.679 177.375 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' PHE . . . . . 0.476 ' CD1' ' HA ' ' A' ' 14' ' ' LEU . 19.7 m-85 -63.61 -42.05 98.25 Favored 'General case' 0 N--CA 1.454 -0.25 0 C-N-CA 119.388 -0.925 . . . . 0.0 109.604 172.559 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 67.1 mttt -61.82 -28.54 69.55 Favored 'General case' 0 C--N 1.341 0.2 0 O-C-N 122.985 0.178 . . . . 0.0 110.833 -178.776 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 54.5 t0 -73.95 -43.62 57.63 Favored 'General case' 0 N--CA 1.455 -0.177 0 O-C-N 123.48 0.488 . . . . 0.0 111.019 178.829 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . 0.42 ' CD1' ' HB2' ' A' ' 25' ' ' SER . 63.6 mt -57.82 144.13 39.75 Favored 'General case' 0 N--CA 1.454 -0.228 0 O-C-N 122.048 -0.408 . . . . 0.0 111.073 -177.157 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . 0.508 ' HE2' ' OD1' ' B' 2052 ' ' ASP . 1.0 OUTLIER -83.7 -22.86 31.92 Favored 'General case' 0 N--CA 1.453 -0.323 0 N-CA-C 109.652 -0.499 . . . . 0.0 109.652 177.001 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' SER . . . . . 0.459 ' C ' ' H ' ' A' ' 24' ' ' ILE . 68.8 m -75.36 -24.09 57.26 Favored 'General case' 0 N--CA 1.456 -0.148 0 N-CA-C 109.832 -0.433 . . . . 0.0 109.832 170.335 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 70.64 -31.69 0.48 Allowed Glycine 0 CA--C 1.527 0.799 0 C-N-CA 124.883 1.23 . . . . 0.0 112.103 179.689 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . 0.459 ' H ' ' C ' ' A' ' 22' ' ' SER . 47.2 mt -87.23 154.95 3.28 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.523 0 C-N-CA 123.801 0.841 . . . . 0.0 109.143 173.881 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' SER . . . . . 0.491 ' HG ' ' CG ' ' B' 2054 ' ' ASP . 32.7 t -158.29 81.46 0.83 Allowed 'General case' 0 CA--C 1.517 -0.319 0 N-CA-C 109.886 -0.413 . . . . 0.0 109.886 177.82 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -50.58 -33.01 25.13 Favored Glycine 0 CA--C 1.529 0.927 0 CA-C-O 119.499 -0.612 . . . . 0.0 112.43 -175.442 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 40.3 t -73.13 -52.39 14.38 Favored 'General case' 0 N--CA 1.453 -0.298 0 CA-C-N 118.205 1.003 . . . . 0.0 110.771 -179.709 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 82.6 mtt85 -69.88 -31.74 69.71 Favored 'General case' 0 C--N 1.34 0.189 0 CA-C-N 117.544 0.156 . . . . 0.0 110.681 -177.491 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 53.0 mt -59.77 -45.81 94.28 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.724 0 N-CA-C 108.164 -1.05 . . . . 0.0 108.164 174.423 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 33.5 mtmm -68.22 -23.32 64.8 Favored 'General case' 0 N--CA 1.454 -0.234 0 CA-C-O 118.606 -0.711 . . . . 0.0 111.869 177.06 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.04 -59.4 4.19 Favored 'General case' 0 C--N 1.341 0.197 0 CA-C-N 119.341 0.973 . . . . 0.0 110.281 177.777 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . 0.464 ' HB2' ' CE2' ' A' ' 10' ' ' PHE . 1.2 pp -75.29 -17.94 60.17 Favored 'General case' 0 CA--C 1.531 0.245 0 C-N-CA 119.47 -0.892 . . . . 0.0 112.068 -177.271 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 55.2 m -72.66 -38.75 67.55 Favored 'General case' 0 N--CA 1.457 -0.123 0 N-CA-C 108.898 -0.779 . . . . 0.0 108.898 175.684 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 98.8 m -70.4 -37.4 74.46 Favored 'General case' 0 N--CA 1.453 -0.321 0 N-CA-C 109.861 -0.422 . . . . 0.0 109.861 179.995 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 19.8 t80 -61.64 -38.26 87.05 Favored 'General case' 0 C--N 1.34 0.159 0 N-CA-C 109.962 -0.385 . . . . 0.0 109.962 175.359 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -68.07 -37.54 81.38 Favored 'General case' 0 N--CA 1.447 -0.621 0 CA-C-N 116.791 -0.186 . . . . 0.0 110.945 -179.331 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 3.2 mm? -71.05 -35.97 72.15 Favored 'General case' 0 CA--C 1.522 -0.114 0 C-N-CA 122.096 0.158 . . . . 0.0 110.948 -179.369 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 41.5 t0 -72.86 -14.62 61.53 Favored 'General case' 0 N--CA 1.452 -0.337 0 C-N-CA 122.472 0.309 . . . . 0.0 110.588 177.238 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 96.6 m-70 -151.52 88.99 1.45 Allowed 'General case' 0 CA--C 1.53 0.192 0 C-N-CA 122.935 0.494 . . . . 0.0 111.411 -173.897 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -75.42 -12.71 14.88 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.232 0 O-C-N 122.023 -0.423 . . . . 0.0 111.024 175.707 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -57.24 -24.38 54.33 Favored 'General case' 0 C--O 1.228 -0.045 0 C-N-CA 123.34 0.656 . . . . 0.0 111.762 -176.404 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -106.98 18.63 5.77 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.24 0 C-N-CA 123.291 0.637 . . . . 0.0 112.58 178.768 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 3.0 pp20? -54.0 -28.61 39.03 Favored 'General case' 0 CA--C 1.528 0.129 0 CA-C-N 118.723 0.692 . . . . 0.0 111.7 177.848 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 29.6 t -65.39 -46.14 81.27 Favored 'General case' 0 N--CA 1.452 -0.335 0 O-C-N 122.384 -0.198 . . . . 0.0 110.936 -176.199 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . 0.505 ' HD3' ' CD1' ' A' ' 7' ' ' PHE . 19.2 ptpt -74.69 -26.9 60.15 Favored 'General case' 0 C--N 1.339 0.13 0 N-CA-C 109.566 -0.531 . . . . 0.0 109.566 177.908 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 61.0 mt -68.63 -48.8 69.88 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.228 0 N-CA-C 109.823 -0.436 . . . . 0.0 109.823 -179.036 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 35.4 mm -63.84 -38.25 81.86 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.249 0 N-CA-C 109.065 -0.717 . . . . 0.0 109.065 176.944 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 49.8 m -63.33 -42.64 98.99 Favored 'General case' 0 CA--C 1.531 0.23 0 C-N-CA 120.82 -0.352 . . . . 0.0 111.5 -178.345 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 6.9 mp -73.51 -36.35 65.72 Favored 'General case' 0 N--CA 1.453 -0.276 0 N-CA-C 112.652 0.612 . . . . 0.0 112.652 -176.332 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 5.5 pt -71.63 -44.4 69.76 Favored 'Isoleucine or valine' 0 C--N 1.34 0.169 0 CA-C-N 119.352 0.978 . . . . 0.0 110.846 -178.55 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 16.2 pt -66.12 -38.04 81.1 Favored 'Isoleucine or valine' 0 C--N 1.335 -0.055 0 C-N-CA 120.192 -0.603 . . . . 0.0 110.785 -179.783 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 90.7 m-20 -70.86 -41.07 71.9 Favored 'General case' 0 N--CA 1.454 -0.274 0 CA-C-N 118.107 0.412 . . . . 0.0 111.756 178.365 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 18.8 t80 -63.61 -41.3 98.32 Favored 'General case' 0 N--CA 1.455 -0.182 0 N-CA-C 109.081 -0.711 . . . . 0.0 109.081 175.93 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 23.3 t -62.25 -38.91 91.05 Favored 'General case' 0 N--CA 1.45 -0.462 0 C-N-CA 122.437 0.295 . . . . 0.0 111.435 -176.64 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 55.6 mtm180 -75.12 -40.88 59.47 Favored 'General case' 0 N--CA 1.456 -0.156 0 N-CA-C 111.913 0.338 . . . . 0.0 111.913 -177.239 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 48.7 mt -80.46 -44.52 19.1 Favored 'General case' 0 N--CA 1.455 -0.206 0 N-CA-C 113.221 0.823 . . . . 0.0 113.221 -176.023 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 14.5 p -62.68 159.45 43.58 Favored Pre-proline 0 CA--C 1.535 0.382 0 N-CA-C 114.241 1.2 . . . . 0.0 114.241 -170.701 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 35.9 Cg_exo -58.79 -179.51 0.15 Allowed 'Trans proline' 0 N--CA 1.454 -0.822 1 C-N-CA 125.758 4.306 . . . . 0.0 113.746 174.423 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 42.3 p-10 -66.4 -42.65 87.52 Favored 'General case' 0 CA--C 1.533 0.298 0 C-N-CA 124.534 1.134 . . . . 0.0 113.364 -175.013 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 39.8 m -72.75 -37.03 67.81 Favored 'General case' 0 N--CA 1.455 -0.189 0 O-C-N 121.773 -0.58 . . . . 0.0 109.762 179.74 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 55.4 m80 -69.02 -27.87 66.06 Favored 'General case' 0 N--CA 1.45 -0.425 0 CA-C-N 116.176 -0.465 . . . . 0.0 109.867 176.025 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . 0.417 ' HE3' ' HB3' ' A' ' 112' ' ' ALA . 56.4 tptt -65.88 -45.39 82.24 Favored 'General case' 0 C--N 1.338 0.108 0 C-N-CA 122.623 0.369 . . . . 0.0 110.025 177.877 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . 0.46 HD13 ' CD2' ' A' ' 120' ' ' HIS . 0.3 OUTLIER -61.29 -41.94 97.82 Favored 'General case' 0 N--CA 1.455 -0.213 0 N-CA-C 108.458 -0.941 . . . . 0.0 108.458 177.641 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -65.22 -29.26 74.87 Favored Glycine 0 CA--C 1.527 0.791 0 N-CA-C 111.964 -0.454 . . . . 0.0 111.964 178.554 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 37.0 p -68.7 -37.1 79.26 Favored 'General case' 0 N--CA 1.451 -0.375 0 CA-C-N 117.931 0.866 . . . . 0.0 110.062 178.462 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 95.1 mt -75.32 -24.81 57.47 Favored 'General case' 0 N--CA 1.452 -0.338 0 CA-C-N 116.596 -0.275 . . . . 0.0 110.726 178.98 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 9.6 m-30 -70.69 -36.01 73.08 Favored 'General case' 0 CA--C 1.515 -0.374 0 CA-C-N 118.338 0.517 . . . . 0.0 110.422 174.007 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 68' ' ' ILE . . . . . . . . . . . . . 22.0 mt -68.29 -54.3 22.76 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.621 0 N-CA-C 107.448 -1.315 . . . . 0.0 107.448 177.69 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 65.5 mt -50.39 -37.14 14.28 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.174 0 C-N-CA 123.885 0.874 . . . . 0.0 111.802 175.021 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 8.8 t70 -71.06 -54.85 9.71 Favored 'General case' 0 CA--C 1.521 -0.147 0 CA-C-N 118.819 0.736 . . . . 0.0 111.487 -179.737 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 53.6 p -66.87 -44.26 81.4 Favored 'General case' 0 N--CA 1.452 -0.373 0 O-C-N 123.161 0.288 . . . . 0.0 110.499 -175.25 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -75.13 -36.65 38.22 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.246 0 N-CA-C 109.629 -0.508 . . . . 0.0 109.629 179.731 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -67.09 -46.15 75.32 Favored Glycine 0 C--N 1.337 0.622 0 N-CA-C 111.417 -0.673 . . . . 0.0 111.417 -175.351 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 39.0 mtm105 -69.81 -42.61 73.47 Favored 'General case' 0 CA--C 1.517 -0.309 0 CA-C-N 117.37 0.585 . . . . 0.0 109.906 177.913 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -64.83 -33.88 77.05 Favored 'General case' 0 N--CA 1.45 -0.432 0 CA-C-O 119.335 -0.364 . . . . 0.0 110.918 -178.191 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 1.0 OUTLIER -68.18 -45.45 73.4 Favored 'General case' 0 CA--C 1.519 -0.241 0 CA-C-N 118.571 0.623 . . . . 0.0 110.929 177.076 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . 0.447 ' HA ' ' SG ' ' A' ' 94' ' ' CYS . 6.5 tt -66.62 -48.17 70.33 Favored 'General case' 0 N--CA 1.447 -0.596 0 C-N-CA 118.249 -1.381 . . . . 0.0 108.24 -178.266 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 90.4 m-20 -54.19 -44.96 72.0 Favored 'General case' 0 C--O 1.228 -0.079 0 N-CA-C 112.864 0.69 . . . . 0.0 112.864 177.979 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 15.5 tm-20 -61.53 -50.2 73.64 Favored 'General case' 0 N--CA 1.448 -0.548 0 CA-C-N 117.878 0.308 . . . . 0.0 111.117 -177.752 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 31.6 p -72.82 -26.88 61.65 Favored 'General case' 0 N--CA 1.453 -0.276 0 C-N-CA 120.477 -0.489 . . . . 0.0 110.412 -178.12 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 33.2 ttp180 -70.4 -23.7 62.8 Favored 'General case' 0 N--CA 1.45 -0.448 0 C-N-CA 123.676 0.79 . . . . 0.0 111.061 175.022 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 34.0 t -84.1 -14.04 51.45 Favored 'General case' 0 N--CA 1.454 -0.262 0 N-CA-C 113.14 0.793 . . . . 0.0 113.14 -179.13 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 26.6 p30 -151.94 16.61 0.66 Allowed 'General case' 0 CA--C 1.519 -0.223 0 N-CA-C 114.064 1.135 . . . . 0.0 114.064 -175.292 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 25.2 p 63.22 19.22 11.54 Favored 'General case' 0 N--CA 1.448 -0.557 0 N-CA-C 114.501 1.297 . . . . 0.0 114.501 174.599 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 99.1 m-20 -55.13 -24.5 26.47 Favored 'General case' 0 CA--C 1.53 0.201 0 CA-C-N 119.182 0.901 . . . . 0.0 111.556 179.661 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 40.7 t -68.28 -7.48 31.2 Favored 'General case' 0 CA--C 1.531 0.24 0 C-N-CA 122.685 0.394 . . . . 0.0 111.946 -178.781 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 92.8 p -83.79 -15.08 49.76 Favored 'General case' 0 C--N 1.339 0.144 0 C-N-CA 122.683 0.393 . . . . 0.0 111.355 176.93 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 86.5 p -81.84 -157.62 0.2 Allowed 'General case' 0 CA--C 1.531 0.22 0 C-N-CA 123.411 0.685 . . . . 0.0 110.231 -179.061 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 2.0 p-10 -55.12 143.07 28.42 Favored 'General case' 0 CA--C 1.528 0.128 0 C-N-CA 122.953 0.501 . . . . 0.0 109.872 178.906 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -71.29 -64.89 1.04 Allowed Pre-proline 0 N--CA 1.456 -0.128 0 CA-C-O 118.073 -0.965 . . . . 0.0 110.702 -175.917 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 31.5 Cg_exo -59.53 139.21 88.15 Favored 'Trans proline' 0 N--CA 1.447 -1.211 0 N-CA-C 108.209 -1.496 . . . . 0.0 108.209 172.987 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 90.68 16.57 54.6 Favored Glycine 0 CA--C 1.526 0.766 0 CA-C-O 119.369 -0.684 . . . . 0.0 112.28 -176.756 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 78.0 p -151.2 172.17 16.25 Favored 'General case' 0 N--CA 1.455 -0.213 0 CA-C-N 118.05 0.925 . . . . 0.0 111.349 176.307 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 94' ' ' CYS . . . . . 0.447 ' SG ' ' HA ' ' A' ' 77' ' ' LEU . 5.3 t -57.03 -27.21 61.44 Favored 'General case' 0 N--CA 1.451 -0.422 0 CA-C-N 115.196 -0.911 . . . . 0.0 109.91 173.376 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -56.11 -59.25 5.19 Favored 'General case' 0 N--CA 1.446 -0.653 0 N-CA-C 109.384 -0.599 . . . . 0.0 109.384 -176.189 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 73.6 t60 -74.59 -34.44 62.87 Favored 'General case' 0 N--CA 1.45 -0.472 0 CA-C-N 116.36 -0.382 . . . . 0.0 111.419 -179.152 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -64.93 -50.67 65.55 Favored 'General case' 0 N--CA 1.454 -0.261 0 O-C-N 122.969 0.168 . . . . 0.0 111.356 -177.145 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 98' ' ' ILE . . . . . 0.407 HD13 ' SG ' ' A' ' 94' ' ' CYS . 1.7 mp -73.61 -32.31 35.31 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.207 0 N-CA-C 110.033 -0.358 . . . . 0.0 110.033 -178.32 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 2.0 m120 -67.11 -45.24 77.79 Favored 'General case' 0 N--CA 1.453 -0.306 0 CA-C-N 118.062 0.392 . . . . 0.0 111.101 176.838 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 95.9 m -70.67 -33.64 71.16 Favored 'General case' 0 N--CA 1.457 -0.12 0 CA-C-N 117.947 0.339 . . . . 0.0 110.497 -177.109 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 68.4 tp -73.58 -30.39 62.99 Favored 'General case' 0 N--CA 1.451 -0.408 0 C-N-CA 122.661 0.385 . . . . 0.0 110.946 -179.104 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -70.09 -19.84 75.91 Favored Glycine 0 CA--C 1.529 0.922 0 CA-C-O 119.555 -0.581 . . . . 0.0 112.828 -176.998 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 14.6 mm-40 -80.23 -39.46 29.01 Favored 'General case' 0 C--O 1.231 0.125 0 CA-C-N 118.008 0.904 . . . . 0.0 111.381 179.998 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 30.3 m -97.87 -8.87 9.09 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.158 0 N-CA-C 113.177 0.806 . . . . 0.0 113.177 -173.868 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 105' ' ' ILE . . . . . . . . . . . . . 10.6 tp -57.15 -26.78 26.09 Favored 'Isoleucine or valine' 0 CA--C 1.528 0.124 0 CA-C-N 119.162 0.892 . . . . 0.0 111.655 -176.716 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 25.4 pt20 -67.48 -30.04 69.64 Favored 'General case' 0 N--CA 1.454 -0.267 0 O-C-N 122.182 -0.324 . . . . 0.0 110.523 178.852 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 66.5 mt-10 -73.98 -41.6 61.68 Favored 'General case' 0 N--CA 1.455 -0.201 0 N-CA-C 108.795 -0.817 . . . . 0.0 108.795 177.315 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 41.1 mt -68.65 -42.73 77.53 Favored 'General case' 0 N--CA 1.449 -0.505 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.573 -174.348 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 95.9 mt -72.61 -47.1 50.58 Favored 'General case' 0 N--CA 1.451 -0.416 0 CA-C-O 119.01 -0.519 . . . . 0.0 111.319 -179.033 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 44.6 t -61.89 -41.19 97.58 Favored 'General case' 0 C--O 1.233 0.204 0 CA-C-N 118.849 0.75 . . . . 0.0 110.684 -179.295 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 22.6 t0 -59.25 -40.26 85.43 Favored 'General case' 0 N--CA 1.453 -0.289 0 N-CA-C 108.469 -0.937 . . . . 0.0 108.469 174.7 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 112' ' ' ALA . . . . . 0.417 ' HB3' ' HE3' ' A' ' 62' ' ' LYS . . . -69.33 -38.75 78.32 Favored 'General case' 0 N--CA 1.443 -0.779 0 C-N-CA 120.603 -0.439 . . . . 0.0 111.138 -175.768 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 113' ' ' ILE . . . . . 0.44 ' O ' ' HE2' ' A' ' 121' ' ' LYS . 36.6 mm -66.21 -42.37 90.92 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.473 0 C-N-CA 118.809 -1.156 . . . . 0.0 109.739 -178.276 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -71.96 -46.86 55.9 Favored 'General case' 0 N--CA 1.451 -0.422 0 N-CA-C 111.555 0.205 . . . . 0.0 111.555 -178.899 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 33.1 ttpt -76.77 -37.25 56.22 Favored 'General case' 0 N--CA 1.451 -0.384 0 N-CA-C 113.497 0.925 . . . . 0.0 113.497 -175.405 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 116' ' ' SER . . . . . 0.484 ' HB2' ' CB ' ' A' ' 120' ' ' HIS . 24.4 p -76.54 159.82 30.0 Favored 'General case' 0 CA--C 1.527 0.095 0 N-CA-C 112.605 0.595 . . . . 0.0 112.605 -170.678 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 11.6 m120 -76.68 168.4 20.15 Favored 'General case' 0 CA--C 1.519 -0.236 0 C-N-CA 123.227 0.611 . . . . 0.0 111.851 -179.719 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 118' ' ' GLN . . . . . . . . . . . . . 12.7 mm100 -53.75 -42.23 67.96 Favored 'General case' 0 C--O 1.233 0.216 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.559 -178.394 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 18.4 t0 -66.67 -32.73 74.23 Favored 'General case' 0 N--CA 1.456 -0.164 0 N-CA-C 109.303 -0.628 . . . . 0.0 109.303 -179.622 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 120' ' ' HIS . . . . . 0.484 ' CB ' ' HB2' ' A' ' 116' ' ' SER . 20.8 m170 -76.05 -40.38 53.48 Favored 'General case' 0 N--CA 1.449 -0.491 0 CA-C-N 116.002 -0.544 . . . . 0.0 110.073 -178.859 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 121' ' ' LYS . . . . . 0.44 ' HE2' ' O ' ' A' ' 113' ' ' ILE . 96.0 mttt -54.98 -41.04 70.69 Favored 'General case' 0 C--N 1.339 0.118 0 N-CA-C 108.222 -1.029 . . . . 0.0 108.222 177.932 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 46.0 tp10 -70.63 -39.31 73.79 Favored 'General case' 0 CA--C 1.53 0.178 0 N-CA-C 111.467 0.173 . . . . 0.0 111.467 178.222 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 92.0 mttt -71.36 -26.43 62.8 Favored 'General case' 0 N--CA 1.452 -0.335 0 O-C-N 121.835 -0.541 . . . . 0.0 110.827 -179.266 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 124' ' ' ILE . . . . . . . . . . . . . 69.1 mt -69.99 -40.25 78.37 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.244 0 N-CA-C 108.653 -0.869 . . . . 0.0 108.653 174.233 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 125' ' ' ARG . . . . . 0.407 ' HA ' HH11 ' A' ' 125' ' ' ARG . 6.6 mmm180 -61.28 -48.41 81.53 Favored 'General case' 0 N--CA 1.45 -0.433 0 CA-C-O 118.899 -0.572 . . . . 0.0 111.518 179.269 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 126' ' ' MET . . . . . . . . . . . . . 28.7 ptm -62.96 -30.11 71.33 Favored 'General case' 0 N--CA 1.453 -0.284 0 C-N-CA 119.183 -1.007 . . . . 0.0 109.299 179.217 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 1.2 mp -62.44 -39.29 92.86 Favored 'General case' 0 C--N 1.339 0.146 0 CA-C-N 118.187 0.449 . . . . 0.0 111.037 175.957 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 80.8 mt -72.72 -36.76 67.87 Favored 'General case' 0 N--CA 1.455 -0.223 0 CA-C-N 118.488 0.586 . . . . 0.0 110.127 179.614 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 15.1 m-20 -65.71 -35.84 81.91 Favored 'General case' 0 N--CA 1.454 -0.274 0 N-CA-C 109.351 -0.611 . . . . 0.0 109.351 176.624 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 130' ' ' ILE . . . . . 0.4 ' HA ' ' HD3' ' A' ' 133' ' ' ARG . 35.7 mt -63.62 -36.43 76.41 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.229 0 C-N-CA 122.487 0.315 . . . . 0.0 110.212 176.423 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 131' ' ' TRP . . . . . . . . . . . . . 46.4 m0 -73.8 -31.01 63.05 Favored 'General case' 0 N--CA 1.449 -0.481 0 N-CA-C 112.899 0.703 . . . . 0.0 112.899 179.54 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 82.9 m-20 -70.36 -34.3 72.45 Favored 'General case' 0 N--CA 1.456 -0.172 0 CA-C-N 118.458 0.572 . . . . 0.0 110.577 176.889 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 133' ' ' ARG . . . . . 0.405 HH21 ' C ' ' B' 2063 ' ' SER . 23.1 mtp180 -72.36 -33.94 67.63 Favored 'General case' 0 N--CA 1.456 -0.163 0 C-N-CA 123.221 0.608 . . . . 0.0 109.823 177.747 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 37.0 m -80.47 -14.59 58.14 Favored 'General case' 0 N--CA 1.453 -0.3 0 C-N-CA 123.409 0.684 . . . . 0.0 111.973 -178.918 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 135' ' ' GLY . . . . . . . . . . . . . . . 85.09 11.5 76.04 Favored Glycine 0 CA--C 1.53 1.008 0 CA-C-O 119.121 -0.822 . . . . 0.0 113.564 177.538 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 136' ' ' LEU . . . . . . . . . . . . . 11.0 mp -69.01 154.58 41.83 Favored 'General case' 0 C--O 1.232 0.133 0 CA-C-N 118.759 1.28 . . . . 0.0 109.292 177.612 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 137' ' ' PHE . . . . . . . . . . . . . 81.9 m-85 -77.68 -22.32 50.72 Favored 'General case' 0 N--CA 1.453 -0.295 0 N-CA-C 112.189 0.44 . . . . 0.0 112.189 -175.672 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 138' ' ' GLN . . . . . . . . . . . . . 25.9 mp0 -75.15 132.88 41.49 Favored 'General case' 0 N--CA 1.455 -0.193 0 C-N-CA 122.845 0.458 . . . . 0.0 110.802 -178.809 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 139' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -174.74 175.71 2.38 Favored 'General case' 0 C--N 1.341 0.211 0 C-N-CA 123.916 0.886 . . . . 0.0 110.807 175.618 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 140' ' ' SER . . . . . . . . . . . . . 42.6 t -74.08 64.48 1.04 Allowed 'General case' 0 N--CA 1.454 -0.238 0 C-N-CA 124.336 1.054 . . . . 0.0 112.977 -176.351 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 141' ' ' TYR . . . . . . . . . . . . . 86.0 m-85 -66.36 -72.94 0.14 Allowed 'General case' 0 N--CA 1.455 -0.178 0 O-C-N 122.014 -0.429 . . . . 0.0 109.876 174.777 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 142' ' ' LEU . . . . . . . . . . . . . 73.2 mt -69.78 155.57 40.34 Favored 'General case' 0 N--CA 1.454 -0.267 0 C-N-CA 123.249 0.62 . . . . 0.0 111.844 -175.396 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 21.1 p30 -68.83 -11.56 60.58 Favored 'General case' 0 N--CA 1.453 -0.283 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.621 177.446 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . -68.12 -32.23 72.38 Favored 'General case' 0 N--CA 1.454 -0.253 0 N-CA-C 110.155 -0.313 . . . . 0.0 110.155 177.046 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 145' ' ' ILE . . . . . . . . . . . . . 29.5 mm -69.38 -26.75 32.12 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.262 0 N-CA-C 109.812 -0.44 . . . . 0.0 109.812 177.549 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 146' ' ' ARG . . . . . . . . . . . . . 81.7 mtt85 -81.17 -34.0 32.66 Favored 'General case' 0 N--CA 1.451 -0.378 0 N-CA-C 110.188 -0.301 . . . . 0.0 110.188 177.774 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 147' ' ' SER . . . . . . . . . . . . . 37.7 m 41.85 50.65 4.1 Favored 'General case' 0 C--N 1.344 0.359 0 C-N-CA 123.647 0.779 . . . . 0.0 110.893 178.793 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -36.91 -41.74 0.35 Allowed 'General case' 0 N--CA 1.448 -0.555 0 C-N-CA 126.279 1.832 . . . . 0.0 113.145 179.471 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 149' ' ' CYS . . . . . . . . . . . . . 13.9 p -71.29 -61.42 1.78 Allowed 'General case' 0 N--CA 1.448 -0.529 0 N-CA-C 109.976 -0.379 . . . . 0.0 109.976 -177.186 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 150' ' ' PHE . . . . . . . . . . . . . 15.6 m-85 -66.89 -16.31 64.23 Favored 'General case' 0 N--CA 1.454 -0.256 0 CA-C-N 118.561 0.618 . . . . 0.0 111.421 -175.399 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 151' ' ' ALA . . . . . . . . . . . . . . . -73.94 -46.69 42.61 Favored 'General case' 0 N--CA 1.449 -0.497 0 CA-C-O 119.438 -0.315 . . . . 0.0 110.447 176.546 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 152' ' ' MET . . . . . . . . . . . . . 93.4 mtp -85.74 -31.47 22.39 Favored 'General case' 0 CA--C 1.532 0.258 0 N-CA-C 112.71 0.633 . . . . 0.0 112.71 -179.259 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 153' ' ' ASP . . . . . . . . . . . . . 72.6 m-20 -74.55 -12.73 60.54 Favored 'General case' 0 N--CA 1.455 -0.221 0 C-N-CA 124.009 0.924 . . . . 0.0 112.735 -175.627 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 154' ' ' LEU . . . . . . . . . . . . . 79.6 mt -126.81 144.65 50.9 Favored 'General case' 0 N--CA 1.453 -0.322 0 CA-C-N 118.274 0.488 . . . . 0.0 110.799 -176.823 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 155' ' ' GLU . . . . . . . . . . . . . 1.9 pp20? -137.72 4.85 2.6 Favored 'General case' 0 N--CA 1.455 -0.221 0 C-N-CA 123.746 0.818 . . . . 0.0 111.454 -177.293 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 156' ' ' HIS . . . . . . . . . . . . . 33.1 p-80 -59.77 128.92 39.34 Favored 'General case' 0 N--CA 1.451 -0.423 0 CA-C-O 121.304 0.574 . . . . 0.0 111.389 -172.01 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 157' ' ' HIS . . . . . . . . . . . . . 20.2 t-160 -161.83 19.78 0.11 Allowed 'General case' 0 CA--C 1.532 0.257 0 C-N-CA 124.855 1.262 . . . . 0.0 108.31 175.222 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 158' ' ' HIS . . . . . . . . . . . . . 16.6 p80 -156.07 169.66 23.97 Favored 'General case' 0 N--CA 1.45 -0.459 0 C-N-CA 123.968 0.907 . . . . 0.0 109.378 -170.929 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 159' ' ' HIS . . . . . . . . . . . . . 50.2 p-80 . . . . . 0 C--O 1.25 1.125 0 CA-C-O 117.295 -1.336 . . . . 0.0 109.826 -179.461 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' B' B 2052 ' ' ASP . . . . . 0.508 ' OD1' ' HE2' ' A' ' 21' ' ' LYS . 0.8 OUTLIER . . . . . 0 N--CA 1.472 0.661 0 CA-C-O 120.276 0.084 . . . . 0.0 110.793 . . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B 2053 ' ' ASP . . . . . . . . . . . . . 35.9 p-10 -100.7 9.04 42.94 Favored 'General case' 0 CA--C 1.532 0.257 0 C-N-CA 123.736 0.814 . . . . 0.0 112.464 -176.027 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B 2054 ' ' ASP . . . . . 0.491 ' CG ' ' HG ' ' A' ' 25' ' ' SER . 3.0 p-10 -140.1 -158.5 0.86 Allowed 'General case' 0 N--CA 1.454 -0.249 0 CA-C-N 118.863 0.756 . . . . 0.0 111.218 -179.71 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B 2055 ' ' GLU . . . . . . . . . . . . . 41.5 mt-10 -59.89 -21.68 61.36 Favored 'General case' 0 CA--C 1.529 0.143 0 C-N-CA 124.135 0.974 . . . . 0.0 112.411 -176.539 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B 2056 ' ' ASP . . . . . 0.456 ' CG ' ' H2 ' ' B' 2052 ' ' ASP . 17.8 m-20 47.56 -118.26 0.91 Allowed 'General case' 0 N--CA 1.454 -0.258 0 C-N-CA 123.256 0.622 . . . . 0.0 110.922 -175.106 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B 2057 ' ' ASP . . . . . . . . . . . . . 43.1 t0 -55.5 96.7 0.02 OUTLIER 'General case' 0 CA--C 1.531 0.237 0 C-N-CA 123.761 0.824 . . . . 0.0 112.084 -173.195 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B 2058 ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -71.82 137.92 47.94 Favored 'General case' 0 N--CA 1.454 -0.262 0 C-N-CA 124.277 1.031 . . . . 0.0 110.673 -178.89 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B 2059 ' ' THR . . . . . . . . . . . . . 60.2 m -106.95 114.04 61.97 Favored Pre-proline 0 N--CA 1.453 -0.278 0 N-CA-C 109.199 -0.667 . . . . 0.0 109.199 178.158 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B 2060 ' ' PRO . . . . . . . . . . . . . 93.4 Cg_endo -74.26 132.5 16.54 Favored 'Trans proline' 0 N--CA 1.452 -0.968 0 C-N-CA 123.13 2.554 . . . . 0.0 111.348 -179.401 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B 2061 ' ' SER . . . . . . . . . . . . . 43.4 m -83.31 138.21 33.65 Favored 'General case' 0 N--CA 1.454 -0.232 0 N-CA-C 108.562 -0.903 . . . . 0.0 108.562 172.231 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B 2062 ' ' ILE . . . . . . . . . . . . . 5.9 tp -160.67 137.48 2.06 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.203 0 N-CA-C 112.693 0.627 . . . . 0.0 112.693 -176.973 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B 2063 ' ' SER . . . . . 0.405 ' C ' HH21 ' A' ' 133' ' ' ARG . 82.4 p . . . . . 0 C--O 1.251 1.173 0 CA-C-O 117.266 -1.349 . . . . 0.0 109.533 175.516 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 85.9 mtp . . . . . 0 N--CA 1.469 0.517 0 CA-C-O 119.239 -0.41 . . . . 0.0 110.727 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 24.5 mp0 -132.63 8.13 4.18 Favored 'General case' 0 C--N 1.341 0.23 0 N-CA-C 112.985 0.735 . . . . 0.0 112.985 -179.372 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 44.6 tp60 -153.0 -31.03 0.13 Allowed 'General case' 0 C--N 1.341 0.206 0 CA-C-N 118.585 0.63 . . . . 0.0 111.223 178.936 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 2.3 p-10 -78.28 160.28 27.98 Favored 'General case' 0 N--CA 1.452 -0.353 0 C-N-CA 123.443 0.697 . . . . 0.0 110.163 176.245 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 13.7 m-20 -80.83 24.79 0.47 Allowed 'General case' 0 N--CA 1.458 -0.063 0 N-CA-C 113.53 0.937 . . . . 0.0 113.53 -175.035 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 22.4 p-10 -67.05 -31.54 72.12 Favored 'General case' 0 C--N 1.334 -0.102 0 CA-C-O 121.275 0.559 . . . . 0.0 109.602 -177.806 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' PHE . . . . . 0.495 ' CE1' ' HD3' ' A' ' 45' ' ' LYS . 1.4 t80 -55.28 -34.72 64.34 Favored 'General case' 0 N--CA 1.447 -0.59 0 C-N-CA 125.007 1.323 . . . . 0.0 111.022 -178.314 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 50.8 tp60 -53.68 -34.82 59.99 Favored 'General case' 0 N--CA 1.454 -0.262 0 C-N-CA 123.448 0.699 . . . . 0.0 112.059 -177.189 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 27.9 m-80 -72.3 -33.36 67.34 Favored 'General case' 0 N--CA 1.453 -0.311 0 N-CA-C 110.052 -0.351 . . . . 0.0 110.052 -179.529 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' PHE . . . . . 0.506 ' CZ ' HG12 ' A' ' 46' ' ' ILE . 6.4 t80 -70.19 -39.39 75.23 Favored 'General case' 0 N--CA 1.45 -0.439 0 N-CA-C 108.794 -0.817 . . . . 0.0 108.794 176.18 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 88.3 t -65.89 -53.38 38.62 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.271 0 N-CA-C 109.163 -0.68 . . . . 0.0 109.163 179.054 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -58.2 -30.62 66.61 Favored 'General case' 0 N--CA 1.455 -0.221 0 C-N-CA 122.716 0.406 . . . . 0.0 111.305 -179.312 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 91.4 m -71.13 -40.36 71.44 Favored 'General case' 0 N--CA 1.453 -0.325 0 N-CA-C 109.131 -0.692 . . . . 0.0 109.131 176.213 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . 0.448 ' HA ' ' CD1' ' A' ' 17' ' ' PHE . 8.2 tp -65.9 -41.55 91.33 Favored 'General case' 0 N--CA 1.449 -0.476 0 CA-C-O 121.416 0.627 . . . . 0.0 109.869 179.473 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 73.2 mm-40 -63.81 -27.96 69.54 Favored 'General case' 0 N--CA 1.448 -0.545 0 C-N-CA 124.133 0.973 . . . . 0.0 109.949 177.931 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 51.0 m -69.78 -30.65 68.27 Favored 'General case' 0 N--CA 1.453 -0.29 0 N-CA-C 109.74 -0.467 . . . . 0.0 109.74 176.474 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' PHE . . . . . 0.454 ' CD1' HD11 ' A' ' 68' ' ' ILE . 33.6 m-85 -69.98 -33.16 71.69 Favored 'General case' 0 C--N 1.339 0.137 0 C-N-CA 119.469 -0.892 . . . . 0.0 111.065 171.982 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . 0.462 ' HG2' ' CE1' ' A' ' 53' ' ' TYR . 70.0 mttt -67.37 -24.18 65.67 Favored 'General case' 0 N--CA 1.462 0.152 0 CA-C-O 120.918 0.389 . . . . 0.0 110.496 174.739 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 31.2 t0 -79.37 -46.35 17.8 Favored 'General case' 0 C--N 1.334 -0.075 0 CA-C-N 116.521 -0.309 . . . . 0.0 110.653 175.469 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 13.5 mt -54.63 126.67 24.77 Favored 'General case' 0 N--CA 1.457 -0.112 0 CA-C-O 120.894 0.378 . . . . 0.0 111.556 -176.666 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 1.2 mppt? -74.06 -23.28 59.35 Favored 'General case' 0 N--CA 1.456 -0.168 0 N-CA-C 108.988 -0.745 . . . . 0.0 108.988 175.194 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 34.6 m -82.67 -20.89 35.32 Favored 'General case' 0 N--CA 1.455 -0.184 0 C-N-CA 122.923 0.489 . . . . 0.0 110.637 174.916 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 72.21 -42.52 0.8 Allowed Glycine 0 CA--C 1.527 0.829 0 C-N-CA 124.982 1.277 . . . . 0.0 111.831 -177.168 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 84.1 mt -75.52 149.43 6.95 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.392 0 C-N-CA 123.995 0.918 . . . . 0.0 111.109 177.911 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 31.2 t -167.18 93.31 0.43 Allowed 'General case' 0 CA--C 1.518 -0.281 0 N-CA-C 108.847 -0.797 . . . . 0.0 108.847 169.791 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -55.23 -35.51 60.43 Favored Glycine 0 C--N 1.332 0.349 0 N-CA-C 110.709 -0.956 . . . . 0.0 110.709 -176.834 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' SER . . . . . 0.513 ' H ' ' HB3' ' B' 2055 ' ' GLU . 30.3 t -61.83 -53.15 59.85 Favored 'General case' 0 N--CA 1.449 -0.494 0 N-CA-C 109.752 -0.462 . . . . 0.0 109.752 -179.153 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 82.5 mmt-85 -68.87 -40.6 79.2 Favored 'General case' 0 C--O 1.231 0.123 0 C-N-CA 122.941 0.496 . . . . 0.0 110.417 -179.446 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 65.6 mt -57.37 -45.13 85.32 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.657 0 N-CA-C 108.559 -0.904 . . . . 0.0 108.559 177.931 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 51.0 mtmt -68.52 -27.27 65.96 Favored 'General case' 0 N--CA 1.456 -0.132 0 CA-C-O 118.65 -0.691 . . . . 0.0 111.51 179.531 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . 0.4 ' CA ' ' HE3' ' A' ' 31' ' ' LYS . 0.0 OUTLIER -63.59 -59.61 4.4 Favored 'General case' 0 C--N 1.341 0.232 0 CA-C-N 119.131 0.878 . . . . 0.0 110.163 177.299 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . 0.476 ' HB2' ' CE2' ' A' ' 10' ' ' PHE . 1.6 pp -75.67 -19.22 59.29 Favored 'General case' 0 CA--C 1.532 0.28 0 C-N-CA 119.263 -0.975 . . . . 0.0 111.64 -176.924 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 21.4 m -69.61 -42.93 73.71 Favored 'General case' 0 CA--C 1.52 -0.174 0 N-CA-C 108.845 -0.798 . . . . 0.0 108.845 175.927 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 87.4 m -72.1 -41.54 67.18 Favored 'General case' 0 N--CA 1.448 -0.552 0 CA-C-N 116.482 -0.326 . . . . 0.0 110.374 -175.995 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 58.3 t80 -63.98 -31.34 72.49 Favored 'General case' 0 N--CA 1.456 -0.163 0 C-N-CA 119.946 -0.701 . . . . 0.0 109.842 178.436 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -72.02 -27.66 62.87 Favored 'General case' 0 N--CA 1.447 -0.589 0 CA-C-O 119.385 -0.34 . . . . 0.0 110.682 174.414 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -76.39 -39.14 54.51 Favored 'General case' 0 CA--C 1.519 -0.229 0 N-CA-C 107.79 -1.189 . . . . 0.0 107.79 -175.89 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 77.0 m-20 -67.4 -15.28 63.59 Favored 'General case' 0 N--CA 1.441 -0.883 0 C-N-CA 124.981 1.312 . . . . 0.0 111.331 176.927 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 97.0 m-70 -153.42 91.55 1.51 Allowed 'General case' 0 N--CA 1.451 -0.415 0 C-N-CA 123.265 0.626 . . . . 0.0 111.137 -175.569 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 40' ' ' ILE . . . . . 0.479 ' H ' HD13 ' A' ' 40' ' ' ILE . 0.0 OUTLIER -70.07 -14.83 18.64 Favored 'Isoleucine or valine' 0 C--O 1.226 -0.176 0 O-C-N 121.788 -0.57 . . . . 0.0 109.789 173.11 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 20.9 m-20 -57.91 -10.49 1.78 Allowed 'General case' 0 CA--C 1.532 0.255 0 C-N-CA 125.248 1.419 . . . . 0.0 113.897 -177.672 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -118.54 9.04 6.85 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.192 0 C-N-CA 124.114 0.966 . . . . 0.0 111.335 179.714 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 3.0 pp20? -47.76 -31.07 4.44 Favored 'General case' 0 C--N 1.331 -0.212 0 O-C-N 121.996 -0.44 . . . . 0.0 112.122 176.638 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 2.5 m -71.58 -39.03 70.83 Favored 'General case' 0 CA--C 1.53 0.211 0 O-C-N 121.794 -0.566 . . . . 0.0 111.234 -175.665 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . 0.495 ' HD3' ' CE1' ' A' ' 7' ' ' PHE . 19.1 ptpt -74.16 -24.5 59.41 Favored 'General case' 0 CA--C 1.531 0.24 0 O-C-N 121.637 -0.665 . . . . 0.0 109.719 176.357 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 46' ' ' ILE . . . . . 0.506 HG12 ' CZ ' ' A' ' 10' ' ' PHE . 97.7 mt -72.75 -47.37 50.2 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.237 0 C-N-CA 122.514 0.326 . . . . 0.0 110.206 -179.642 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 33.6 mm -62.79 -36.59 76.11 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.181 0 N-CA-C 109.183 -0.673 . . . . 0.0 109.183 177.454 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 47.1 m -62.84 -38.4 90.64 Favored 'General case' 0 N--CA 1.455 -0.202 0 C-N-CA 120.978 -0.289 . . . . 0.0 111.228 179.213 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 18.6 mt -74.68 -35.17 62.77 Favored 'General case' 0 N--CA 1.451 -0.413 0 N-CA-C 113.176 0.806 . . . . 0.0 113.176 -178.278 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 19.4 pt -69.59 -39.99 79.0 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.181 0 CA-C-N 118.925 0.784 . . . . 0.0 110.258 -178.893 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 36.0 pt -67.21 -42.79 88.38 Favored 'Isoleucine or valine' 0 C--N 1.338 0.092 0 C-N-CA 119.701 -0.799 . . . . 0.0 110.246 178.514 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 85.3 m-20 -63.96 -46.4 84.81 Favored 'General case' 0 N--CA 1.455 -0.208 0 CA-C-N 118.117 0.417 . . . . 0.0 110.886 -179.806 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 53' ' ' TYR . . . . . 0.462 ' CE1' ' HG2' ' A' ' 18' ' ' LYS . 12.1 t80 -63.59 -43.02 98.19 Favored 'General case' 0 N--CA 1.453 -0.314 0 N-CA-C 109.925 -0.398 . . . . 0.0 109.925 -179.819 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 24.2 m -66.0 -30.17 70.68 Favored 'General case' 0 N--CA 1.454 -0.24 0 CA-C-N 118.024 0.375 . . . . 0.0 111.757 -175.923 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 83.0 mtt-85 -76.62 -54.46 6.64 Favored 'General case' 0 N--CA 1.454 -0.251 0 CA-C-N 118.053 0.388 . . . . 0.0 111.523 -177.938 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . 0.424 ' N ' ' CD2' ' A' ' 56' ' ' LEU . 2.8 mm? -75.42 -20.16 59.05 Favored 'General case' 0 N--CA 1.455 -0.204 0 N-CA-C 113.863 1.06 . . . . 0.0 113.863 -174.084 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 57' ' ' CYS . . . . . 0.406 ' HB2' ' CB ' ' A' ' 61' ' ' HIS . 8.5 p -83.82 157.22 63.92 Favored Pre-proline 0 CA--C 1.537 0.465 0 N-CA-C 113.611 0.967 . . . . 0.0 113.611 -172.634 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 75.9 Cg_endo -75.4 -174.2 1.9 Allowed 'Trans proline' 0 N--CA 1.459 -0.507 1 C-N-CA 125.644 4.229 . . . . 0.0 111.82 174.358 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 38.5 p-10 -57.76 -50.22 73.97 Favored 'General case' 0 CA--C 1.529 0.155 0 C-N-CA 125.022 1.329 . . . . 0.0 114.407 -171.868 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 39.9 m -71.52 -32.21 67.92 Favored 'General case' 0 C--N 1.333 -0.134 0 O-C-N 122.074 -0.392 . . . . 0.0 110.428 -174.863 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 61' ' ' HIS . . . . . 0.406 ' CB ' ' HB2' ' A' ' 57' ' ' CYS . 61.5 m170 -75.39 -27.83 59.23 Favored 'General case' 0 N--CA 1.451 -0.414 0 C-N-CA 122.608 0.363 . . . . 0.0 110.207 176.464 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 45.6 tptt -68.97 -40.22 78.97 Favored 'General case' 0 N--CA 1.451 -0.425 0 N-CA-C 109.664 -0.495 . . . . 0.0 109.664 177.812 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 1.8 tm? -73.21 -35.43 66.32 Favored 'General case' 0 N--CA 1.454 -0.241 0 N-CA-C 109.537 -0.542 . . . . 0.0 109.537 178.6 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -69.39 -29.35 71.79 Favored Glycine 0 CA--C 1.525 0.718 0 N-CA-C 110.646 -0.982 . . . . 0.0 110.646 175.765 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 43.9 t -71.11 -42.74 68.89 Favored 'General case' 0 N--CA 1.454 -0.241 0 CA-C-N 117.566 0.683 . . . . 0.0 110.133 176.797 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 72.3 mt -68.01 -24.46 65.12 Favored 'General case' 0 N--CA 1.452 -0.358 0 N-CA-C 110.151 -0.314 . . . . 0.0 110.151 179.104 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 2.0 m-85 -70.04 -39.62 75.63 Favored 'General case' 0 N--CA 1.454 -0.274 0 C-N-CA 122.288 0.235 . . . . 0.0 110.815 172.802 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 68' ' ' ILE . . . . . 0.454 HD11 ' CD1' ' A' ' 17' ' ' PHE . 20.3 mt -67.07 -46.6 84.16 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.381 0 N-CA-C 108.728 -0.841 . . . . 0.0 108.728 177.994 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 97.3 mt -57.24 -36.48 52.23 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.121 0 C-N-CA 123.366 0.666 . . . . 0.0 111.028 175.729 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 22.2 t70 -70.18 -43.59 70.49 Favored 'General case' 0 N--CA 1.455 -0.223 0 CA-C-N 117.883 0.31 . . . . 0.0 110.912 178.437 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 30.1 t -67.25 -53.39 30.5 Favored 'General case' 0 N--CA 1.452 -0.351 0 CA-C-N 116.553 -0.294 . . . . 0.0 110.759 -177.458 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -75.13 -33.34 28.53 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.304 0 N-CA-C 109.911 -0.403 . . . . 0.0 109.911 -177.532 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -68.62 -45.33 67.08 Favored Glycine 0 C--N 1.338 0.67 0 CA-C-O 119.703 -0.498 . . . . 0.0 112.074 -176.155 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 33.4 mtm105 -71.01 -40.9 71.54 Favored 'General case' 0 N--CA 1.452 -0.329 0 CA-C-N 117.651 0.726 . . . . 0.0 109.695 177.143 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -61.22 -37.15 81.98 Favored 'General case' 0 N--CA 1.453 -0.297 0 C-N-CA 120.871 -0.332 . . . . 0.0 110.442 -178.673 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 2.4 m-30 -70.19 -47.5 61.25 Favored 'General case' 0 N--CA 1.453 -0.299 0 CA-C-N 118.033 0.379 . . . . 0.0 111.112 178.235 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -65.86 -38.27 88.38 Favored 'General case' 0 N--CA 1.444 -0.761 0 C-N-CA 118.935 -1.106 . . . . 0.0 108.675 -176.98 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 95.5 m-20 -63.49 -45.04 92.57 Favored 'General case' 0 N--CA 1.455 -0.188 0 N-CA-C 111.792 0.293 . . . . 0.0 111.792 177.255 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 14.5 tm-20 -63.54 -46.86 84.03 Favored 'General case' 0 N--CA 1.447 -0.579 0 CA-C-N 117.679 0.218 . . . . 0.0 111.215 -177.698 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 52.7 p -73.79 -18.53 60.95 Favored 'General case' 0 N--CA 1.453 -0.301 0 N-CA-C 112.068 0.396 . . . . 0.0 112.068 179.611 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 20.3 ttm105 -75.77 -37.13 59.52 Favored 'General case' 0 N--CA 1.455 -0.182 0 CA-C-N 118.161 0.437 . . . . 0.0 109.881 171.425 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 30.9 t -76.09 -34.27 59.53 Favored 'General case' 0 N--CA 1.456 -0.17 0 C-N-CA 122.997 0.519 . . . . 0.0 112.385 -179.331 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 47.1 m-20 -125.21 167.68 14.51 Favored 'General case' 0 N--CA 1.455 -0.213 0 CA-C-O 120.867 0.365 . . . . 0.0 111.926 -170.027 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 31.9 t -69.32 13.94 0.11 Allowed 'General case' 0 CA--C 1.535 0.4 0 N-CA-C 113.789 1.033 . . . . 0.0 113.789 -174.543 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 83.4 m-20 -76.38 -3.05 34.88 Favored 'General case' 0 CA--C 1.53 0.204 0 O-C-N 121.722 -0.611 . . . . 0.0 111.79 179.003 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 37.1 t -66.46 137.38 56.79 Favored 'General case' 0 N--CA 1.454 -0.256 0 N-CA-C 109.736 -0.468 . . . . 0.0 109.736 176.882 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 78.0 p -166.94 -170.99 1.68 Allowed 'General case' 0 N--CA 1.454 -0.253 0 N-CA-C 109.071 -0.714 . . . . 0.0 109.071 -176.88 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 32.2 t -148.46 154.82 40.39 Favored 'General case' 0 N--CA 1.454 -0.242 0 N-CA-C 110.26 -0.274 . . . . 0.0 110.26 177.881 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 7.1 m120 54.5 34.61 21.48 Favored 'General case' 0 CA--C 1.535 0.37 0 N-CA-C 113.686 0.995 . . . . 0.0 113.686 176.682 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 90' ' ' LYS . . . . . 0.407 ' HE3' ' HB3' ' A' ' 90' ' ' LYS . 21.0 ttpp -146.96 132.23 9.1 Favored Pre-proline 0 CA--C 1.534 0.333 0 CA-C-N 118.598 0.635 . . . . 0.0 111.348 -178.266 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 85.9 Cg_endo -72.64 167.62 26.63 Favored 'Trans proline' 0 N--CA 1.453 -0.885 0 C-N-CA 123.599 2.866 . . . . 0.0 109.746 174.371 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 80.61 17.89 72.09 Favored Glycine 0 CA--C 1.525 0.663 0 N-CA-C 111.489 -0.644 . . . . 0.0 111.489 179.306 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -156.78 166.68 32.68 Favored 'General case' 0 N--CA 1.455 -0.208 0 C-N-CA 124.811 1.244 . . . . 0.0 108.918 -178.809 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 94' ' ' CYS . . . . . . . . . . . . . 30.5 p -59.47 -18.59 40.99 Favored 'General case' 0 N--CA 1.451 -0.424 0 C-N-CA 122.358 0.263 . . . . 0.0 110.535 178.382 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -56.55 -63.09 1.31 Allowed 'General case' 0 N--CA 1.449 -0.48 0 C-N-CA 122.333 0.253 . . . . 0.0 110.62 -177.658 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 76.0 t60 -72.25 -33.54 67.58 Favored 'General case' 0 N--CA 1.449 -0.515 0 CA-C-N 116.949 -0.114 . . . . 0.0 110.739 -179.556 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -63.48 -54.1 41.63 Favored 'General case' 0 N--CA 1.452 -0.347 0 O-C-N 123.021 0.201 . . . . 0.0 111.375 -177.333 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 1.7 mp -70.13 -36.7 69.24 Favored 'Isoleucine or valine' 0 C--N 1.337 0.05 0 CA-C-N 117.778 0.263 . . . . 0.0 110.428 -179.505 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 35.9 m-20 -67.69 -45.22 75.77 Favored 'General case' 0 N--CA 1.454 -0.27 0 CA-C-N 117.916 0.325 . . . . 0.0 111.316 -178.512 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 98.1 m -70.27 -31.7 69.19 Favored 'General case' 0 N--CA 1.453 -0.308 0 N-CA-C 110.125 -0.324 . . . . 0.0 110.125 -177.797 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 53.7 tp -74.06 -38.34 63.98 Favored 'General case' 0 N--CA 1.449 -0.476 0 CA-C-O 119.626 -0.226 . . . . 0.0 111.058 179.439 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -65.96 -22.64 70.59 Favored Glycine 0 CA--C 1.53 1.009 0 CA-C-O 119.811 -0.438 . . . . 0.0 113.216 -174.562 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 17.3 mm-40 -78.84 -36.4 42.55 Favored 'General case' 0 N--CA 1.456 -0.127 0 CA-C-N 117.877 0.839 . . . . 0.0 111.455 179.186 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 19.6 m -105.02 -8.4 9.84 Favored 'Isoleucine or valine' 0 CA--C 1.527 0.089 0 N-CA-C 112.895 0.702 . . . . 0.0 112.895 -174.492 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 105' ' ' ILE . . . . . . . . . . . . . 10.6 tp -59.59 -26.79 35.78 Favored 'Isoleucine or valine' 0 C--N 1.337 0.062 0 CA-C-N 119.484 1.038 . . . . 0.0 110.587 -179.32 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 27.7 pt20 -66.97 -29.05 68.79 Favored 'General case' 0 N--CA 1.45 -0.432 0 N-CA-C 110.325 -0.25 . . . . 0.0 110.325 177.434 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 60.7 mt-10 -75.96 -36.44 59.3 Favored 'General case' 0 CA--C 1.529 0.153 0 N-CA-C 109.94 -0.393 . . . . 0.0 109.94 177.137 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 10.7 mp -71.69 -41.3 68.83 Favored 'General case' 0 N--CA 1.448 -0.543 0 N-CA-C 109.892 -0.41 . . . . 0.0 109.892 179.847 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 91.5 mt -70.72 -53.14 16.75 Favored 'General case' 0 N--CA 1.455 -0.183 0 CA-C-O 119.526 -0.273 . . . . 0.0 111.176 -179.581 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 9.8 p -47.14 -55.79 7.79 Favored 'General case' 0 C--N 1.34 0.162 0 C-N-CA 122.664 0.386 . . . . 0.0 111.067 177.474 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 18.5 t0 -59.76 -37.71 79.76 Favored 'General case' 0 N--CA 1.446 -0.665 0 N-CA-C 109.475 -0.565 . . . . 0.0 109.475 -179.808 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -68.65 -37.61 79.8 Favored 'General case' 0 N--CA 1.444 -0.761 0 C-N-CA 119.862 -0.735 . . . . 0.0 110.814 -176.504 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 113' ' ' ILE . . . . . . . . . . . . . 27.5 mm -67.71 -39.38 81.98 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.288 0 C-N-CA 119.331 -0.948 . . . . 0.0 110.211 -178.16 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -75.2 -43.57 51.23 Favored 'General case' 0 CA--C 1.53 0.201 0 N-CA-C 112.073 0.397 . . . . 0.0 112.073 179.265 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 39.4 ttmt -75.73 -38.31 58.59 Favored 'General case' 0 C--N 1.338 0.079 0 C-N-CA 123.486 0.714 . . . . 0.0 112.538 -175.263 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 54.9 p -74.66 154.09 38.64 Favored 'General case' 0 N--CA 1.453 -0.294 0 N-CA-C 112.692 0.627 . . . . 0.0 112.692 -170.735 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 21.5 t-20 -75.76 163.81 26.89 Favored 'General case' 0 N--CA 1.454 -0.267 0 N-CA-C 108.84 -0.8 . . . . 0.0 108.84 178.131 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 118' ' ' GLN . . . . . . . . . . . . . 26.5 mm100 -49.59 -51.91 33.99 Favored 'General case' 0 N--CA 1.457 -0.079 0 C-N-CA 123.117 0.567 . . . . 0.0 111.726 -171.61 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 16.0 t0 -57.16 -41.59 79.46 Favored 'General case' 0 C--O 1.23 0.04 0 N-CA-C 109.859 -0.422 . . . . 0.0 109.859 -179.761 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 68.3 m-70 -68.84 -34.4 75.42 Favored 'General case' 0 N--CA 1.447 -0.597 0 CA-C-O 118.981 -0.533 . . . . 0.0 110.603 -179.709 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 60.5 mttm -57.64 -42.81 84.17 Favored 'General case' 0 N--CA 1.464 0.267 0 CA-C-N 118.958 0.799 . . . . 0.0 109.845 177.319 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 29.6 mm-40 -75.62 -32.83 60.42 Favored 'General case' 0 N--CA 1.449 -0.478 0 N-CA-C 112.282 0.475 . . . . 0.0 112.282 -178.002 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 46.4 mtmt -67.5 -28.98 68.3 Favored 'General case' 0 C--N 1.332 -0.193 0 C-N-CA 120.046 -0.662 . . . . 0.0 109.427 176.791 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 124' ' ' ILE . . . . . . . . . . . . . 62.2 mt -69.89 -38.79 76.57 Favored 'Isoleucine or valine' 0 C--O 1.226 -0.143 0 N-CA-C 109.463 -0.569 . . . . 0.0 109.463 171.812 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -56.39 -49.05 75.6 Favored 'General case' 0 C--N 1.341 0.219 0 O-C-N 122.185 -0.322 . . . . 0.0 110.468 179.818 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 126' ' ' MET . . . . . . . . . . . . . 27.8 ptm -69.41 -31.28 69.54 Favored 'General case' 0 N--CA 1.454 -0.243 0 C-N-CA 120.508 -0.477 . . . . 0.0 110.402 -179.582 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 2.1 mp -62.85 -32.77 74.07 Favored 'General case' 0 N--CA 1.456 -0.144 0 CA-C-N 118.568 0.622 . . . . 0.0 110.547 176.107 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 96.4 mt -72.43 -38.14 68.42 Favored 'General case' 0 N--CA 1.456 -0.162 0 CA-C-N 118.777 0.717 . . . . 0.0 109.927 177.291 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 50.9 m-20 -63.4 -36.34 83.39 Favored 'General case' 0 N--CA 1.456 -0.174 0 N-CA-C 109.796 -0.446 . . . . 0.0 109.796 175.375 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 130' ' ' ILE . . . . . 0.565 ' HA ' ' CD ' ' A' ' 133' ' ' ARG . 55.0 mt -69.02 -31.97 52.51 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.278 0 C-N-CA 122.59 0.356 . . . . 0.0 110.615 179.404 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 131' ' ' TRP . . . . . . . . . . . . . 47.9 m0 -75.92 -26.7 57.17 Favored 'General case' 0 N--CA 1.452 -0.361 0 C-N-CA 120.12 -0.632 . . . . 0.0 111.651 175.303 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 66.2 m-20 -73.93 -46.67 42.81 Favored 'General case' 0 C--N 1.341 0.198 0 CA-C-N 118.065 0.393 . . . . 0.0 110.708 175.294 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 133' ' ' ARG . . . . . 0.565 ' CD ' ' HA ' ' A' ' 130' ' ' ILE . 8.4 ptm180 -75.05 -24.42 58.25 Favored 'General case' 0 N--CA 1.454 -0.246 0 C-N-CA 123.141 0.576 . . . . 0.0 112.382 -175.801 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 28.5 t -90.62 -5.44 55.86 Favored 'General case' 0 N--CA 1.452 -0.368 0 N-CA-C 111.781 0.289 . . . . 0.0 111.781 178.181 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 135' ' ' GLY . . . . . . . . . . . . . . . 74.44 14.25 81.1 Favored Glycine 0 CA--C 1.527 0.81 0 CA-C-O 119.679 -0.511 . . . . 0.0 112.939 177.526 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 136' ' ' LEU . . . . . . . . . . . . . 3.5 tt -70.1 -55.82 8.48 Favored 'General case' 0 CA--C 1.529 0.14 0 CA-C-N 117.928 0.864 . . . . 0.0 109.531 -178.543 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 137' ' ' PHE . . . . . . . . . . . . . 66.3 t80 -160.59 130.82 5.24 Favored 'General case' 0 N--CA 1.454 -0.248 0 N-CA-C 108.635 -0.876 . . . . 0.0 108.635 -178.262 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 138' ' ' GLN . . . . . . . . . . . . . 22.4 mp0 -81.79 136.79 35.39 Favored 'General case' 0 N--CA 1.451 -0.377 0 CA-C-O 120.921 0.391 . . . . 0.0 111.653 -175.999 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 139' ' ' LYS . . . . . . . . . . . . . 3.2 ttmp? -61.48 118.2 6.7 Favored 'General case' 0 N--CA 1.452 -0.34 0 C-N-CA 123.942 0.897 . . . . 0.0 108.752 175.052 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 140' ' ' SER . . . . . . . . . . . . . 35.0 t -89.21 -2.68 58.59 Favored 'General case' 0 CA--C 1.53 0.175 0 N-CA-C 112.806 0.669 . . . . 0.0 112.806 -176.783 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 141' ' ' TYR . . . . . . . . . . . . . 79.4 m-85 52.61 20.6 1.56 Allowed 'General case' 0 CA--C 1.533 0.321 0 C-N-CA 123.469 0.708 . . . . 0.0 112.46 -178.423 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 142' ' ' LEU . . . . . . . . . . . . . 59.6 tp -65.2 147.94 52.56 Favored 'General case' 0 N--CA 1.454 -0.246 0 C-N-CA 123.446 0.698 . . . . 0.0 110.185 -178.166 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 27.5 p-10 -61.05 -26.78 67.87 Favored 'General case' 0 N--CA 1.455 -0.18 0 N-CA-C 111.859 0.318 . . . . 0.0 111.859 -175.023 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . -64.61 -36.8 85.43 Favored 'General case' 0 N--CA 1.452 -0.348 0 N-CA-C 109.582 -0.525 . . . . 0.0 109.582 177.451 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 145' ' ' ILE . . . . . . . . . . . . . 24.3 mm -75.31 -27.75 19.72 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.311 0 N-CA-C 110.182 -0.303 . . . . 0.0 110.182 -179.967 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 146' ' ' ARG . . . . . . . . . . . . . 75.5 mtt180 -72.66 -20.47 61.24 Favored 'General case' 0 C--N 1.34 0.172 0 N-CA-C 109.574 -0.528 . . . . 0.0 109.574 174.82 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 147' ' ' SER . . . . . . . . . . . . . 36.2 t 57.74 55.99 5.13 Favored 'General case' 0 N--CA 1.451 -0.415 0 C-N-CA 123.341 0.657 . . . . 0.0 110.229 176.488 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 148' ' ' LYS . . . . . 0.567 ' HE2' ' HA ' ' A' ' 148' ' ' LYS . 8.0 mmpt? -55.78 -18.89 9.46 Favored 'General case' 0 N--CA 1.456 -0.137 0 N-CA-C 112.698 0.629 . . . . 0.0 112.698 -174.9 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 149' ' ' CYS . . . . . . . . . . . . . 60.6 m -63.78 -42.64 97.72 Favored 'General case' 0 N--CA 1.455 -0.208 0 CA-C-N 119.212 0.915 . . . . 0.0 109.716 177.481 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 150' ' ' PHE . . . . . . . . . . . . . 87.2 t80 -69.11 -22.89 63.94 Favored 'General case' 0 N--CA 1.453 -0.276 0 N-CA-C 109.871 -0.418 . . . . 0.0 109.871 179.16 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 151' ' ' ALA . . . . . . . . . . . . . . . -81.13 -28.32 35.16 Favored 'General case' 0 N--CA 1.45 -0.436 0 C-N-CA 122.484 0.314 . . . . 0.0 110.517 175.312 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 152' ' ' MET . . . . . . . . . . . . . 92.6 mtp -75.39 -20.5 58.91 Favored 'General case' 0 C--N 1.342 0.259 0 C-N-CA 122.795 0.438 . . . . 0.0 111.183 176.868 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 153' ' ' ASP . . . . . . . . . . . . . 60.1 m-20 -64.54 -9.66 20.53 Favored 'General case' 0 CA--C 1.535 0.383 0 N-CA-C 110.481 -0.192 . . . . 0.0 110.481 170.204 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 154' ' ' LEU . . . . . . . . . . . . . 77.9 mt -130.49 -177.92 4.55 Favored 'General case' 0 N--CA 1.455 -0.179 0 C-N-CA 124.936 1.294 . . . . 0.0 108.534 178.16 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 155' ' ' GLU . . . . . . . . . . . . . 13.3 pm0 -75.17 4.56 6.69 Favored 'General case' 0 CA--C 1.534 0.361 0 O-C-N 121.963 -0.461 . . . . 0.0 111.909 177.356 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 156' ' ' HIS . . . . . . . . . . . . . 32.5 m170 -77.96 43.53 0.43 Allowed 'General case' 0 CA--C 1.529 0.163 0 C-N-CA 124.786 1.234 . . . . 0.0 112.069 -175.265 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 157' ' ' HIS . . . . . . . . . . . . . 36.4 m170 -69.01 0.45 4.53 Favored 'General case' 0 CA--C 1.535 0.368 0 N-CA-C 112.597 0.591 . . . . 0.0 112.597 -176.553 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 158' ' ' HIS . . . . . . . . . . . . . 51.4 p-80 -73.07 163.88 27.51 Favored 'General case' 0 N--CA 1.456 -0.159 0 CA-C-N 118.576 0.626 . . . . 0.0 110.991 178.958 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 159' ' ' HIS . . . . . . . . . . . . . 30.7 m80 . . . . . 0 C--O 1.249 1.038 0 CA-C-O 117.181 -1.39 . . . . 0.0 111.429 -179.653 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' B' B 2052 ' ' ASP . . . . . . . . . . . . . 4.0 m-20 . . . . . 0 N--CA 1.476 0.83 0 N-CA-C 110.729 -0.1 . . . . 0.0 110.729 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' B' B 2053 ' ' ASP . . . . . . . . . . . . . 10.8 m-20 -148.88 164.03 35.68 Favored 'General case' 0 N--CA 1.453 -0.322 0 C-N-CA 123.419 0.688 . . . . 0.0 111.933 -173.993 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B 2054 ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -72.0 164.07 26.77 Favored 'General case' 0 CA--C 1.532 0.276 0 C-N-CA 125.103 1.361 . . . . 0.0 113.454 -177.938 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B 2055 ' ' GLU . . . . . 0.513 ' HB3' ' H ' ' A' ' 27' ' ' SER . 40.6 tt0 56.31 41.09 29.56 Favored 'General case' 0 CA--C 1.535 0.373 0 C-N-CA 125.801 1.64 . . . . 0.0 114.204 172.863 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B 2056 ' ' ASP . . . . . . . . . . . . . 40.2 p-10 -74.28 0.49 14.08 Favored 'General case' 0 CA--C 1.532 0.284 0 O-C-N 120.999 -1.063 . . . . 0.0 110.822 175.706 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B 2057 ' ' ASP . . . . . . . . . . . . . 34.6 p-10 -92.81 17.13 10.96 Favored 'General case' 0 CA--C 1.531 0.233 0 C-N-CA 124.9 1.28 . . . . 0.0 111.02 178.086 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B 2058 ' ' TYR . . . . . . . . . . . . . 72.9 t80 -53.36 148.67 8.5 Favored 'General case' 0 N--CA 1.454 -0.231 0 CA-C-O 121.456 0.646 . . . . 0.0 111.981 -179.077 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B 2059 ' ' THR . . . . . . . . . . . . . 54.6 m -134.36 132.9 21.2 Favored Pre-proline 0 N--CA 1.451 -0.392 0 N-CA-C 107.734 -1.21 . . . . 0.0 107.734 178.736 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B 2060 ' ' PRO . . . . . . . . . . . . . 88.4 Cg_endo -70.29 168.65 21.64 Favored 'Trans proline' 0 N--CA 1.449 -1.092 0 C-N-CA 123.274 2.649 . . . . 0.0 111.549 -177.112 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B 2061 ' ' SER . . . . . . . . . . . . . 23.3 t -77.6 159.65 29.09 Favored 'General case' 0 CA--C 1.531 0.218 0 N-CA-C 112.898 0.703 . . . . 0.0 112.898 -174.215 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B 2062 ' ' ILE . . . . . . . . . . . . . 12.1 mt 63.44 135.83 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.534 0.33 0 C-N-CA 127.109 2.164 . . . . 0.0 112.929 -178.909 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B 2063 ' ' SER . . . . . . . . . . . . . 30.2 t . . . . . 0 C--O 1.249 1.077 0 CA-C-O 117.501 -1.238 . . . . 0.0 112.045 -172.072 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 55.2 ttm . . . . . 0 N--CA 1.474 0.731 0 CA-C-O 121.258 0.552 . . . . 0.0 110.301 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 43.9 tt0 -160.75 127.84 4.23 Favored 'General case' 0 N--CA 1.454 -0.261 0 N-CA-C 107.54 -1.281 . . . . 0.0 107.54 177.987 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 16.5 mt-30 51.83 -142.86 0.71 Allowed 'General case' 0 CA--C 1.531 0.246 0 N-CA-C 108.49 -0.93 . . . . 0.0 108.49 -176.121 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 10.6 p-10 -81.59 109.66 16.24 Favored 'General case' 0 N--CA 1.448 -0.539 0 O-C-N 121.935 -0.478 . . . . 0.0 109.784 175.155 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 90.2 m-20 -69.96 -0.36 7.32 Favored 'General case' 0 C--N 1.339 0.124 0 CA-C-O 120.967 0.413 . . . . 0.0 111.632 175.815 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 22.0 m-20 -69.1 -19.02 64.05 Favored 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 108.85 -0.796 . . . . 0.0 108.85 176.904 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' PHE . . . . . 0.52 ' HB2' ' HZ3' ' A' ' 45' ' ' LYS . 1.4 t80 -58.26 -34.51 70.56 Favored 'General case' 0 N--CA 1.449 -0.497 0 C-N-CA 123.29 0.636 . . . . 0.0 109.779 179.55 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 51.0 tp60 -51.69 -36.75 47.81 Favored 'General case' 0 N--CA 1.456 -0.145 0 C-N-CA 124.545 1.138 . . . . 0.0 111.829 -177.668 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 26.5 m-80 -71.43 -34.85 70.66 Favored 'General case' 0 N--CA 1.454 -0.272 0 N-CA-C 109.821 -0.437 . . . . 0.0 109.821 -179.379 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' PHE . . . . . 0.471 ' CZ ' HG12 ' A' ' 46' ' ' ILE . 2.1 t80 -71.45 -38.2 71.33 Favored 'General case' 0 N--CA 1.45 -0.439 0 N-CA-C 109.078 -0.712 . . . . 0.0 109.078 178.24 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 86.8 t -66.48 -55.36 18.82 Favored 'Isoleucine or valine' 0 CA--C 1.52 -0.181 0 N-CA-C 109.106 -0.702 . . . . 0.0 109.106 178.448 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -58.01 -29.75 65.54 Favored 'General case' 0 N--CA 1.456 -0.13 0 C-N-CA 122.704 0.402 . . . . 0.0 111.996 -179.107 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 92.3 m -71.93 -39.77 69.22 Favored 'General case' 0 CA--C 1.53 0.209 0 N-CA-C 109.214 -0.661 . . . . 0.0 109.214 176.18 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . 0.417 ' HA ' ' CD1' ' A' ' 17' ' ' PHE . 0.1 OUTLIER -64.28 -45.45 87.97 Favored 'General case' 0 N--CA 1.45 -0.439 0 N-CA-C 109.076 -0.713 . . . . 0.0 109.076 177.145 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 72.5 mm-40 -64.91 -29.75 70.71 Favored 'General case' 0 N--CA 1.454 -0.267 0 C-N-CA 124.004 0.922 . . . . 0.0 110.264 179.798 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 70.5 m -67.18 -34.76 78.21 Favored 'General case' 0 N--CA 1.452 -0.348 0 N-CA-C 109.464 -0.569 . . . . 0.0 109.464 175.646 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' PHE . . . . . 0.417 ' CD1' ' HA ' ' A' ' 14' ' ' LEU . 15.4 m-85 -63.77 -39.98 95.59 Favored 'General case' 0 C--N 1.34 0.186 0 C-N-CA 120.176 -0.61 . . . . 0.0 109.821 174.657 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . 0.467 ' HG2' ' CE1' ' A' ' 53' ' ' TYR . 59.0 mttt -65.92 -29.45 69.87 Favored 'General case' 0 C--N 1.338 0.071 0 CA-C-N 117.625 0.193 . . . . 0.0 110.993 -179.122 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 60.6 t0 -75.16 -42.05 56.88 Favored 'General case' 0 N--CA 1.454 -0.242 0 O-C-N 123.374 0.421 . . . . 0.0 111.073 -179.189 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 14.1 mt -57.99 140.79 51.58 Favored 'General case' 0 N--CA 1.451 -0.396 0 C-N-CA 120.181 -0.608 . . . . 0.0 111.069 -176.483 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . 0.488 ' HE2' ' OD2' ' B' 2052 ' ' ASP . 1.1 mppt? -79.84 -21.42 44.19 Favored 'General case' 0 N--CA 1.454 -0.254 0 N-CA-C 109.319 -0.623 . . . . 0.0 109.319 176.543 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' SER . . . . . 0.445 ' C ' ' H ' ' A' ' 24' ' ' ILE . 85.8 p -76.75 -24.95 52.96 Favored 'General case' 0 CA--C 1.53 0.205 0 N-CA-C 109.557 -0.535 . . . . 0.0 109.557 169.82 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 71.7 -29.03 0.61 Allowed Glycine 0 CA--C 1.527 0.807 0 C-N-CA 125.294 1.426 . . . . 0.0 112.683 177.3 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . 0.445 ' H ' ' C ' ' A' ' 22' ' ' SER . 35.9 mt -89.73 155.07 3.12 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.557 0 N-CA-C 108.433 -0.951 . . . . 0.0 108.433 173.327 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 4.0 t -158.48 76.27 0.75 Allowed 'General case' 0 C--O 1.225 -0.199 0 CA-C-N 118.665 0.666 . . . . 0.0 110.518 -177.498 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -48.03 -49.86 22.91 Favored Glycine 0 CA--C 1.53 1.01 0 CA-C-O 118.592 -1.116 . . . . 0.0 115.403 -170.036 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' SER . . . . . 0.461 ' HG ' ' CG ' ' B' 2054 ' ' ASP . 60.1 p -71.7 -35.96 70.4 Favored 'General case' 0 C--N 1.34 0.19 0 CA-C-N 120.173 1.987 . . . . 0.0 110.871 -176.182 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 75.2 mtt85 -70.94 -37.91 72.87 Favored 'General case' 0 C--N 1.341 0.237 0 CA-C-N 118.236 0.471 . . . . 0.0 110.183 178.027 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 41.3 mt -56.45 -45.03 81.73 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.446 0 N-CA-C 107.811 -1.181 . . . . 0.0 107.811 174.159 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 52.8 mtmt -68.36 -23.73 64.72 Favored 'General case' 0 N--CA 1.454 -0.225 0 CA-C-O 118.458 -0.782 . . . . 0.0 112.341 177.544 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . 0.474 ' HA ' ' HE3' ' A' ' 31' ' ' LYS . 0.0 OUTLIER -66.1 -59.28 3.93 Favored 'General case' 0 C--N 1.344 0.331 0 CA-C-N 119.629 1.104 . . . . 0.0 110.35 177.345 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 1.4 pp -74.17 -17.97 60.84 Favored 'General case' 0 N--CA 1.455 -0.176 0 C-N-CA 119.267 -0.973 . . . . 0.0 111.695 -177.024 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 39.7 m -73.54 -37.04 65.73 Favored 'General case' 0 N--CA 1.457 -0.12 0 N-CA-C 109.621 -0.511 . . . . 0.0 109.621 176.18 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 97.6 m -74.05 -37.27 64.33 Favored 'General case' 0 N--CA 1.453 -0.301 0 N-CA-C 110.231 -0.285 . . . . 0.0 110.231 -179.297 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 71.7 t80 -67.55 -33.32 74.81 Favored 'General case' 0 N--CA 1.454 -0.229 0 N-CA-C 109.718 -0.475 . . . . 0.0 109.718 176.727 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -71.14 -31.01 67.19 Favored 'General case' 0 N--CA 1.451 -0.386 0 CA-C-O 119.722 -0.18 . . . . 0.0 111.2 177.595 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 13.1 mt -71.92 -40.88 68.48 Favored 'General case' 0 N--CA 1.454 -0.23 0 C-N-CA 122.349 0.26 . . . . 0.0 111.123 178.101 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 41.8 t0 -67.6 -21.51 65.41 Favored 'General case' 0 CA--C 1.532 0.28 0 N-CA-C 110.504 -0.184 . . . . 0.0 110.504 178.613 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 74.6 m80 -146.39 92.0 2.12 Favored 'General case' 0 N--CA 1.453 -0.314 0 CA-C-O 120.88 0.372 . . . . 0.0 111.197 -177.662 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 40' ' ' ILE . . . . . 0.557 ' H ' HD13 ' A' ' 40' ' ' ILE . 0.0 OUTLIER -72.63 -16.99 18.3 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.54 0 CA-C-O 118.965 -0.54 . . . . 0.0 110.816 176.8 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 3.8 m-20 -57.68 -22.7 47.55 Favored 'General case' 0 N--CA 1.456 -0.16 0 N-CA-C 112.864 0.69 . . . . 0.0 112.864 -176.264 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -102.57 14.79 5.94 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.159 0 C-N-CA 122.636 0.374 . . . . 0.0 111.876 177.098 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 2.8 pp20? -51.51 -34.02 34.2 Favored 'General case' 0 C--O 1.226 -0.153 0 O-C-N 121.475 -0.765 . . . . 0.0 111.23 178.042 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 30.9 t -58.39 -49.88 75.67 Favored 'General case' 0 CA--C 1.531 0.225 0 N-CA-C 112.279 0.474 . . . . 0.0 112.279 -176.853 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . 0.52 ' HZ3' ' HB2' ' A' ' 7' ' ' PHE . 19.4 ptpt -71.13 -23.22 62.04 Favored 'General case' 0 CA--C 1.529 0.153 0 O-C-N 121.959 -0.463 . . . . 0.0 110.326 -179.913 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 46' ' ' ILE . . . . . 0.471 HG12 ' CZ ' ' A' ' 10' ' ' PHE . 94.4 mt -75.2 -41.72 44.28 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.256 0 C-N-CA 122.888 0.475 . . . . 0.0 109.899 179.979 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 32.1 mm -62.61 -35.47 70.47 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.212 0 N-CA-C 109.185 -0.672 . . . . 0.0 109.185 175.672 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 17.9 t -63.59 -47.78 80.07 Favored 'General case' 0 N--CA 1.456 -0.152 0 C-N-CA 119.872 -0.731 . . . . 0.0 110.454 177.443 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 20.6 mt -64.5 -33.54 76.12 Favored 'General case' 0 N--CA 1.449 -0.496 0 CA-C-O 118.708 -0.663 . . . . 0.0 112.451 -175.788 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 24.6 pt -70.18 -42.71 79.12 Favored 'Isoleucine or valine' 0 C--O 1.226 -0.17 0 C-N-CA 119.366 -0.933 . . . . 0.0 110.669 178.554 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 43.3 pt -70.92 -39.96 75.85 Favored 'Isoleucine or valine' 0 C--N 1.342 0.264 0 CA-C-N 118.916 0.78 . . . . 0.0 110.68 179.756 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 76.3 m-20 -63.31 -48.86 76.29 Favored 'General case' 0 N--CA 1.454 -0.265 0 CA-C-N 117.783 0.265 . . . . 0.0 110.8 -179.987 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 53' ' ' TYR . . . . . 0.467 ' CE1' ' HG2' ' A' ' 18' ' ' LYS . 16.9 t80 -66.13 -47.14 75.08 Favored 'General case' 0 N--CA 1.454 -0.255 0 CA-C-O 119.443 -0.313 . . . . 0.0 110.41 -179.538 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 19.4 t -65.0 -27.91 69.15 Favored 'General case' 0 N--CA 1.454 -0.272 0 O-C-N 123.205 0.316 . . . . 0.0 111.796 -173.968 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . 0.422 HH22 ' CD ' ' A' ' 107' ' ' GLU . 90.2 mtt-85 -75.49 -51.29 13.34 Favored 'General case' 0 N--CA 1.455 -0.205 0 O-C-N 122.211 -0.306 . . . . 0.0 110.996 178.057 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 44.0 mt -75.17 -43.53 51.71 Favored 'General case' 0 N--CA 1.457 -0.112 0 N-CA-C 113.034 0.753 . . . . 0.0 113.034 -172.884 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 57' ' ' CYS . . . . . 0.464 ' O ' ' HE2' ' A' ' 62' ' ' LYS . 12.6 p -65.39 154.07 88.55 Favored Pre-proline 0 CA--C 1.538 0.483 0 N-CA-C 112.985 0.735 . . . . 0.0 112.985 -173.633 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 45.6 Cg_endo -80.23 -175.53 2.75 Favored 'Trans proline' 0 N--CA 1.458 -0.612 1 C-N-CA 125.381 4.054 . . . . 0.0 112.371 -179.557 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 35.4 t0 -36.86 -73.29 0.05 OUTLIER 'General case' 0 C--N 1.341 0.206 0 C-N-CA 126.422 1.889 . . . . 0.0 114.357 -174.134 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 19.7 m -61.88 -29.43 70.19 Favored 'General case' 0 C--O 1.232 0.138 0 O-C-N 122.079 -0.388 . . . . 0.0 111.544 -171.643 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 60.2 m80 -75.66 -29.2 59.0 Favored 'General case' 0 N--CA 1.45 -0.444 0 C-N-CA 122.467 0.307 . . . . 0.0 110.62 178.516 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . 0.464 ' HE2' ' O ' ' A' ' 57' ' ' CYS . 66.4 mttm -68.33 -37.85 80.96 Favored 'General case' 0 C--N 1.34 0.182 0 N-CA-C 109.092 -0.707 . . . . 0.0 109.092 174.241 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -61.61 -44.66 96.59 Favored 'General case' 0 C--N 1.341 0.213 0 N-CA-C 108.437 -0.949 . . . . 0.0 108.437 177.321 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -68.76 -28.31 73.2 Favored Glycine 0 CA--C 1.526 0.733 0 N-CA-C 111.609 -0.596 . . . . 0.0 111.609 -179.539 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 37.0 p -67.73 -36.94 81.49 Favored 'General case' 0 N--CA 1.452 -0.326 0 CA-C-N 117.965 0.883 . . . . 0.0 109.497 177.71 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 79.0 mt -75.47 -26.81 58.54 Favored 'General case' 0 N--CA 1.449 -0.5 0 CA-C-N 116.506 -0.315 . . . . 0.0 110.935 179.573 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 10.0 m-30 -69.29 -37.72 77.97 Favored 'General case' 0 CA--C 1.513 -0.476 0 CA-C-N 118.367 0.531 . . . . 0.0 110.97 174.231 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 68' ' ' ILE . . . . . . . . . . . . . 18.2 mt -63.87 -47.83 88.99 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.764 0 N-CA-C 107.501 -1.296 . . . . 0.0 107.501 178.907 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 97.0 mt -59.4 -32.56 48.93 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.155 0 C-N-CA 123.832 0.853 . . . . 0.0 111.34 177.056 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 15.2 t70 -68.89 -54.9 12.99 Favored 'General case' 0 CA--C 1.52 -0.196 0 CA-C-N 118.26 0.482 . . . . 0.0 111.134 179.183 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 32.3 t -70.02 -42.33 73.11 Favored 'General case' 0 N--CA 1.452 -0.342 0 C-N-CA 120.829 -0.348 . . . . 0.0 110.795 -174.353 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -74.99 -34.89 33.67 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.233 0 N-CA-C 109.583 -0.525 . . . . 0.0 109.583 179.851 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -70.15 -52.0 20.25 Favored Glycine 0 C--N 1.338 0.667 0 N-CA-C 111.619 -0.592 . . . . 0.0 111.619 -176.531 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 38.6 mtm180 -65.95 -41.79 90.83 Favored 'General case' 0 N--CA 1.45 -0.466 0 C-N-CA 120.306 -0.558 . . . . 0.0 109.608 178.839 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -67.44 -31.29 71.36 Favored 'General case' 0 N--CA 1.45 -0.442 0 C-N-CA 119.703 -0.799 . . . . 0.0 110.865 -177.645 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 1.4 m-30 -66.52 -44.84 81.38 Favored 'General case' 0 CA--C 1.52 -0.199 0 CA-C-N 118.801 0.728 . . . . 0.0 110.348 177.368 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 42.9 tp -70.62 -45.74 64.65 Favored 'General case' 0 N--CA 1.447 -0.6 0 C-N-CA 117.914 -1.514 . . . . 0.0 109.281 179.387 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 83.1 m-20 -56.91 -45.91 82.31 Favored 'General case' 0 CA--C 1.531 0.247 0 N-CA-C 113.164 0.802 . . . . 0.0 113.164 179.017 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 4.7 tm-20 -64.79 -48.62 73.78 Favored 'General case' 0 N--CA 1.453 -0.323 0 CA-C-N 119.115 0.87 . . . . 0.0 110.994 -179.66 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 68.9 p -67.41 -25.91 66.17 Favored 'General case' 0 CA--C 1.528 0.125 0 O-C-N 122.219 -0.301 . . . . 0.0 110.694 179.133 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 35.3 ttp180 -75.93 -20.36 58.04 Favored 'General case' 0 N--CA 1.452 -0.361 0 C-N-CA 124.155 0.982 . . . . 0.0 111.757 171.98 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 53.4 m -83.21 -26.71 30.55 Favored 'General case' 0 CA--C 1.529 0.135 0 CA-C-O 119.364 -0.35 . . . . 0.0 111.77 -179.4 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 58.0 t30 -159.2 158.41 32.62 Favored 'General case' 0 N--CA 1.454 -0.257 0 CA-C-N 118.132 0.424 . . . . 0.0 110.255 177.709 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 36.9 t -70.23 35.75 0.04 OUTLIER 'General case' 0 CA--C 1.535 0.387 0 C-N-CA 124.02 0.928 . . . . 0.0 112.948 -177.396 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 74.3 m-20 -65.65 141.29 58.44 Favored 'General case' 0 N--CA 1.453 -0.278 0 O-C-N 121.922 -0.487 . . . . 0.0 110.169 179.457 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 37.3 t -160.99 149.9 16.53 Favored 'General case' 0 N--CA 1.454 -0.25 0 CA-C-O 120.374 0.131 . . . . 0.0 110.76 179.508 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 27.9 t -81.67 -179.35 7.35 Favored 'General case' 0 N--CA 1.452 -0.335 0 N-CA-C 108.855 -0.794 . . . . 0.0 108.855 171.62 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 93.5 p -74.77 2.94 8.9 Favored 'General case' 0 CA--C 1.533 0.323 0 N-CA-C 112.882 0.697 . . . . 0.0 112.882 -177.37 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 25.6 t-20 -156.83 178.2 10.62 Favored 'General case' 0 CA--C 1.531 0.215 0 CA-C-N 118.541 0.61 . . . . 0.0 110.505 -176.226 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 90' ' ' LYS . . . . . 0.401 ' N ' ' HD2' ' A' ' 91' ' ' PRO . 28.6 tptp -59.91 -51.56 79.82 Favored Pre-proline 0 CA--C 1.536 0.41 0 CA-C-O 118.403 -0.808 . . . . 0.0 110.694 177.614 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 91' ' ' PRO . . . . . 0.401 ' HD2' ' N ' ' A' ' 90' ' ' LYS . 58.3 Cg_endo -65.92 151.18 84.77 Favored 'Trans proline' 0 N--CA 1.453 -0.906 0 C-N-CA 122.149 1.899 . . . . 0.0 108.647 169.365 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 96.1 19.56 28.19 Favored Glycine 0 CA--C 1.525 0.683 0 CA-C-O 119.466 -0.63 . . . . 0.0 112.569 -176.841 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 37.3 p -151.62 171.33 17.79 Favored 'General case' 0 CA--C 1.521 -0.17 0 CA-C-N 118.327 1.064 . . . . 0.0 110.922 178.595 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 94' ' ' CYS . . . . . 0.403 ' HB2' HD13 ' A' ' 98' ' ' ILE . 29.6 p -59.23 -24.79 63.47 Favored 'General case' 0 N--CA 1.451 -0.394 0 CA-C-N 115.404 -0.816 . . . . 0.0 109.287 175.133 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -60.69 -57.99 10.37 Favored 'General case' 0 N--CA 1.446 -0.675 0 N-CA-C 109.381 -0.6 . . . . 0.0 109.381 -176.814 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 63.0 t60 -75.4 -30.18 60.01 Favored 'General case' 0 N--CA 1.451 -0.406 0 N-CA-C 111.603 0.223 . . . . 0.0 111.603 -179.03 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -68.53 -51.36 43.84 Favored 'General case' 0 N--CA 1.448 -0.539 0 O-C-N 123.029 0.206 . . . . 0.0 111.127 -178.473 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 98' ' ' ILE . . . . . 0.403 HD13 ' HB2' ' A' ' 94' ' ' CYS . 2.0 mp -72.01 -29.62 33.66 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.198 0 C-N-CA 120.785 -0.366 . . . . 0.0 110.323 179.874 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 4.5 m120 -64.65 -48.78 73.56 Favored 'General case' 0 N--CA 1.455 -0.19 0 CA-C-N 118.373 0.533 . . . . 0.0 110.322 175.663 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 43.9 m -71.79 -33.94 69.0 Favored 'General case' 0 N--CA 1.456 -0.126 0 O-C-N 122.322 -0.236 . . . . 0.0 110.61 -175.717 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -71.04 -40.85 71.45 Favored 'General case' 0 N--CA 1.447 -0.578 0 N-CA-C 110.225 -0.287 . . . . 0.0 110.225 -179.794 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -64.27 -22.54 67.38 Favored Glycine 0 CA--C 1.528 0.906 0 CA-C-O 119.185 -0.786 . . . . 0.0 114.045 -172.333 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 16.0 mt-10 -95.16 -13.8 24.7 Favored 'General case' 0 C--O 1.231 0.116 0 CA-C-N 118.649 1.225 . . . . 0.0 112.015 -178.492 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 48.2 t -113.18 -23.45 4.34 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.198 0 CA-C-N 116.691 -0.231 . . . . 0.0 111.289 -173.543 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 105' ' ' ILE . . . . . . . . . . . . . 10.0 tp -59.98 -23.3 26.52 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.146 0 C-N-CA 122.922 0.489 . . . . 0.0 111.369 -178.34 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 26.5 pt20 -65.58 -29.53 70.14 Favored 'General case' 0 N--CA 1.452 -0.373 0 N-CA-C 110.288 -0.264 . . . . 0.0 110.288 179.351 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 107' ' ' GLU . . . . . 0.422 ' CD ' HH22 ' A' ' 55' ' ' ARG . 37.8 mt-10 -75.88 -39.91 55.54 Favored 'General case' 0 N--CA 1.455 -0.19 0 CA-C-N 118.079 0.4 . . . . 0.0 110.164 177.445 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 9.8 mp -67.95 -42.37 81.07 Favored 'General case' 0 N--CA 1.453 -0.314 0 N-CA-C 110.066 -0.346 . . . . 0.0 110.066 -178.462 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 90.2 mt -69.52 -59.17 3.15 Favored 'General case' 0 N--CA 1.454 -0.27 0 CA-C-O 119.113 -0.47 . . . . 0.0 110.583 -179.285 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 12.1 p -45.5 -52.74 9.88 Favored 'General case' 0 C--O 1.232 0.17 0 CA-C-N 118.163 0.438 . . . . 0.0 111.806 -179.696 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 34.2 t0 -64.34 -38.93 92.76 Favored 'General case' 0 N--CA 1.445 -0.706 0 N-CA-C 110.099 -0.334 . . . . 0.0 110.099 -178.271 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -70.41 -32.98 70.82 Favored 'General case' 0 N--CA 1.448 -0.568 0 CA-C-O 119.244 -0.407 . . . . 0.0 110.671 -177.914 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 113' ' ' ILE . . . . . . . . . . . . . 46.1 mm -65.23 -41.3 91.21 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.133 0 N-CA-C 108.525 -0.917 . . . . 0.0 108.525 178.175 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -74.6 -38.46 62.6 Favored 'General case' 0 N--CA 1.454 -0.27 0 N-CA-C 112.13 0.418 . . . . 0.0 112.13 179.89 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 115' ' ' LYS . . . . . 0.592 ' HZ1' ' HB2' ' A' ' 115' ' ' LYS . 0.1 OUTLIER -75.5 -34.17 60.82 Favored 'General case' 0 C--N 1.339 0.138 0 N-CA-C 112.784 0.661 . . . . 0.0 112.784 -176.53 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 116' ' ' SER . . . . . 0.426 ' HB2' ' HB2' ' A' ' 120' ' ' HIS . 86.5 p -82.13 154.08 25.71 Favored 'General case' 0 N--CA 1.452 -0.352 0 N-CA-C 113.739 1.014 . . . . 0.0 113.739 -168.718 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 48.8 t30 -72.01 165.46 24.2 Favored 'General case' 0 CA--C 1.533 0.296 0 C-N-CA 124.036 0.935 . . . . 0.0 110.329 176.27 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 118' ' ' GLN . . . . . . . . . . . . . 25.6 mm100 -52.71 -40.78 63.31 Favored 'General case' 0 N--CA 1.456 -0.141 0 N-CA-C 113.239 0.829 . . . . 0.0 113.239 -171.633 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 20.4 p-10 -72.44 -41.06 66.56 Favored 'General case' 0 N--CA 1.456 -0.151 0 C-N-CA 120.606 -0.437 . . . . 0.0 109.828 -179.613 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 120' ' ' HIS . . . . . 0.426 ' HB2' ' HB2' ' A' ' 116' ' ' SER . 14.6 m-70 -65.22 -34.83 79.3 Favored 'General case' 0 N--CA 1.452 -0.334 0 C-N-CA 123.11 0.564 . . . . 0.0 110.366 178.226 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 55.8 mttm -61.15 -46.26 91.26 Favored 'General case' 0 C--N 1.341 0.208 0 N-CA-C 108.638 -0.875 . . . . 0.0 108.638 175.062 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 40.7 tp10 -67.39 -36.79 82.02 Favored 'General case' 0 N--CA 1.452 -0.336 0 CA-C-N 116.513 -0.312 . . . . 0.0 111.108 -176.313 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 34.1 mtmt -64.36 -31.68 72.98 Favored 'General case' 0 N--CA 1.452 -0.332 0 N-CA-C 109.61 -0.515 . . . . 0.0 109.61 176.912 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 124' ' ' ILE . . . . . . . . . . . . . 53.7 mt -74.0 -35.86 43.13 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.319 0 O-C-N 121.642 -0.661 . . . . 0.0 109.785 175.696 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 11.7 mmm180 -63.79 -39.74 94.97 Favored 'General case' 0 C--N 1.34 0.174 0 CA-C-N 118.522 0.601 . . . . 0.0 110.353 -179.778 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 126' ' ' MET . . . . . . . . . . . . . 18.6 ptp -68.9 -32.26 71.77 Favored 'General case' 0 N--CA 1.455 -0.189 0 C-N-CA 119.623 -0.831 . . . . 0.0 109.354 176.736 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 2.0 mp -60.52 -33.06 72.09 Favored 'General case' 0 CA--C 1.531 0.221 0 CA-C-N 118.647 0.658 . . . . 0.0 110.277 175.787 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -70.27 -42.11 72.56 Favored 'General case' 0 CA--C 1.523 -0.064 0 CA-C-N 118.701 0.682 . . . . 0.0 109.992 177.196 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 15.6 t0 -61.0 -45.03 96.49 Favored 'General case' 0 N--CA 1.455 -0.211 0 CA-C-O 121.085 0.469 . . . . 0.0 109.797 177.124 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 130' ' ' ILE . . . . . 0.414 ' HA ' ' HD3' ' A' ' 133' ' ' ARG . 53.6 mt -61.05 -36.89 75.6 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.348 0 C-N-CA 123.575 0.75 . . . . 0.0 110.511 -178.29 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 131' ' ' TRP . . . . . . . . . . . . . 51.3 m0 -77.98 -31.32 50.7 Favored 'General case' 0 N--CA 1.451 -0.383 0 N-CA-C 112.897 0.703 . . . . 0.0 112.897 -179.834 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 88.6 m-20 -75.1 -22.77 58.04 Favored 'General case' 0 N--CA 1.454 -0.246 0 CA-C-N 118.258 0.481 . . . . 0.0 110.803 176.965 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 133' ' ' ARG . . . . . 0.453 HH21 ' C ' ' B' 2063 ' ' SER . 16.0 mtp180 -75.56 -35.99 60.52 Favored 'General case' 0 C--N 1.339 0.136 0 C-N-CA 123.099 0.56 . . . . 0.0 110.411 172.783 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 44.6 t -72.69 -16.22 61.68 Favored 'General case' 0 N--CA 1.455 -0.203 0 C-N-CA 122.594 0.358 . . . . 0.0 111.714 -179.692 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 135' ' ' GLY . . . . . . . . . . . . . . . 78.94 15.3 80.87 Favored Glycine 0 CA--C 1.527 0.83 0 CA-C-O 119.519 -0.601 . . . . 0.0 111.962 -179.451 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 136' ' ' LEU . . . . . . . . . . . . . 25.5 mt -60.84 156.94 16.13 Favored 'General case' 0 N--CA 1.456 -0.133 0 CA-C-N 117.793 0.796 . . . . 0.0 109.645 176.204 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 137' ' ' PHE . . . . . . . . . . . . . 79.7 t80 -66.99 -34.41 77.69 Favored 'General case' 0 C--O 1.232 0.177 0 N-CA-C 112.919 0.711 . . . . 0.0 112.919 -171.46 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 138' ' ' GLN . . . . . . . . . . . . . 18.5 pm0 -71.27 152.24 43.47 Favored 'General case' 0 N--CA 1.455 -0.21 0 CA-C-N 118.497 0.589 . . . . 0.0 109.683 178.253 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 139' ' ' LYS . . . . . . . . . . . . . 13.4 mmtm -138.83 143.81 39.0 Favored 'General case' 0 N--CA 1.456 -0.135 0 CA-C-O 121.184 0.516 . . . . 0.0 111.222 -175.304 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 140' ' ' SER . . . . . . . . . . . . . 88.1 p -74.63 -4.51 37.59 Favored 'General case' 0 N--CA 1.456 -0.171 0 C-N-CA 123.976 0.91 . . . . 0.0 112.368 -179.162 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 141' ' ' TYR . . . . . . . . . . . . . 6.4 m-30 -76.23 -17.49 59.48 Favored 'General case' 0 N--CA 1.455 -0.213 0 N-CA-C 113.033 0.753 . . . . 0.0 113.033 -173.272 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 142' ' ' LEU . . . . . . . . . . . . . 79.3 mt -74.03 139.75 44.94 Favored 'General case' 0 N--CA 1.456 -0.164 0 CA-C-N 118.771 0.714 . . . . 0.0 110.285 -175.859 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 17.6 p30 -67.53 -14.9 63.34 Favored 'General case' 0 CA--C 1.531 0.226 0 CA-C-N 116.822 -0.172 . . . . 0.0 111.386 -176.977 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . -67.96 -34.47 76.62 Favored 'General case' 0 N--CA 1.447 -0.585 0 N-CA-C 109.409 -0.589 . . . . 0.0 109.409 175.182 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 145' ' ' ILE . . . . . . . . . . . . . 19.5 mm -78.33 -25.21 13.83 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.236 0 CA-C-O 120.588 0.233 . . . . 0.0 110.389 -179.871 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 146' ' ' ARG . . . . . . . . . . . . . 37.2 mtt180 -73.4 -23.93 60.23 Favored 'General case' 0 N--CA 1.456 -0.152 0 N-CA-C 109.718 -0.475 . . . . 0.0 109.718 175.425 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 147' ' ' SER . . . . . . . . . . . . . 84.1 p 46.69 57.1 5.83 Favored 'General case' 0 C--N 1.339 0.148 0 C-N-CA 124.604 1.162 . . . . 0.0 111.399 172.003 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 148' ' ' LYS . . . . . 0.571 ' H ' ' HD3' ' A' ' 148' ' ' LYS . 0.0 OUTLIER -54.72 -14.99 1.56 Allowed 'General case' 0 CA--C 1.532 0.283 0 C-N-CA 124.229 1.012 . . . . 0.0 112.408 -178.566 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 149' ' ' CYS . . . . . . . . . . . . . 26.1 p -63.13 -29.81 71.09 Favored 'General case' 0 N--CA 1.452 -0.374 0 CA-C-N 118.345 0.52 . . . . 0.0 109.757 177.432 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 150' ' ' PHE . . . . . . . . . . . . . 43.4 t80 -70.71 -24.62 62.68 Favored 'General case' 0 N--CA 1.453 -0.285 0 CA-C-N 118.142 0.428 . . . . 0.0 110.265 179.224 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 151' ' ' ALA . . . . . . . . . . . . . . . -76.62 -30.54 56.95 Favored 'General case' 0 N--CA 1.45 -0.46 0 N-CA-C 109.67 -0.493 . . . . 0.0 109.67 174.555 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 152' ' ' MET . . . . . . . . . . . . . 96.7 mmm -73.3 -23.49 60.28 Favored 'General case' 0 CA--C 1.531 0.212 0 CA-C-O 119.746 -0.168 . . . . 0.0 111.121 176.711 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 153' ' ' ASP . . . . . . . . . . . . . 71.1 m-20 -68.18 -14.14 62.76 Favored 'General case' 0 CA--C 1.531 0.22 0 C-N-CA 122.455 0.302 . . . . 0.0 111.552 175.209 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 154' ' ' LEU . . . . . . . . . . . . . 52.7 mt -78.44 38.95 0.32 Allowed 'General case' 0 CA--C 1.53 0.175 0 C-N-CA 123.117 0.567 . . . . 0.0 111.666 -179.934 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 155' ' ' GLU . . . . . . . . . . . . . 17.2 pt-20 -73.69 -174.73 1.84 Allowed 'General case' 0 CA--C 1.535 0.393 0 C-N-CA 123.056 0.542 . . . . 0.0 111.087 -178.965 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 156' ' ' HIS . . . . . . . . . . . . . 80.3 t60 -64.88 -1.17 1.82 Allowed 'General case' 0 CA--C 1.534 0.35 0 N-CA-C 113.682 0.993 . . . . 0.0 113.682 -174.105 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 157' ' ' HIS . . . . . . . . . . . . . 35.3 p-80 -152.26 156.14 39.1 Favored 'General case' 0 N--CA 1.453 -0.314 0 CA-C-N 118.158 0.436 . . . . 0.0 109.878 -179.676 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 158' ' ' HIS . . . . . . . . . . . . . 53.2 p-80 -83.24 164.68 19.96 Favored 'General case' 0 N--CA 1.453 -0.304 0 C-N-CA 122.649 0.38 . . . . 0.0 110.463 178.111 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 159' ' ' HIS . . . . . . . . . . . . . 59.5 m170 . . . . . 0 C--O 1.251 1.151 0 CA-C-O 117.251 -1.357 . . . . 0.0 110.013 176.654 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' B' B 2052 ' ' ASP . . . . . 0.488 ' OD2' ' HE2' ' A' ' 21' ' ' LYS . 0.7 OUTLIER . . . . . 0 N--CA 1.473 0.714 0 CA-C-O 120.274 0.083 . . . . 0.0 111.094 . . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B 2053 ' ' ASP . . . . . . . . . . . . . 50.2 p-10 -124.22 20.31 8.95 Favored 'General case' 0 CA--C 1.53 0.174 0 C-N-CA 123.523 0.729 . . . . 0.0 110.664 -177.041 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B 2054 ' ' ASP . . . . . 0.461 ' CG ' ' HG ' ' A' ' 27' ' ' SER . 38.5 t0 -142.74 179.48 6.97 Favored 'General case' 0 N--CA 1.451 -0.397 0 N-CA-C 109.394 -0.595 . . . . 0.0 109.394 -175.606 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B 2055 ' ' GLU . . . . . . . . . . . . . 86.4 mt-10 -57.87 -13.16 3.9 Favored 'General case' 0 N--CA 1.454 -0.232 0 C-N-CA 124.24 1.016 . . . . 0.0 111.934 179.379 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B 2056 ' ' ASP . . . . . . . . . . . . . 91.3 m-20 47.72 -126.27 1.76 Allowed 'General case' 0 N--CA 1.452 -0.335 0 C-N-CA 123.164 0.586 . . . . 0.0 110.708 -177.298 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B 2057 ' ' ASP . . . . . . . . . . . . . 28.5 t0 -57.06 89.64 0.01 OUTLIER 'General case' 0 CA--C 1.533 0.316 0 C-N-CA 123.858 0.863 . . . . 0.0 112.429 -173.293 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B 2058 ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -62.78 142.57 58.12 Favored 'General case' 0 N--CA 1.454 -0.252 0 C-N-CA 124.967 1.307 . . . . 0.0 110.994 178.628 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B 2059 ' ' THR . . . . . . . . . . . . . 52.5 m -112.13 117.89 47.01 Favored Pre-proline 0 N--CA 1.452 -0.326 0 N-CA-C 108.633 -0.877 . . . . 0.0 108.633 178.216 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B 2060 ' ' PRO . . . . . . . . . . . . . 88.9 Cg_endo -75.5 167.66 26.1 Favored 'Trans proline' 0 N--CA 1.45 -1.062 0 C-N-CA 123.678 2.919 . . . . 0.0 111.378 -178.39 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B 2061 ' ' SER . . . . . . . . . . . . . 39.9 t -150.41 142.76 24.3 Favored 'General case' 0 N--CA 1.453 -0.282 0 N-CA-C 109.364 -0.606 . . . . 0.0 109.364 175.861 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B 2062 ' ' ILE . . . . . . . . . . . . . 16.7 tt -167.06 155.34 1.29 Allowed 'Isoleucine or valine' 0 N--CA 1.455 -0.217 0 C-N-CA 123.508 0.723 . . . . 0.0 110.052 -178.181 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B 2063 ' ' SER . . . . . 0.453 ' C ' HH21 ' A' ' 133' ' ' ARG . 80.3 p . . . . . 0 C--O 1.247 0.96 0 CA-C-O 117.211 -1.376 . . . . 0.0 109.722 174.453 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.473 0.697 0 N-CA-C 110.286 -0.264 . . . . 0.0 110.286 . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' GLN . . . . . 0.563 ' HG2' ' H ' ' A' ' 4' ' ' ASP . 14.5 pm0 -157.52 -165.37 1.77 Allowed 'General case' 0 N--CA 1.453 -0.293 0 N-CA-C 108.709 -0.849 . . . . 0.0 108.709 -178.62 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 4.6 pm0 -61.38 -10.75 7.97 Favored 'General case' 0 CA--C 1.532 0.268 0 O-C-N 121.519 -0.738 . . . . 0.0 112.547 -178.236 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' ASP . . . . . 0.563 ' H ' ' HG2' ' A' ' 2' ' ' GLN . 4.8 m-20 -86.24 8.46 21.15 Favored 'General case' 0 C--N 1.341 0.219 0 N-CA-C 112.467 0.543 . . . . 0.0 112.467 179.606 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 25.3 m-20 -81.67 11.31 4.88 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.927 -0.579 . . . . 0.0 111.998 -176.634 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 18.8 p-10 -76.83 -32.18 57.39 Favored 'General case' 0 N--CA 1.453 -0.32 0 N-CA-C 107.443 -1.317 . . . . 0.0 107.443 173.599 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' PHE . . . . . 0.547 ' HB2' ' HZ2' ' A' ' 45' ' ' LYS . 1.0 OUTLIER -62.34 -34.42 76.6 Favored 'General case' 0 N--CA 1.443 -0.816 0 C-N-CA 125.515 1.526 . . . . 0.0 111.174 -176.427 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 17.4 tp60 -50.56 -36.2 33.38 Favored 'General case' 0 N--CA 1.456 -0.135 0 C-N-CA 123.141 0.576 . . . . 0.0 111.325 -178.455 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 26.5 m-80 -70.99 -39.69 72.31 Favored 'General case' 0 N--CA 1.454 -0.248 0 N-CA-C 110.194 -0.298 . . . . 0.0 110.194 -179.389 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' PHE . . . . . 0.524 ' CE2' ' HB2' ' A' ' 32' ' ' LEU . 3.7 t80 -68.56 -37.51 79.96 Favored 'General case' 0 N--CA 1.451 -0.408 0 C-N-CA 123.476 0.71 . . . . 0.0 109.873 178.089 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 94.7 t -66.28 -51.19 61.67 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.219 0 N-CA-C 108.221 -1.029 . . . . 0.0 108.221 178.601 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -61.64 -25.76 67.57 Favored 'General case' 0 N--CA 1.452 -0.344 0 C-N-CA 122.844 0.458 . . . . 0.0 111.717 179.789 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 59.3 m -74.61 -37.02 62.96 Favored 'General case' 0 N--CA 1.456 -0.155 0 N-CA-C 108.972 -0.751 . . . . 0.0 108.972 175.613 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -66.49 -44.25 83.16 Favored 'General case' 0 N--CA 1.448 -0.54 0 N-CA-C 108.617 -0.883 . . . . 0.0 108.617 177.088 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 68.2 mm-40 -66.53 -27.03 67.44 Favored 'General case' 0 N--CA 1.451 -0.41 0 C-N-CA 123.952 0.901 . . . . 0.0 110.001 177.864 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 22.0 t -67.93 -35.16 77.97 Favored 'General case' 0 N--CA 1.451 -0.379 0 N-CA-C 109.316 -0.624 . . . . 0.0 109.316 177.521 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 46.6 m-85 -67.9 -39.32 83.64 Favored 'General case' 0 CA--C 1.518 -0.267 0 C-N-CA 120.304 -0.558 . . . . 0.0 110.439 173.977 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 72.1 mttt -58.7 -32.81 69.5 Favored 'General case' 0 C--N 1.339 0.11 0 C-N-CA 120.46 -0.496 . . . . 0.0 109.714 178.849 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 24.9 t0 -76.33 -45.73 30.84 Favored 'General case' 0 N--CA 1.456 -0.151 0 C-N-CA 123.27 0.628 . . . . 0.0 111.05 176.292 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 3.8 mt -46.99 136.49 8.38 Favored 'General case' 0 N--CA 1.454 -0.231 0 C-N-CA 123.224 0.61 . . . . 0.0 112.073 -173.473 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.49 -13.0 60.26 Favored 'General case' 0 CA--C 1.53 0.205 0 CA-C-N 115.252 -0.886 . . . . 0.0 111.88 -174.621 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' SER . . . . . 0.467 ' C ' ' H ' ' A' ' 24' ' ' ILE . 67.3 m -120.96 -10.85 9.02 Favored 'General case' 0 CA--C 1.528 0.122 0 C-N-CA 123.692 0.797 . . . . 0.0 112.005 -178.397 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 74.39 -21.66 1.43 Allowed Glycine 0 CA--C 1.531 1.059 0 N-CA-C 111.344 -0.702 . . . . 0.0 111.344 -174.824 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . 0.467 ' H ' ' C ' ' A' ' 22' ' ' SER . 81.0 mt -94.19 154.22 3.34 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.136 0 C-N-CA 124.498 1.119 . . . . 0.0 109.604 174.301 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 30.3 t -168.44 107.38 0.49 Allowed 'General case' 0 CA--C 1.517 -0.306 0 CA-C-O 119.451 -0.309 . . . . 0.0 110.289 168.933 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -54.61 -39.57 67.13 Favored Glycine 0 CA--C 1.524 0.634 0 C-N-CA 120.091 -1.052 . . . . 0.0 110.618 179.924 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 29.0 t -63.08 -52.31 63.21 Favored 'General case' 0 N--CA 1.455 -0.193 0 CA-C-N 117.866 0.833 . . . . 0.0 110.745 -178.075 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 74.2 mmt-85 -68.17 -39.46 82.56 Favored 'General case' 0 C--O 1.231 0.129 0 O-C-N 122.103 -0.373 . . . . 0.0 110.265 -178.971 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 72.9 mt -61.01 -47.59 92.89 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.511 0 N-CA-C 109.595 -0.52 . . . . 0.0 109.595 178.789 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 51.2 mtmt -64.75 -28.97 69.94 Favored 'General case' 0 C--N 1.341 0.2 0 CA-C-O 119.289 -0.386 . . . . 0.0 111.151 -179.782 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . 0.415 ' CE ' ' HA ' ' A' ' 31' ' ' LYS . 4.6 mmpt? -65.63 -58.74 5.01 Favored 'General case' 0 C--O 1.231 0.085 0 CA-C-N 118.362 0.528 . . . . 0.0 110.839 179.547 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . 0.524 ' HB2' ' CE2' ' A' ' 10' ' ' PHE . 1.6 pp -72.21 -20.97 61.48 Favored 'General case' 0 CA--C 1.528 0.115 0 C-N-CA 118.967 -1.093 . . . . 0.0 111.249 -177.642 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 33' ' ' THR . . . . . 0.403 ' N ' HD11 ' A' ' 32' ' ' LEU . 55.2 m -72.51 -40.7 66.65 Favored 'General case' 0 N--CA 1.455 -0.215 0 N-CA-C 109.364 -0.606 . . . . 0.0 109.364 178.169 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 99.9 m -69.31 -38.29 78.17 Favored 'General case' 0 N--CA 1.451 -0.389 0 C-N-CA 121.008 -0.277 . . . . 0.0 110.392 -177.671 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 42.9 t80 -66.44 -34.33 77.7 Favored 'General case' 0 N--CA 1.455 -0.223 0 C-N-CA 119.821 -0.752 . . . . 0.0 110.047 176.547 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -71.49 -32.18 67.95 Favored 'General case' 0 N--CA 1.452 -0.347 0 CA-C-O 119.376 -0.345 . . . . 0.0 111.477 179.094 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -75.07 -34.1 61.77 Favored 'General case' 0 N--CA 1.457 -0.103 0 CA-C-N 118.129 0.422 . . . . 0.0 110.544 179.003 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 44.1 t0 -67.71 -22.74 65.24 Favored 'General case' 0 N--CA 1.455 -0.212 0 N-CA-C 110.403 -0.221 . . . . 0.0 110.403 175.86 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 98.1 m-70 -151.44 99.01 2.59 Favored 'General case' 0 C--N 1.342 0.263 0 C-N-CA 122.871 0.468 . . . . 0.0 111.461 -175.157 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 40' ' ' ILE . . . . . 0.452 HD11 ' H ' ' A' ' 40' ' ' ILE . 0.0 OUTLIER -75.91 -14.59 15.2 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.322 0 CA-C-O 119.268 -0.396 . . . . 0.0 110.478 175.14 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 89.4 m-20 -58.58 -16.88 17.76 Favored 'General case' 0 CA--C 1.531 0.232 0 N-CA-C 112.723 0.638 . . . . 0.0 112.723 -178.204 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -106.71 13.19 8.33 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.159 0 C-N-CA 122.803 0.441 . . . . 0.0 111.859 177.473 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 3.0 pp20? -52.49 -30.07 28.24 Favored 'General case' 0 CA--C 1.527 0.085 0 O-C-N 121.755 -0.591 . . . . 0.0 111.557 177.532 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 40.3 t -62.4 -48.19 80.79 Favored 'General case' 0 CA--C 1.53 0.209 0 N-CA-C 112.299 0.481 . . . . 0.0 112.299 -179.326 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . 0.547 ' HZ2' ' HB2' ' A' ' 7' ' ' PHE . 18.2 ptpt -71.93 -25.58 61.95 Favored 'General case' 0 C--N 1.339 0.139 0 N-CA-C 109.494 -0.558 . . . . 0.0 109.494 179.32 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 46' ' ' ILE . . . . . 0.465 HG12 ' CZ ' ' A' ' 10' ' ' PHE . 88.7 mt -71.01 -50.38 42.93 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.297 0 C-N-CA 122.798 0.439 . . . . 0.0 110.064 -178.96 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 35.5 mm -63.75 -35.03 71.58 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.169 0 N-CA-C 109.402 -0.592 . . . . 0.0 109.402 179.237 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 50.1 m -63.68 -39.4 94.22 Favored 'General case' 0 N--CA 1.452 -0.332 0 O-C-N 122.429 -0.17 . . . . 0.0 111.073 -179.192 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -78.46 -30.58 47.5 Favored 'General case' 0 N--CA 1.456 -0.163 0 N-CA-C 113.465 0.913 . . . . 0.0 113.465 -178.728 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 13.5 pt -70.15 -40.32 78.08 Favored 'Isoleucine or valine' 0 C--N 1.34 0.161 0 CA-C-N 119.963 1.256 . . . . 0.0 110.259 177.994 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 22.1 pt -69.11 -39.91 80.01 Favored 'Isoleucine or valine' 0 C--N 1.338 0.103 0 C-N-CA 120.138 -0.625 . . . . 0.0 110.315 179.584 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 44.4 t0 -65.42 -49.34 69.58 Favored 'General case' 0 N--CA 1.456 -0.174 0 CA-C-N 117.906 0.321 . . . . 0.0 110.841 178.492 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 44.5 t80 -62.74 -43.22 99.36 Favored 'General case' 0 N--CA 1.453 -0.31 0 N-CA-C 109.538 -0.542 . . . . 0.0 109.538 179.671 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 34.7 t -62.49 -30.83 71.55 Favored 'General case' 0 N--CA 1.454 -0.237 0 CA-C-N 118.175 0.443 . . . . 0.0 111.492 -177.786 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 7.1 tpt180 -81.34 -44.53 17.49 Favored 'General case' 0 N--CA 1.454 -0.25 0 CA-C-N 118.126 0.421 . . . . 0.0 111.271 -178.942 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 95.0 mt -77.37 -47.51 19.69 Favored 'General case' 0 N--CA 1.456 -0.146 0 N-CA-C 114.032 1.123 . . . . 0.0 114.032 -175.56 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 57' ' ' CYS . . . . . 0.423 ' O ' ' HE2' ' A' ' 62' ' ' LYS . 13.5 p -61.39 158.46 38.09 Favored Pre-proline 0 CA--C 1.536 0.408 0 N-CA-C 113.957 1.095 . . . . 0.0 113.957 -169.718 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 31.7 Cg_exo -59.12 174.05 1.09 Allowed 'Trans proline' 0 N--CA 1.455 -0.774 1 C-N-CA 125.801 4.334 . . . . 0.0 113.439 176.442 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 27.3 p30 -58.48 -47.75 83.06 Favored 'General case' 0 CA--C 1.531 0.225 0 CA-C-N 115.179 -0.919 . . . . 0.0 112.624 -173.695 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 34.3 m -70.66 -29.77 66.2 Favored 'General case' 0 N--CA 1.453 -0.299 0 CA-C-O 120.927 0.394 . . . . 0.0 110.18 -179.0 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 62.9 m80 -75.34 -27.16 59.1 Favored 'General case' 0 N--CA 1.45 -0.468 0 C-N-CA 122.812 0.445 . . . . 0.0 110.313 177.701 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . 0.423 ' HE2' ' O ' ' A' ' 57' ' ' CYS . 64.1 mttm -67.79 -37.46 82.05 Favored 'General case' 0 N--CA 1.457 -0.084 0 N-CA-C 109.668 -0.493 . . . . 0.0 109.668 171.613 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -62.79 -42.84 99.88 Favored 'General case' 0 CA--C 1.53 0.199 0 N-CA-C 108.045 -1.095 . . . . 0.0 108.045 173.341 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -66.83 -30.99 76.99 Favored Glycine 0 C--N 1.34 0.75 0 N-CA-C 111.811 -0.515 . . . . 0.0 111.811 -179.423 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 30.0 t -68.62 -40.45 80.37 Favored 'General case' 0 N--CA 1.45 -0.443 0 CA-C-N 117.665 0.732 . . . . 0.0 109.884 178.317 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 77.0 mt -70.99 -24.12 62.32 Favored 'General case' 0 N--CA 1.45 -0.438 0 N-CA-C 109.767 -0.457 . . . . 0.0 109.767 178.922 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -73.49 -38.85 65.25 Favored 'General case' 0 N--CA 1.456 -0.169 0 C-N-CA 122.822 0.449 . . . . 0.0 110.698 174.765 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 68' ' ' ILE . . . . . . . . . . . . . 19.6 mt -65.59 -51.06 67.61 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.295 0 N-CA-C 108.594 -0.891 . . . . 0.0 108.594 175.211 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 86.0 mt -55.89 -32.01 31.63 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.303 0 C-N-CA 123.662 0.785 . . . . 0.0 111.4 176.588 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 15.0 t70 -69.31 -51.41 37.43 Favored 'General case' 0 N--CA 1.454 -0.264 0 O-C-N 121.757 -0.589 . . . . 0.0 111.157 178.757 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 90.2 p -67.64 -48.06 67.79 Favored 'General case' 0 N--CA 1.452 -0.368 0 O-C-N 122.987 0.18 . . . . 0.0 111.059 -175.128 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -75.72 -34.79 29.32 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.168 0 N-CA-C 109.818 -0.438 . . . . 0.0 109.818 -179.672 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -67.82 -48.21 56.48 Favored Glycine 0 C--N 1.336 0.569 0 N-CA-C 110.811 -0.916 . . . . 0.0 110.811 -176.376 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 39.5 mtm180 -68.41 -42.9 78.33 Favored 'General case' 0 N--CA 1.448 -0.526 0 CA-C-N 117.408 0.604 . . . . 0.0 109.899 178.394 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -62.38 -31.31 71.96 Favored 'General case' 0 N--CA 1.449 -0.498 0 C-N-CA 120.302 -0.559 . . . . 0.0 110.498 -178.462 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 1.9 m-30 -70.86 -51.97 23.14 Favored 'General case' 0 N--CA 1.456 -0.169 0 CA-C-N 118.46 0.573 . . . . 0.0 110.934 176.413 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 43.6 tp -68.34 -36.92 79.96 Favored 'General case' 0 N--CA 1.449 -0.493 0 C-N-CA 118.212 -1.395 . . . . 0.0 110.092 -176.952 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 83.8 m-20 -64.89 -45.41 86.07 Favored 'General case' 0 N--CA 1.454 -0.274 0 CA-C-O 119.645 -0.217 . . . . 0.0 111.507 179.052 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 16.0 tm-20 -64.92 -49.04 71.95 Favored 'General case' 0 N--CA 1.446 -0.661 0 CA-C-N 118.17 0.441 . . . . 0.0 111.575 179.378 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 79.9 p -68.32 -25.45 65.12 Favored 'General case' 0 CA--C 1.531 0.243 0 CA-C-N 117.933 0.333 . . . . 0.0 110.577 -178.538 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 37.3 ttp-105 -74.73 -30.7 61.6 Favored 'General case' 0 CA--C 1.53 0.2 0 C-N-CA 122.813 0.445 . . . . 0.0 111.42 173.023 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 58.0 m -75.74 -28.01 58.34 Favored 'General case' 0 N--CA 1.458 -0.063 0 N-CA-C 112.65 0.611 . . . . 0.0 112.65 -175.839 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -159.95 158.47 30.77 Favored 'General case' 0 N--CA 1.456 -0.15 0 CA-C-N 118.093 0.406 . . . . 0.0 110.951 -179.964 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 32.2 t -71.6 22.12 0.05 OUTLIER 'General case' 0 CA--C 1.535 0.399 0 N-CA-C 113.99 1.108 . . . . 0.0 113.99 -173.308 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 93.3 m-20 -61.62 134.31 56.65 Favored 'General case' 0 N--CA 1.454 -0.231 0 N-CA-C 109.078 -0.712 . . . . 0.0 109.078 177.986 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 77.9 p -160.41 161.45 33.02 Favored 'General case' 0 N--CA 1.452 -0.342 0 CA-C-N 116.508 -0.315 . . . . 0.0 110.341 -176.878 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 87' ' ' SER . . . . . 0.45 ' H ' ' CG2' ' A' ' 93' ' ' THR . 11.1 t -92.62 178.71 5.72 Favored 'General case' 0 N--CA 1.453 -0.304 0 C-N-CA 123.247 0.619 . . . . 0.0 110.533 -179.988 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 79.4 p -73.98 -5.23 40.08 Favored 'General case' 0 N--CA 1.455 -0.224 0 C-N-CA 123.186 0.594 . . . . 0.0 112.455 -178.001 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 11.2 m120 -148.26 178.12 8.84 Favored 'General case' 0 CA--C 1.528 0.126 0 CA-C-N 118.314 0.506 . . . . 0.0 110.294 -175.748 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 22.0 tptm -59.93 -53.35 66.22 Favored Pre-proline 0 CA--C 1.53 0.183 0 CA-C-O 118.552 -0.737 . . . . 0.0 110.197 176.159 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 55.4 Cg_endo -64.16 152.64 80.3 Favored 'Trans proline' 0 N--CA 1.454 -0.833 0 C-N-CA 122.359 2.039 . . . . 0.0 108.352 171.007 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 95.76 15.53 42.51 Favored Glycine 0 CA--C 1.524 0.645 0 CA-C-O 119.464 -0.631 . . . . 0.0 112.314 -177.165 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 93' ' ' THR . . . . . 0.45 ' CG2' ' H ' ' A' ' 87' ' ' SER . 42.0 p -150.33 168.65 23.47 Favored 'General case' 0 C--N 1.34 0.157 0 CA-C-N 118.446 1.123 . . . . 0.0 111.436 177.825 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 94' ' ' CYS . . . . . 0.435 ' SG ' HD13 ' A' ' 98' ' ' ILE . 7.5 t -54.96 -28.12 48.99 Favored 'General case' 0 N--CA 1.449 -0.48 0 CA-C-N 115.021 -0.991 . . . . 0.0 109.653 173.262 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -57.84 -57.32 13.29 Favored 'General case' 0 N--CA 1.445 -0.71 0 N-CA-C 109.244 -0.65 . . . . 0.0 109.244 -178.324 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 61.0 t60 -75.64 -31.69 59.93 Favored 'General case' 0 N--CA 1.452 -0.35 0 C-N-CA 121.103 -0.239 . . . . 0.0 111.598 -179.193 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -67.4 -48.69 66.62 Favored 'General case' 0 N--CA 1.451 -0.422 0 O-C-N 122.92 0.138 . . . . 0.0 111.039 -177.255 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 98' ' ' ILE . . . . . 0.435 HD13 ' SG ' ' A' ' 94' ' ' CYS . 1.7 mp -73.69 -30.74 29.85 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.208 0 N-CA-C 109.903 -0.406 . . . . 0.0 109.903 179.998 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 3.5 m120 -64.68 -47.93 76.58 Favored 'General case' 0 N--CA 1.457 -0.09 0 CA-C-N 118.423 0.556 . . . . 0.0 110.942 175.104 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 47.5 m -72.39 -25.96 61.7 Favored 'General case' 0 N--CA 1.456 -0.157 0 C-N-CA 122.334 0.254 . . . . 0.0 110.563 -175.259 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 57.5 tp -80.33 -37.5 32.42 Favored 'General case' 0 N--CA 1.447 -0.595 0 C-N-CA 122.794 0.438 . . . . 0.0 110.867 178.876 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -75.02 -24.84 70.61 Favored Glycine 0 CA--C 1.527 0.809 0 CA-C-O 119.485 -0.619 . . . . 0.0 112.74 -175.954 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 24.1 pt-20 -78.14 -2.48 37.71 Favored 'General case' 0 CA--C 1.532 0.27 0 CA-C-N 117.98 0.89 . . . . 0.0 111.604 -179.928 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 36.0 m -138.47 9.56 0.69 Allowed 'Isoleucine or valine' 0 CA--C 1.529 0.167 0 N-CA-C 111.996 0.369 . . . . 0.0 111.996 176.288 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 105' ' ' ILE . . . . . . . . . . . . . 11.2 tp -62.28 -26.18 39.63 Favored 'Isoleucine or valine' 0 N--CA 1.458 -0.065 0 CA-C-N 118.697 0.681 . . . . 0.0 111.408 -175.367 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 10.2 pt20 -67.9 -28.47 67.53 Favored 'General case' 0 N--CA 1.453 -0.287 0 N-CA-C 110.154 -0.313 . . . . 0.0 110.154 178.617 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 74.6 mm-40 -75.55 -42.8 51.45 Favored 'General case' 0 N--CA 1.453 -0.283 0 N-CA-C 110.007 -0.368 . . . . 0.0 110.007 -178.017 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 7.3 mp -69.83 -43.77 71.3 Favored 'General case' 0 N--CA 1.448 -0.525 0 N-CA-C 109.703 -0.48 . . . . 0.0 109.703 -179.119 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 96.2 mt -66.72 -64.14 0.92 Allowed 'General case' 0 N--CA 1.452 -0.348 0 C-N-CA 120.592 -0.443 . . . . 0.0 110.261 178.788 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 21.1 t -50.86 -39.82 54.69 Favored 'General case' 0 C--O 1.233 0.199 0 N-CA-C 112.535 0.569 . . . . 0.0 112.535 -173.593 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 49.7 t0 -68.4 -43.8 76.44 Favored 'General case' 0 N--CA 1.456 -0.146 0 N-CA-C 110.206 -0.294 . . . . 0.0 110.206 178.914 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -69.21 -34.68 75.26 Favored 'General case' 0 N--CA 1.448 -0.569 0 CA-C-N 116.836 -0.166 . . . . 0.0 110.744 -178.137 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 113' ' ' ILE . . . . . . . . . . . . . 46.7 mm -66.96 -36.06 76.23 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.333 0 N-CA-C 109.334 -0.617 . . . . 0.0 109.334 179.204 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -74.81 -42.28 58.34 Favored 'General case' 0 N--CA 1.453 -0.31 0 N-CA-C 111.828 0.307 . . . . 0.0 111.828 178.03 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 115' ' ' LYS . . . . . 0.552 ' HB2' ' HZ3' ' A' ' 115' ' ' LYS . 0.0 OUTLIER -78.14 -35.73 48.61 Favored 'General case' 0 N--CA 1.456 -0.163 0 N-CA-C 112.514 0.561 . . . . 0.0 112.514 -174.964 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 116' ' ' SER . . . . . 0.474 ' HB2' ' CB ' ' A' ' 120' ' ' HIS . 54.3 p -81.84 157.13 24.53 Favored 'General case' 0 N--CA 1.456 -0.172 0 N-CA-C 112.892 0.701 . . . . 0.0 112.892 -171.15 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 53.1 t30 -77.03 166.35 23.43 Favored 'General case' 0 C--O 1.226 -0.146 0 C-N-CA 123.203 0.601 . . . . 0.0 110.564 -178.563 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 118' ' ' GLN . . . . . . . . . . . . . 12.8 mt-30 -54.71 -36.54 64.83 Favored 'General case' 0 CA--C 1.531 0.221 0 N-CA-C 112.649 0.611 . . . . 0.0 112.649 -172.663 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 11.2 p-10 -70.99 -39.12 72.65 Favored 'General case' 0 C--O 1.226 -0.144 0 CA-C-O 121.099 0.476 . . . . 0.0 109.877 178.767 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 120' ' ' HIS . . . . . 0.474 ' CB ' ' HB2' ' A' ' 116' ' ' SER . 36.9 m170 -64.74 -38.89 92.53 Favored 'General case' 0 N--CA 1.45 -0.43 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.223 176.473 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 121' ' ' LYS . . . . . 0.598 ' HE3' ' CE2' ' A' ' 150' ' ' PHE . 46.2 mttm -58.95 -43.4 91.23 Favored 'General case' 0 C--N 1.342 0.274 0 N-CA-C 108.719 -0.845 . . . . 0.0 108.719 177.196 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 41.6 tp10 -66.34 -38.73 88.3 Favored 'General case' 0 N--CA 1.454 -0.25 0 CA-C-O 119.459 -0.305 . . . . 0.0 111.358 -176.982 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 53.2 mtpt -65.74 -28.88 69.36 Favored 'General case' 0 N--CA 1.452 -0.341 0 CA-C-N 118.511 0.596 . . . . 0.0 110.225 177.729 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 124' ' ' ILE . . . . . . . . . . . . . 61.6 mt -74.44 -37.18 44.03 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.24 0 N-CA-C 109.544 -0.539 . . . . 0.0 109.544 176.822 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 55.8 mmm-85 -65.53 -42.81 91.57 Favored 'General case' 0 C--O 1.23 0.076 0 O-C-N 122.215 -0.303 . . . . 0.0 110.969 179.851 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 126' ' ' MET . . . . . . . . . . . . . 28.6 ptm -67.57 -29.54 68.93 Favored 'General case' 0 N--CA 1.454 -0.273 0 C-N-CA 119.747 -0.781 . . . . 0.0 109.237 176.563 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 1.7 mp -63.15 -29.61 70.93 Favored 'General case' 0 N--CA 1.455 -0.208 0 CA-C-O 118.993 -0.527 . . . . 0.0 110.29 172.849 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 76.0 mt -69.16 -43.2 74.76 Favored 'General case' 0 C--N 1.34 0.163 0 CA-C-N 119.23 0.923 . . . . 0.0 109.935 175.691 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 67.0 m-20 -60.17 -39.37 86.2 Favored 'General case' 0 N--CA 1.463 0.18 0 CA-C-N 118.331 0.514 . . . . 0.0 110.041 176.514 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 130' ' ' ILE . . . . . 0.436 ' HA ' ' HD3' ' A' ' 133' ' ' ARG . 62.7 mt -66.15 -36.66 77.96 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.401 0 C-N-CA 122.911 0.484 . . . . 0.0 110.063 179.118 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 131' ' ' TRP . . . . . . . . . . . . . 49.4 m0 -75.7 -29.7 59.08 Favored 'General case' 0 N--CA 1.455 -0.197 0 N-CA-C 112.56 0.578 . . . . 0.0 112.56 177.9 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 65.3 m-20 -67.74 -31.5 71.46 Favored 'General case' 0 N--CA 1.454 -0.228 0 CA-C-N 118.243 0.474 . . . . 0.0 109.903 175.975 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 133' ' ' ARG . . . . . 0.436 ' HD3' ' HA ' ' A' ' 130' ' ' ILE . 20.8 mtp180 -73.99 -37.95 64.28 Favored 'General case' 0 C--N 1.338 0.104 0 C-N-CA 122.907 0.483 . . . . 0.0 111.164 178.905 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 43.3 t -75.88 -15.24 60.24 Favored 'General case' 0 CA--C 1.531 0.227 0 O-C-N 122.083 -0.386 . . . . 0.0 110.826 176.045 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 135' ' ' GLY . . . . . . . . . . . . . . . 85.96 12.11 71.98 Favored Glycine 0 CA--C 1.528 0.857 0 CA-C-O 119.557 -0.58 . . . . 0.0 112.648 179.003 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 136' ' ' LEU . . . . . . . . . . . . . 65.3 mt -69.52 -34.58 74.47 Favored 'General case' 0 N--CA 1.454 -0.242 0 CA-C-N 118.034 0.917 . . . . 0.0 111.201 -179.624 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 137' ' ' PHE . . . . . . . . . . . . . 73.5 m-85 -153.78 -169.3 3.24 Favored 'General case' 0 N--CA 1.456 -0.139 0 CA-C-O 120.905 0.383 . . . . 0.0 110.54 -173.017 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 138' ' ' GLN . . . . . . . . . . . . . 4.1 pt20 -147.97 171.59 15.55 Favored 'General case' 0 N--CA 1.45 -0.474 0 C-N-CA 124.437 1.095 . . . . 0.0 108.431 177.562 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 139' ' ' LYS . . . . . . . . . . . . . 57.7 mttp -72.73 61.37 0.53 Allowed 'General case' 0 CA--C 1.53 0.199 0 C-N-CA 123.238 0.615 . . . . 0.0 112.347 -177.786 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 140' ' ' SER . . . . . . . . . . . . . 39.5 t -73.55 49.91 0.31 Allowed 'General case' 0 CA--C 1.533 0.296 0 C-N-CA 124.449 1.1 . . . . 0.0 109.645 172.704 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 141' ' ' TYR . . . . . . . . . . . . . 35.7 t80 -70.54 46.74 0.09 Allowed 'General case' 0 N--CA 1.449 -0.51 0 C-N-CA 126.171 1.789 . . . . 0.0 113.708 -174.185 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 142' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -67.02 169.87 7.68 Favored 'General case' 0 N--CA 1.453 -0.281 0 N-CA-C 109.126 -0.694 . . . . 0.0 109.126 175.427 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 16.6 p30 -60.03 -15.09 19.85 Favored 'General case' 0 CA--C 1.531 0.241 0 O-C-N 122.056 -0.403 . . . . 0.0 111.5 -177.28 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . -70.83 -51.92 23.65 Favored 'General case' 0 N--CA 1.452 -0.334 0 N-CA-C 109.607 -0.516 . . . . 0.0 109.607 175.885 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 145' ' ' ILE . . . . . . . . . . . . . 40.6 mm -72.55 -30.7 35.03 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.135 0 N-CA-C 109.995 -0.372 . . . . 0.0 109.995 178.574 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 146' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -66.21 -24.85 66.69 Favored 'General case' 0 N--CA 1.454 -0.243 0 N-CA-C 108.226 -1.028 . . . . 0.0 108.226 172.498 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 147' ' ' SER . . . . . . . . . . . . . 12.3 t 55.28 77.05 0.23 Allowed 'General case' 0 N--CA 1.449 -0.483 0 C-N-CA 125.015 1.326 . . . . 0.0 111.612 177.305 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.28 -11.72 7.15 Favored 'General case' 0 CA--C 1.532 0.28 0 CA-C-N 115.28 -0.873 . . . . 0.0 111.082 172.959 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 149' ' ' CYS . . . . . . . . . . . . . 49.1 t -61.38 -33.12 73.13 Favored 'General case' 0 N--CA 1.448 -0.526 0 N-CA-C 109.415 -0.587 . . . . 0.0 109.415 178.081 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 150' ' ' PHE . . . . . 0.598 ' CE2' ' HE3' ' A' ' 121' ' ' LYS . 28.1 t80 -64.47 -30.42 71.46 Favored 'General case' 0 N--CA 1.452 -0.351 0 N-CA-C 110.214 -0.291 . . . . 0.0 110.214 -178.67 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 151' ' ' ALA . . . . . . . . . . . . . . . -76.52 -28.79 56.5 Favored 'General case' 0 N--CA 1.454 -0.23 0 N-CA-C 110.293 -0.262 . . . . 0.0 110.293 177.576 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 152' ' ' MET . . . . . . . . . . . . . 87.9 mtp -77.09 -29.43 54.92 Favored 'General case' 0 CA--C 1.53 0.188 0 N-CA-C 110.721 -0.103 . . . . 0.0 110.721 173.845 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 153' ' ' ASP . . . . . . . . . . . . . 79.2 m-20 -75.68 -44.39 42.54 Favored 'General case' 0 N--CA 1.453 -0.277 0 C-N-CA 123.76 0.824 . . . . 0.0 112.462 -179.239 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 154' ' ' LEU . . . . . . . . . . . . . 50.8 mt -141.74 169.5 17.47 Favored 'General case' 0 C--N 1.339 0.133 0 C-N-CA 123.079 0.552 . . . . 0.0 111.5 -175.888 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 155' ' ' GLU . . . . . . . . . . . . . 39.5 mp0 -66.26 -12.03 53.85 Favored 'General case' 0 N--CA 1.455 -0.198 0 C-N-CA 123.609 0.764 . . . . 0.0 110.567 176.759 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 156' ' ' HIS . . . . . . . . . . . . . 49.2 m80 -72.86 73.41 1.12 Allowed 'General case' 0 N--CA 1.452 -0.331 0 C-N-CA 123.682 0.793 . . . . 0.0 109.045 174.7 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 157' ' ' HIS . . . . . . . . . . . . . 57.7 m170 -65.55 -1.67 2.8 Favored 'General case' 0 N--CA 1.453 -0.296 0 N-CA-C 113.05 0.759 . . . . 0.0 113.05 -178.448 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 158' ' ' HIS . . . . . . . . . . . . . 97.0 m-70 -140.66 167.52 21.97 Favored 'General case' 0 N--CA 1.455 -0.183 0 C-N-CA 123.282 0.633 . . . . 0.0 110.013 -179.525 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 159' ' ' HIS . . . . . . . . . . . . . 44.9 m170 . . . . . 0 C--O 1.249 1.053 0 CA-C-O 117.751 -1.119 . . . . 0.0 110.591 -178.94 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' B' B 2052 ' ' ASP . . . . . . . . . . . . . 14.4 p-10 . . . . . 0 N--CA 1.471 0.585 0 N-CA-C 109.995 -0.372 . . . . 0.0 109.995 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' B' B 2053 ' ' ASP . . . . . . . . . . . . . 47.2 m-20 -77.61 140.99 39.73 Favored 'General case' 0 N--CA 1.452 -0.329 0 CA-C-O 121.093 0.473 . . . . 0.0 112.132 -174.742 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B 2054 ' ' ASP . . . . . . . . . . . . . 41.6 t0 -165.97 -160.2 0.43 Allowed 'General case' 0 CA--C 1.535 0.38 0 C-N-CA 125.397 1.479 . . . . 0.0 107.178 -178.283 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B 2055 ' ' GLU . . . . . . . . . . . . . 61.7 tt0 -43.77 136.15 3.63 Favored 'General case' 0 C--N 1.34 0.163 0 C-N-CA 123.546 0.739 . . . . 0.0 109.68 173.959 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B 2056 ' ' ASP . . . . . . . . . . . . . 55.6 t0 -105.08 -115.41 0.24 Allowed 'General case' 0 CA--C 1.532 0.268 0 C-N-CA 123.153 0.581 . . . . 0.0 111.73 -174.26 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B 2057 ' ' ASP . . . . . . . . . . . . . 33.0 t0 -60.03 98.68 0.06 Allowed 'General case' 0 N--CA 1.454 -0.236 0 C-N-CA 124.03 0.932 . . . . 0.0 112.149 -171.084 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B 2058 ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -75.82 145.77 40.41 Favored 'General case' 0 N--CA 1.453 -0.305 0 C-N-CA 122.92 0.488 . . . . 0.0 109.847 177.688 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B 2059 ' ' THR . . . . . . . . . . . . . 54.0 m -85.72 116.14 64.45 Favored Pre-proline 0 N--CA 1.455 -0.204 0 N-CA-C 109.61 -0.515 . . . . 0.0 109.61 179.006 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B 2060 ' ' PRO . . . . . . . . . . . . . 47.8 Cg_endo -77.73 62.03 7.7 Favored 'Trans proline' 0 N--CA 1.45 -1.038 0 C-N-CA 123.859 3.039 . . . . 0.0 110.201 179.573 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B 2061 ' ' SER . . . . . . . . . . . . . 88.2 p -62.31 143.46 56.9 Favored 'General case' 0 N--CA 1.455 -0.219 0 CA-C-O 121.021 0.438 . . . . 0.0 111.059 -177.865 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B 2062 ' ' ILE . . . . . . . . . . . . . 16.7 tt -164.63 155.93 1.82 Allowed 'Isoleucine or valine' 0 N--CA 1.453 -0.319 0 C-N-CA 123.747 0.819 . . . . 0.0 109.748 -179.378 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B 2063 ' ' SER . . . . . . . . . . . . . 82.5 p . . . . . 0 C--O 1.248 0.988 0 CA-C-O 117.097 -1.43 . . . . 0.0 109.632 174.865 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 63.2 ttp . . . . . 0 N--CA 1.474 0.743 0 N-CA-C 109.969 -0.382 . . . . 0.0 109.969 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 27.2 tp60 -153.7 135.98 14.91 Favored 'General case' 0 N--CA 1.451 -0.379 0 CA-C-O 120.973 0.415 . . . . 0.0 110.539 -179.929 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 35.6 tp60 -164.38 128.26 2.57 Favored 'General case' 0 N--CA 1.455 -0.184 0 N-CA-C 108.056 -1.09 . . . . 0.0 108.056 173.99 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' ASP . . . . . 0.48 ' C ' ' H ' ' A' ' 6' ' ' ASP . 47.7 t0 -162.37 -174.23 3.94 Favored 'General case' 0 N--CA 1.453 -0.309 0 N-CA-C 108.238 -1.023 . . . . 0.0 108.238 -177.798 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 42.3 m-20 -74.38 15.83 0.31 Allowed 'General case' 0 N--CA 1.454 -0.264 0 O-C-N 121.974 -0.454 . . . . 0.0 110.922 171.711 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' ASP . . . . . 0.48 ' H ' ' C ' ' A' ' 4' ' ' ASP . 36.2 p-10 -73.8 -28.06 61.44 Favored 'General case' 0 N--CA 1.453 -0.283 0 N-CA-C 108.788 -0.819 . . . . 0.0 108.788 179.328 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' PHE . . . . . 0.517 ' CE1' ' HD3' ' A' ' 45' ' ' LYS . 1.6 t80 -51.12 -37.31 45.3 Favored 'General case' 0 N--CA 1.448 -0.54 0 C-N-CA 124.375 1.07 . . . . 0.0 110.71 177.36 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 51.1 tp60 -53.64 -34.64 59.26 Favored 'General case' 0 N--CA 1.454 -0.268 0 C-N-CA 123.281 0.632 . . . . 0.0 111.579 -178.515 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 32.0 m-80 -72.49 -31.46 65.39 Favored 'General case' 0 N--CA 1.448 -0.528 0 N-CA-C 109.992 -0.373 . . . . 0.0 109.992 -179.587 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' PHE . . . . . 0.45 ' CE2' ' HB2' ' A' ' 32' ' ' LEU . 13.0 t80 -69.44 -40.94 76.89 Favored 'General case' 0 N--CA 1.449 -0.519 0 N-CA-C 108.986 -0.746 . . . . 0.0 108.986 175.412 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 62.6 t -64.35 -53.62 40.86 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.23 0 N-CA-C 108.657 -0.868 . . . . 0.0 108.657 179.467 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -59.84 -26.88 66.17 Favored 'General case' 0 N--CA 1.453 -0.279 0 C-N-CA 122.597 0.359 . . . . 0.0 111.808 179.534 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 91.2 m -74.25 -39.46 63.02 Favored 'General case' 0 CA--C 1.529 0.166 0 N-CA-C 109.077 -0.712 . . . . 0.0 109.077 176.703 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . 0.487 ' HA ' ' CD1' ' A' ' 17' ' ' PHE . 10.9 tp -64.42 -45.31 88.09 Favored 'General case' 0 N--CA 1.452 -0.367 0 CA-C-O 121.374 0.607 . . . . 0.0 109.371 177.402 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 68.6 mm-40 -63.85 -28.28 69.74 Favored 'General case' 0 N--CA 1.453 -0.312 0 C-N-CA 124.069 0.948 . . . . 0.0 110.005 178.393 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 74.5 m -70.62 -28.19 64.66 Favored 'General case' 0 N--CA 1.453 -0.325 0 N-CA-C 109.616 -0.513 . . . . 0.0 109.616 177.281 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' PHE . . . . . 0.487 ' CD1' ' HA ' ' A' ' 14' ' ' LEU . 16.6 m-85 -69.74 -40.94 75.87 Favored 'General case' 0 N--CA 1.454 -0.243 0 C-N-CA 119.648 -0.821 . . . . 0.0 110.267 171.554 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 81.0 mttt -61.96 -28.51 69.6 Favored 'General case' 0 C--N 1.34 0.18 0 CA-C-O 120.617 0.246 . . . . 0.0 110.691 -178.575 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 46.3 t0 -71.42 -27.12 63.07 Favored 'General case' 0 CA--C 1.532 0.281 0 CA-C-N 115.826 -0.625 . . . . 0.0 112.192 -179.407 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 97.4 mt -74.02 152.92 39.89 Favored 'General case' 0 N--CA 1.455 -0.176 0 O-C-N 122.055 -0.403 . . . . 0.0 110.78 -177.563 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . 0.476 ' HE3' ' CA ' ' A' ' 21' ' ' LYS . 0.0 OUTLIER -77.13 -30.89 55.35 Favored 'General case' 0 C--N 1.339 0.135 0 N-CA-C 110.261 -0.274 . . . . 0.0 110.261 176.3 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' SER . . . . . 0.4 ' C ' ' H ' ' A' ' 24' ' ' ILE . 99.0 p -88.33 -22.47 23.82 Favored 'General case' 0 N--CA 1.457 -0.114 0 C-N-CA 122.983 0.513 . . . . 0.0 110.931 179.568 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 73.08 -22.04 0.98 Allowed Glycine 0 CA--C 1.527 0.801 0 C-N-CA 123.532 0.586 . . . . 0.0 112.752 178.919 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . 0.4 ' H ' ' C ' ' A' ' 22' ' ' SER . 53.5 mt -78.93 149.38 5.57 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.212 0 N-CA-C 108.775 -0.824 . . . . 0.0 108.775 172.137 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 47.7 t -157.61 83.0 0.89 Allowed 'General case' 0 CA--C 1.517 -0.311 0 N-CA-C 110.146 -0.316 . . . . 0.0 110.146 177.355 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . 0.475 ' O ' ' HE2' ' A' ' 30' ' ' LYS . . . -48.58 -33.85 13.03 Favored Glycine 0 CA--C 1.526 0.741 0 N-CA-C 110.826 -0.91 . . . . 0.0 110.826 -178.89 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 4.7 t -67.76 -61.59 1.81 Allowed 'General case' 0 N--CA 1.452 -0.347 0 CA-C-N 117.407 0.604 . . . . 0.0 111.331 -178.084 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -72.68 -25.85 61.4 Favored 'General case' 0 N--CA 1.454 -0.256 0 CA-C-O 119.424 -0.322 . . . . 0.0 110.749 -175.615 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 56.7 mt -61.12 -46.51 96.49 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.332 0 N-CA-C 108.292 -1.003 . . . . 0.0 108.292 173.713 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . 0.475 ' HE2' ' O ' ' A' ' 26' ' ' GLY . 51.2 mtmt -64.74 -31.16 72.26 Favored 'General case' 0 C--N 1.34 0.154 0 CA-C-N 118.155 0.434 . . . . 0.0 111.258 178.268 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . 0.476 ' HA ' ' HE2' ' A' ' 31' ' ' LYS . 6.2 mmpt? -63.85 -59.93 3.92 Favored 'General case' 0 C--N 1.338 0.098 0 CA-C-O 119.215 -0.421 . . . . 0.0 111.61 -178.811 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . 0.45 ' HB2' ' CE2' ' A' ' 10' ' ' PHE . 1.2 pp -75.51 -16.71 60.26 Favored 'General case' 0 CA--C 1.534 0.343 0 C-N-CA 119.539 -0.865 . . . . 0.0 111.942 -178.182 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 43.5 m -72.47 -38.36 68.23 Favored 'General case' 0 C--N 1.341 0.216 0 N-CA-C 108.656 -0.868 . . . . 0.0 108.656 174.58 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 80.4 m -70.03 -36.5 75.1 Favored 'General case' 0 N--CA 1.452 -0.371 0 N-CA-C 110.168 -0.308 . . . . 0.0 110.168 179.575 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 31.5 t80 -64.8 -36.11 83.26 Favored 'General case' 0 N--CA 1.456 -0.154 0 N-CA-C 109.791 -0.448 . . . . 0.0 109.791 176.045 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -71.36 -35.46 71.12 Favored 'General case' 0 N--CA 1.45 -0.451 0 CA-C-O 119.648 -0.215 . . . . 0.0 111.422 179.253 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 2.3 mm? -69.56 -32.37 71.12 Favored 'General case' 0 N--CA 1.455 -0.182 0 CA-C-O 119.74 -0.172 . . . . 0.0 110.578 179.858 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 40.2 t0 -69.44 -22.87 63.62 Favored 'General case' 0 N--CA 1.454 -0.246 0 O-C-N 122.9 0.125 . . . . 0.0 110.745 176.283 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 77.8 m80 -150.65 101.8 2.96 Favored 'General case' 0 N--CA 1.453 -0.305 0 N-CA-C 112.583 0.586 . . . . 0.0 112.583 -174.931 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 40' ' ' ILE . . . . . 0.546 ' H ' HD11 ' A' ' 40' ' ' ILE . 0.0 OUTLIER -74.56 -9.54 12.96 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.247 0 N-CA-C 109.701 -0.481 . . . . 0.0 109.701 170.865 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 34.0 m-20 -56.72 -17.64 9.69 Favored 'General case' 0 N--CA 1.457 -0.08 0 C-N-CA 124.3 1.04 . . . . 0.0 112.541 -178.92 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -120.08 17.96 6.37 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.267 0 C-N-CA 123.825 0.85 . . . . 0.0 111.461 -178.435 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 2.9 pp20? -52.64 -32.88 44.18 Favored 'General case' 0 CA--C 1.532 0.254 0 O-C-N 121.823 -0.548 . . . . 0.0 111.103 178.159 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 40.3 t -61.16 -46.66 89.6 Favored 'General case' 0 CA--C 1.531 0.242 0 N-CA-C 112.318 0.488 . . . . 0.0 112.318 -178.958 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . 0.517 ' HD3' ' CE1' ' A' ' 7' ' ' PHE . 19.1 ptpt -73.84 -24.13 59.73 Favored 'General case' 0 C--N 1.343 0.299 0 O-C-N 121.577 -0.702 . . . . 0.0 110.153 179.897 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 64.1 mt -71.65 -48.98 49.22 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.278 0 N-CA-C 109.733 -0.469 . . . . 0.0 109.733 -179.676 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 39.4 mm -63.76 -35.93 74.8 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.237 0 N-CA-C 109.626 -0.509 . . . . 0.0 109.626 178.28 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 40.3 t -63.78 -43.48 96.24 Favored 'General case' 0 N--CA 1.455 -0.18 0 O-C-N 122.263 -0.273 . . . . 0.0 111.626 -178.985 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 33.3 mt -75.43 -33.22 60.89 Favored 'General case' 0 N--CA 1.449 -0.498 0 N-CA-C 113.23 0.826 . . . . 0.0 113.23 -176.286 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 5.1 pt -72.65 -43.97 61.03 Favored 'Isoleucine or valine' 0 C--O 1.23 0.075 0 CA-C-N 119.284 0.947 . . . . 0.0 110.787 179.702 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 21.3 pt -62.21 -40.29 87.13 Favored 'Isoleucine or valine' 0 C--N 1.339 0.145 0 C-N-CA 119.628 -0.829 . . . . 0.0 109.962 178.366 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 94.0 m-20 -70.8 -33.62 70.91 Favored 'General case' 0 N--CA 1.455 -0.18 0 CA-C-N 118.061 0.392 . . . . 0.0 111.78 177.787 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 53' ' ' TYR . . . . . 0.471 ' CD2' ' HB2' ' A' ' 65' ' ' SER . 20.8 t80 -67.67 -34.26 76.57 Favored 'General case' 0 N--CA 1.454 -0.248 0 CA-C-N 118.535 0.607 . . . . 0.0 109.667 177.017 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 35.6 t -81.76 -18.26 44.84 Favored 'General case' 0 C--N 1.338 0.075 0 N-CA-C 111.882 0.327 . . . . 0.0 111.882 178.011 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 32.0 ttp180 -93.89 -42.86 8.86 Favored 'General case' 0 N--CA 1.453 -0.314 0 N-CA-C 112.797 0.666 . . . . 0.0 112.797 -178.19 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 41.8 mt -86.3 -49.37 7.72 Favored 'General case' 0 C--N 1.338 0.093 0 N-CA-C 113.407 0.892 . . . . 0.0 113.407 -175.222 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 57' ' ' CYS . . . . . 0.403 ' HB3' ' CD ' ' A' ' 58' ' ' PRO . 84.2 m -72.34 166.72 39.01 Favored Pre-proline 0 CA--C 1.533 0.326 0 N-CA-C 113.248 0.832 . . . . 0.0 113.248 -170.996 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 58' ' ' PRO . . . . . 0.403 ' CD ' ' HB3' ' A' ' 57' ' ' CYS . 35.6 Cg_exo -61.38 166.46 11.22 Favored 'Trans proline' 0 N--CA 1.453 -0.909 1 C-N-CA 125.816 4.344 . . . . 0.0 113.404 -175.178 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 59' ' ' ASP . . . . . 0.414 ' HB2' ' HA ' ' A' ' 116' ' ' SER . 31.8 p-10 -53.86 -44.66 70.56 Favored 'General case' 0 C--N 1.329 -0.314 0 C-N-CA 125.146 1.378 . . . . 0.0 113.618 -171.328 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 9.3 t -71.73 -29.13 64.19 Favored 'General case' 0 N--CA 1.452 -0.354 0 O-C-N 122.049 -0.407 . . . . 0.0 110.151 -179.623 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 52.8 m80 -75.82 -29.47 58.68 Favored 'General case' 0 N--CA 1.452 -0.361 0 C-N-CA 122.692 0.397 . . . . 0.0 109.965 176.104 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 59.1 mttm -61.93 -41.81 98.38 Favored 'General case' 0 C--N 1.341 0.197 0 N-CA-C 109.559 -0.534 . . . . 0.0 109.559 173.164 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 3.0 tm? -63.03 -45.5 92.0 Favored 'General case' 0 N--CA 1.455 -0.222 0 N-CA-C 109.024 -0.732 . . . . 0.0 109.024 177.227 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -61.53 -27.17 67.55 Favored Glycine 0 C--N 1.339 0.729 0 N-CA-C 112.108 -0.397 . . . . 0.0 112.108 -178.95 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 65' ' ' SER . . . . . 0.471 ' HB2' ' CD2' ' A' ' 53' ' ' TYR . 30.1 t -74.66 -39.02 62.29 Favored 'General case' 0 N--CA 1.451 -0.397 0 CA-C-N 117.694 0.747 . . . . 0.0 110.561 176.795 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 82.9 mt -66.21 -23.49 66.44 Favored 'General case' 0 N--CA 1.452 -0.365 0 N-CA-C 109.721 -0.474 . . . . 0.0 109.721 177.546 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 2.3 m-30 -73.69 -39.33 64.44 Favored 'General case' 0 C--O 1.233 0.226 0 C-N-CA 122.397 0.279 . . . . 0.0 110.428 173.926 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 68' ' ' ILE . . . . . 0.424 HD13 ' CE1' ' A' ' 17' ' ' PHE . 31.5 mt -64.88 -51.19 70.0 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.543 0 N-CA-C 107.51 -1.293 . . . . 0.0 107.51 177.055 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 43.5 mt -50.26 -36.84 13.45 Favored 'Isoleucine or valine' 0 CA--C 1.528 0.133 0 C-N-CA 124.21 1.004 . . . . 0.0 111.778 174.828 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 16.6 t70 -69.87 -53.86 16.1 Favored 'General case' 0 N--CA 1.455 -0.193 0 CA-C-N 118.774 0.715 . . . . 0.0 111.116 180.0 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 79.2 p -67.89 -46.72 70.83 Favored 'General case' 0 N--CA 1.451 -0.42 0 CA-C-N 116.717 -0.22 . . . . 0.0 110.772 -174.96 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -74.84 -35.03 35.1 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.133 0 N-CA-C 109.359 -0.608 . . . . 0.0 109.359 -179.172 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -65.82 -50.76 51.41 Favored Glycine 0 C--N 1.339 0.724 0 N-CA-C 111.58 -0.608 . . . . 0.0 111.58 -175.836 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 41.7 mtm105 -69.73 -38.56 76.91 Favored 'General case' 0 N--CA 1.451 -0.4 0 CA-C-N 117.267 0.533 . . . . 0.0 110.227 179.061 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -66.57 -32.68 74.17 Favored 'General case' 0 N--CA 1.451 -0.391 0 C-N-CA 120.714 -0.395 . . . . 0.0 110.743 -179.101 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 1.0 OUTLIER -68.72 -43.52 75.79 Favored 'General case' 0 CA--C 1.518 -0.28 0 CA-C-N 118.527 0.603 . . . . 0.0 110.297 176.091 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 3.0 tm? -64.89 -47.72 76.81 Favored 'General case' 0 N--CA 1.448 -0.534 0 C-N-CA 118.359 -1.336 . . . . 0.0 108.049 178.978 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 46.9 m-20 -58.25 -43.65 87.95 Favored 'General case' 0 C--O 1.23 0.065 0 N-CA-C 112.38 0.511 . . . . 0.0 112.38 -178.063 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 10.4 tm-20 -63.96 -45.06 90.78 Favored 'General case' 0 N--CA 1.447 -0.583 0 CA-C-N 118.186 0.448 . . . . 0.0 110.623 -177.81 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 61.2 p -69.8 -37.62 76.37 Favored 'General case' 0 N--CA 1.453 -0.321 0 CA-C-O 118.927 -0.559 . . . . 0.0 111.1 -177.136 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 7.4 ppt_? -75.85 -16.55 60.05 Favored 'General case' 0 C--N 1.341 0.211 0 CA-C-N 118.823 0.738 . . . . 0.0 111.627 178.05 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 36.9 m -90.72 -36.63 14.21 Favored 'General case' 0 N--CA 1.456 -0.145 0 N-CA-C 112.353 0.501 . . . . 0.0 112.353 179.132 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 66.9 m-20 -119.86 26.14 9.51 Favored 'General case' 0 CA--C 1.52 -0.19 0 N-CA-C 112.954 0.724 . . . . 0.0 112.954 -174.985 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 26.0 t 58.33 15.51 3.48 Favored 'General case' 0 N--CA 1.447 -0.576 0 N-CA-C 114.314 1.227 . . . . 0.0 114.314 173.722 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 80.5 m-20 -76.45 14.11 0.83 Allowed 'General case' 0 CA--C 1.532 0.278 0 CA-C-N 118.413 0.551 . . . . 0.0 111.135 177.887 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 79.2 p -71.7 162.1 29.97 Favored 'General case' 0 N--CA 1.453 -0.32 0 C-N-CA 123.431 0.692 . . . . 0.0 110.822 178.38 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 47.1 t -156.61 -178.96 7.73 Favored 'General case' 0 N--CA 1.452 -0.367 0 C-N-CA 123.145 0.578 . . . . 0.0 109.465 -179.349 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 96.9 p -138.78 8.68 2.58 Favored 'General case' 0 N--CA 1.455 -0.222 0 C-N-CA 123.264 0.625 . . . . 0.0 109.945 175.691 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 9.2 t-20 -161.2 159.2 28.53 Favored 'General case' 0 CA--C 1.531 0.238 0 C-N-CA 122.767 0.427 . . . . 0.0 110.269 -178.525 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 60.0 mttp 63.12 150.51 0.11 Allowed Pre-proline 0 CA--C 1.534 0.353 0 C-N-CA 126.028 1.731 . . . . 0.0 114.182 178.834 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_endo -69.09 170.03 16.71 Favored 'Trans proline' 0 N--CA 1.453 -0.875 0 C-N-CA 124.425 3.417 . . . . 0.0 110.384 175.71 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 96.04 17.29 35.41 Favored Glycine 0 CA--C 1.523 0.586 0 CA-C-O 119.363 -0.687 . . . . 0.0 112.908 177.071 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 35.2 p -151.77 169.24 22.7 Favored 'General case' 0 CA--C 1.518 -0.266 0 C-N-CA 123.907 0.883 . . . . 0.0 109.227 175.974 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 94' ' ' CYS . . . . . . . . . . . . . 1.8 p -67.16 -16.95 64.63 Favored 'General case' 0 N--CA 1.447 -0.612 0 N-CA-C 109.692 -0.485 . . . . 0.0 109.692 178.599 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -62.91 -57.24 11.46 Favored 'General case' 0 N--CA 1.449 -0.5 0 N-CA-C 109.833 -0.432 . . . . 0.0 109.833 -177.104 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 72.9 t60 -72.39 -31.25 65.4 Favored 'General case' 0 N--CA 1.451 -0.408 0 N-CA-C 110.208 -0.293 . . . . 0.0 110.208 179.243 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -65.67 -56.56 11.5 Favored 'General case' 0 N--CA 1.451 -0.417 0 O-C-N 123.274 0.359 . . . . 0.0 111.517 -178.32 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 2.1 mp -67.72 -34.62 68.95 Favored 'Isoleucine or valine' 0 C--N 1.34 0.195 0 C-N-CA 120.494 -0.483 . . . . 0.0 110.456 -179.13 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 69.2 m-20 -66.71 -45.1 79.82 Favored 'General case' 0 N--CA 1.45 -0.448 0 CA-C-N 118.157 0.435 . . . . 0.0 111.509 179.534 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 98.3 m -69.12 -29.62 67.72 Favored 'General case' 0 C--N 1.338 0.088 0 CA-C-N 117.976 0.353 . . . . 0.0 110.455 -177.227 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 62.2 tp -74.11 -33.98 63.77 Favored 'General case' 0 N--CA 1.447 -0.607 0 C-N-CA 122.758 0.423 . . . . 0.0 110.431 179.558 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -67.59 -17.4 68.86 Favored Glycine 0 CA--C 1.526 0.774 0 CA-C-O 119.636 -0.536 . . . . 0.0 112.845 -177.232 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 25.5 mt-10 -79.5 -25.93 41.7 Favored 'General case' 0 C--N 1.338 0.096 0 CA-C-N 118.004 0.902 . . . . 0.0 111.316 -179.696 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 25.3 m -116.92 -6.67 11.91 Favored 'Isoleucine or valine' 0 C--O 1.23 0.061 0 N-CA-C 112.924 0.713 . . . . 0.0 112.924 -174.687 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 105' ' ' ILE . . . . . . . . . . . . . 17.5 tt -60.09 -23.07 26.17 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.25 0 CA-C-N 118.979 0.809 . . . . 0.0 111.635 -179.694 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 25.7 pt20 -61.6 -35.0 76.62 Favored 'General case' 0 N--CA 1.45 -0.447 0 C-N-CA 122.867 0.467 . . . . 0.0 110.19 175.906 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 49.2 mt-10 -71.95 -40.88 68.39 Favored 'General case' 0 N--CA 1.454 -0.232 0 N-CA-C 109.454 -0.573 . . . . 0.0 109.454 -179.828 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 20.2 mt -73.0 -40.87 64.84 Favored 'General case' 0 N--CA 1.449 -0.512 0 CA-C-N 115.899 -0.592 . . . . 0.0 110.706 -173.283 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 84.7 mt -68.56 -63.17 1.11 Allowed 'General case' 0 N--CA 1.448 -0.539 0 N-CA-C 109.626 -0.509 . . . . 0.0 109.626 178.517 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 24.4 p -46.0 -48.37 16.63 Favored 'General case' 0 CA--C 1.52 -0.183 0 C-N-CA 122.613 0.365 . . . . 0.0 111.976 -177.329 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 39.3 t0 -70.66 -35.99 73.14 Favored 'General case' 0 N--CA 1.447 -0.579 0 CA-C-N 116.882 -0.144 . . . . 0.0 110.977 -176.148 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -72.88 -31.54 64.77 Favored 'General case' 0 N--CA 1.448 -0.528 0 C-N-CA 120.882 -0.327 . . . . 0.0 110.735 -178.487 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 113' ' ' ILE . . . . . . . . . . . . . 45.4 mm -68.33 -40.86 83.12 Favored 'Isoleucine or valine' 0 C--N 1.339 0.111 0 N-CA-C 108.892 -0.781 . . . . 0.0 108.892 176.316 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -72.78 -38.3 67.33 Favored 'General case' 0 N--CA 1.45 -0.441 0 CA-C-N 115.697 -0.683 . . . . 0.0 111.926 -177.562 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 115' ' ' LYS . . . . . 0.589 ' HZ3' ' HB2' ' A' ' 115' ' ' LYS . 0.0 OUTLIER -90.46 -33.53 15.95 Favored 'General case' 0 N--CA 1.453 -0.283 0 N-CA-C 113.844 1.053 . . . . 0.0 113.844 -174.968 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 116' ' ' SER . . . . . 0.526 ' O ' ' HE3' ' A' ' 121' ' ' LYS . 1.0 OUTLIER -89.4 160.47 16.8 Favored 'General case' 0 C--N 1.339 0.111 0 N-CA-C 113.45 0.907 . . . . 0.0 113.45 -167.886 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 46.4 t30 -75.51 169.69 17.6 Favored 'General case' 0 C--O 1.226 -0.164 0 C-N-CA 123.983 0.913 . . . . 0.0 111.872 -173.941 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 118' ' ' GLN . . . . . . . . . . . . . 14.8 mm100 -54.37 -37.23 64.74 Favored 'General case' 0 C--N 1.338 0.094 0 C-N-CA 124.03 0.932 . . . . 0.0 112.954 -173.456 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 16.7 p-10 -69.28 -43.3 74.16 Favored 'General case' 0 N--CA 1.453 -0.301 0 N-CA-C 109.393 -0.595 . . . . 0.0 109.393 179.401 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 78.8 m-70 -69.22 -36.12 76.9 Favored 'General case' 0 N--CA 1.45 -0.444 0 CA-C-O 119.311 -0.376 . . . . 0.0 110.939 177.949 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 121' ' ' LYS . . . . . 0.526 ' HE3' ' O ' ' A' ' 116' ' ' SER . 89.8 mttt -58.49 -40.91 84.08 Favored 'General case' 0 C--O 1.231 0.129 0 N-CA-C 108.793 -0.817 . . . . 0.0 108.793 176.063 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 38.3 tp10 -73.99 -35.13 64.41 Favored 'General case' 0 N--CA 1.451 -0.378 0 C-N-CA 122.32 0.248 . . . . 0.0 110.93 179.849 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 84.9 mttt -63.95 -37.65 88.2 Favored 'General case' 0 N--CA 1.453 -0.296 0 N-CA-C 109.546 -0.538 . . . . 0.0 109.546 177.572 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 124' ' ' ILE . . . . . . . . . . . . . 56.4 mt -66.05 -38.92 83.11 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.182 0 N-CA-C 110.032 -0.359 . . . . 0.0 110.032 174.737 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 17.5 mtp180 -66.43 -42.31 87.91 Favored 'General case' 0 C--N 1.34 0.158 0 C-N-CA 122.404 0.282 . . . . 0.0 111.398 -177.356 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 126' ' ' MET . . . . . . . . . . . . . 17.8 ptp -68.42 -31.55 70.96 Favored 'General case' 0 N--CA 1.452 -0.325 0 C-N-CA 119.613 -0.835 . . . . 0.0 109.424 176.482 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 2.2 mp -63.25 -35.39 80.18 Favored 'General case' 0 N--CA 1.454 -0.267 0 N-CA-C 109.695 -0.483 . . . . 0.0 109.695 177.245 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 99.2 mt -68.34 -38.15 81.22 Favored 'General case' 0 N--CA 1.454 -0.256 0 CA-C-N 118.471 0.578 . . . . 0.0 110.049 177.687 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 14.9 t0 -65.49 -45.63 82.84 Favored 'General case' 0 CA--C 1.531 0.212 0 CA-C-N 118.055 0.389 . . . . 0.0 110.052 175.567 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 130' ' ' ILE . . . . . 0.416 ' HA ' ' HD3' ' A' ' 133' ' ' ARG . 51.5 mt -61.11 -34.11 58.86 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.296 0 C-N-CA 123.031 0.532 . . . . 0.0 110.202 -178.721 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 131' ' ' TRP . . . . . . . . . . . . . 50.5 m0 -79.45 -25.8 41.89 Favored 'General case' 0 N--CA 1.452 -0.371 0 N-CA-C 112.928 0.714 . . . . 0.0 112.928 179.271 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 76.8 m-20 -76.81 -27.82 55.33 Favored 'General case' 0 CA--C 1.526 0.048 0 CA-C-N 118.882 0.764 . . . . 0.0 111.329 175.113 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 133' ' ' ARG . . . . . 0.439 HH21 ' C ' ' B' 2063 ' ' SER . 14.7 mtp180 -73.69 -42.99 60.53 Favored 'General case' 0 N--CA 1.455 -0.191 0 C-N-CA 122.798 0.439 . . . . 0.0 110.069 176.952 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 31.6 p -79.86 -14.88 58.33 Favored 'General case' 0 CA--C 1.531 0.25 0 C-N-CA 123.239 0.615 . . . . 0.0 111.033 176.844 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 135' ' ' GLY . . . . . . . . . . . . . . . 76.64 -68.64 2.45 Favored Glycine 0 CA--C 1.526 0.761 0 C-N-CA 124.036 0.827 . . . . 0.0 113.047 174.709 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 136' ' ' LEU . . . . . . . . . . . . . 10.7 mp 56.56 8.66 0.47 Allowed 'General case' 0 CA--C 1.536 0.407 0 C-N-CA 124.914 1.286 . . . . 0.0 113.164 -175.092 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 137' ' ' PHE . . . . . . . . . . . . . 66.4 m-85 53.91 16.99 1.2 Allowed 'General case' 0 CA--C 1.533 0.294 0 N-CA-C 114.622 1.342 . . . . 0.0 114.622 175.887 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 138' ' ' GLN . . . . . . . . . . . . . 39.1 mm-40 -140.89 145.54 36.27 Favored 'General case' 0 N--CA 1.457 -0.091 0 C-N-CA 122.972 0.509 . . . . 0.0 109.7 177.624 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 139' ' ' LYS . . . . . . . . . . . . . 53.2 mmtt -145.96 162.16 38.45 Favored 'General case' 0 C--N 1.339 0.131 0 C-N-CA 123.558 0.743 . . . . 0.0 110.118 -178.133 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 140' ' ' SER . . . . . . . . . . . . . 47.1 t -150.66 34.56 0.62 Allowed 'General case' 0 N--CA 1.452 -0.339 0 CA-C-N 116.373 -0.376 . . . . 0.0 111.797 -174.971 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 141' ' ' TYR . . . . . . . . . . . . . 43.5 m-85 -71.61 44.73 0.1 Allowed 'General case' 0 CA--C 1.534 0.354 0 C-N-CA 123.345 0.658 . . . . 0.0 111.818 177.528 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 142' ' ' LEU . . . . . . . . . . . . . 75.7 mt -70.56 161.85 29.92 Favored 'General case' 0 N--CA 1.455 -0.22 0 C-N-CA 123.367 0.667 . . . . 0.0 109.764 176.796 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 72.3 m-20 -60.15 -20.89 60.57 Favored 'General case' 0 N--CA 1.455 -0.209 0 N-CA-C 112.137 0.421 . . . . 0.0 112.137 -176.976 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . -64.71 -34.62 78.74 Favored 'General case' 0 N--CA 1.451 -0.391 0 CA-C-N 117.724 0.238 . . . . 0.0 110.411 178.461 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 145' ' ' ILE . . . . . . . . . . . . . 23.4 mm -78.31 -32.78 17.03 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.159 0 CA-C-O 120.558 0.218 . . . . 0.0 110.622 177.114 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 146' ' ' ARG . . . . . 0.453 ' O ' ' HE2' ' A' ' 148' ' ' LYS . 85.6 mtt180 -75.63 -17.68 59.93 Favored 'General case' 0 CA--C 1.518 -0.282 0 CA-C-O 118.772 -0.632 . . . . 0.0 112.298 -176.671 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 147' ' ' SER . . . . . . . . . . . . . 39.0 t -70.64 61.76 0.25 Allowed 'General case' 0 N--CA 1.454 -0.228 0 CA-C-O 122.149 0.976 . . . . 0.0 111.249 177.264 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 148' ' ' LYS . . . . . 0.453 ' HE2' ' O ' ' A' ' 146' ' ' ARG . 0.0 OUTLIER -46.6 -15.8 0.03 OUTLIER 'General case' 0 CA--C 1.53 0.194 0 C-N-CA 126.067 1.747 . . . . 0.0 113.695 172.905 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 149' ' ' CYS . . . . . . . . . . . . . 61.0 m -58.93 -29.65 67.25 Favored 'General case' 0 N--CA 1.452 -0.326 0 CA-C-N 118.039 0.381 . . . . 0.0 111.403 -175.654 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 150' ' ' PHE . . . . . . . . . . . . . 9.7 m-85 -63.16 -30.96 72.0 Favored 'General case' 0 N--CA 1.455 -0.187 0 CA-C-N 118.215 0.461 . . . . 0.0 110.301 -179.506 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 151' ' ' ALA . . . . . . . . . . . . . . . -79.36 -42.51 25.45 Favored 'General case' 0 N--CA 1.448 -0.566 0 C-N-CA 122.429 0.292 . . . . 0.0 110.322 178.244 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 152' ' ' MET . . . . . . . . . . . . . 93.7 mtp -64.35 -29.94 71.0 Favored 'General case' 0 N--CA 1.456 -0.143 0 C-N-CA 122.993 0.517 . . . . 0.0 111.249 -176.71 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 153' ' ' ASP . . . . . . . . . . . . . 69.1 m-20 -75.71 -14.33 60.33 Favored 'General case' 0 N--CA 1.452 -0.353 0 C-N-CA 123.283 0.633 . . . . 0.0 111.765 176.653 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 154' ' ' LEU . . . . . . . . . . . . . 89.5 mt -130.94 40.34 3.49 Favored 'General case' 0 N--CA 1.455 -0.184 0 C-N-CA 123.648 0.779 . . . . 0.0 112.107 -172.57 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 155' ' ' GLU . . . . . . . . . . . . . 19.7 pt-20 -154.28 150.2 27.75 Favored 'General case' 0 N--CA 1.454 -0.227 0 CA-C-O 121.105 0.478 . . . . 0.0 111.611 177.405 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 156' ' ' HIS . . . . . . . . . . . . . 31.3 m80 -79.22 -14.45 59.06 Favored 'General case' 0 C--N 1.34 0.181 0 CA-C-N 115.882 -0.599 . . . . 0.0 111.835 -179.239 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 157' ' ' HIS . . . . . . . . . . . . . 86.0 t60 -156.54 142.16 17.71 Favored 'General case' 0 N--CA 1.455 -0.175 0 N-CA-C 109.66 -0.496 . . . . 0.0 109.66 179.587 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 158' ' ' HIS . . . . . . . . . . . . . 48.5 m170 -81.63 151.93 27.39 Favored 'General case' 0 CA--C 1.529 0.161 0 C-N-CA 122.667 0.387 . . . . 0.0 111.279 -176.59 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 159' ' ' HIS . . . . . . . . . . . . . 79.3 t60 . . . . . 0 C--O 1.251 1.167 0 CA-C-O 117.592 -1.194 . . . . 0.0 109.809 -177.463 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' B' B 2052 ' ' ASP . . . . . . . . . . . . . 2.4 m-20 . . . . . 0 N--CA 1.474 0.767 0 N-CA-C 110.144 -0.317 . . . . 0.0 110.144 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' B' B 2053 ' ' ASP . . . . . . . . . . . . . 5.2 m-20 -68.02 122.15 17.61 Favored 'General case' 0 N--CA 1.455 -0.223 0 CA-C-N 116.479 -0.328 . . . . 0.0 110.35 -176.95 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B 2054 ' ' ASP . . . . . . . . . . . . . 44.9 t0 -167.75 174.44 7.62 Favored 'General case' 0 CA--C 1.531 0.217 0 N-CA-C 108.719 -0.845 . . . . 0.0 108.719 -177.724 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B 2055 ' ' GLU . . . . . . . . . . . . . 54.1 mt-10 -70.5 -11.2 60.77 Favored 'General case' 0 CA--C 1.533 0.314 0 N-CA-C 109.459 -0.571 . . . . 0.0 109.459 173.408 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B 2056 ' ' ASP . . . . . . . . . . . . . 45.5 t0 50.6 -111.17 0.51 Allowed 'General case' 0 N--CA 1.455 -0.195 0 C-N-CA 125.488 1.515 . . . . 0.0 112.48 177.68 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B 2057 ' ' ASP . . . . . . . . . . . . . 22.2 t0 -63.18 170.43 2.89 Favored 'General case' 0 CA--C 1.534 0.348 0 C-N-CA 123.631 0.772 . . . . 0.0 112.756 -173.642 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B 2058 ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -143.47 153.6 42.8 Favored 'General case' 0 N--CA 1.456 -0.133 0 C-N-CA 124.342 1.057 . . . . 0.0 108.77 -178.969 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B 2059 ' ' THR . . . . . . . . . . . . . 38.7 m -137.9 119.6 10.72 Favored Pre-proline 0 N--CA 1.451 -0.415 0 N-CA-C 108.624 -0.88 . . . . 0.0 108.624 -179.115 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B 2060 ' ' PRO . . . . . . . . . . . . . 86.0 Cg_endo -75.06 169.19 23.13 Favored 'Trans proline' 0 N--CA 1.447 -1.253 0 C-N-CA 123.766 2.977 . . . . 0.0 111.131 -179.946 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B 2061 ' ' SER . . . . . . . . . . . . . 59.5 m -151.62 138.67 19.13 Favored 'General case' 0 N--CA 1.454 -0.258 0 N-CA-C 108.461 -0.94 . . . . 0.0 108.461 175.828 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B 2062 ' ' ILE . . . . . . . . . . . . . 16.7 tt -164.23 155.14 2.12 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.222 0 CA-C-N 116.642 -0.254 . . . . 0.0 110.424 -176.309 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B 2063 ' ' SER . . . . . 0.439 ' C ' HH21 ' A' ' 133' ' ' ARG . 81.3 p . . . . . 0 C--O 1.253 1.246 0 CA-C-O 117.488 -1.244 . . . . 0.0 109.65 174.17 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.44 ' H3 ' ' CG ' ' A' ' 5' ' ' ASP . 70.4 mtm . . . . . 0 N--CA 1.472 0.643 0 N-CA-C 110.223 -0.288 . . . . 0.0 110.223 . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -138.64 -167.46 2.2 Favored 'General case' 0 N--CA 1.456 -0.136 0 N-CA-C 109.166 -0.679 . . . . 0.0 109.166 179.872 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . 0.405 ' CD ' ' H ' ' A' ' 3' ' ' GLN . 4.1 pm0 -59.32 -20.2 52.61 Favored 'General case' 0 CA--C 1.536 0.421 0 N-CA-C 110.106 -0.331 . . . . 0.0 110.106 174.384 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' ASP . . . . . 0.452 ' CG ' ' HZ3' ' A' ' 45' ' ' LYS . 21.3 p30 -155.52 143.84 20.18 Favored 'General case' 0 N--CA 1.452 -0.364 0 C-N-CA 123.772 0.829 . . . . 0.0 108.923 172.855 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . 0.44 ' CG ' ' H3 ' ' A' ' 1' ' ' MET . 51.1 m-20 -110.09 18.28 20.16 Favored 'General case' 0 N--CA 1.457 -0.114 0 N-CA-C 112.389 0.514 . . . . 0.0 112.389 -178.287 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 21.2 p-10 -70.39 -29.18 65.76 Favored 'General case' 0 C--N 1.331 -0.222 0 N-CA-C 108.032 -1.099 . . . . 0.0 108.032 175.863 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' PHE . . . . . 0.494 ' CD1' ' HD3' ' A' ' 45' ' ' LYS . 1.2 t80 -55.03 -30.47 59.62 Favored 'General case' 0 N--CA 1.445 -0.695 0 C-N-CA 126.09 1.756 . . . . 0.0 111.213 -178.02 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 52.1 tp60 -50.48 -36.51 33.97 Favored 'General case' 0 N--CA 1.455 -0.218 0 C-N-CA 124.125 0.97 . . . . 0.0 111.878 -177.679 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 33.8 m-80 -72.36 -36.36 68.75 Favored 'General case' 0 N--CA 1.454 -0.251 0 CA-C-N 117.939 0.336 . . . . 0.0 110.294 -179.195 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 1.9 t80 -70.84 -39.27 73.08 Favored 'General case' 0 N--CA 1.452 -0.336 0 C-N-CA 123.519 0.728 . . . . 0.0 109.044 178.008 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 76.6 t -66.59 -53.02 39.58 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.385 0 N-CA-C 108.776 -0.824 . . . . 0.0 108.776 179.446 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -60.07 -31.25 69.83 Favored 'General case' 0 N--CA 1.454 -0.267 0 C-N-CA 122.759 0.424 . . . . 0.0 111.839 -178.517 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 86.6 m -67.53 -43.78 79.95 Favored 'General case' 0 CA--C 1.531 0.241 0 N-CA-C 108.691 -0.855 . . . . 0.0 108.691 176.488 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 5.5 tp -69.36 -39.56 78.02 Favored 'General case' 0 N--CA 1.452 -0.356 0 CA-C-N 116.418 -0.355 . . . . 0.0 111.278 -179.559 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 69.4 mm-40 -62.73 -33.76 75.8 Favored 'General case' 0 N--CA 1.451 -0.421 0 C-N-CA 123.596 0.758 . . . . 0.0 109.206 178.226 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 49.5 m -66.21 -32.89 74.59 Favored 'General case' 0 N--CA 1.451 -0.412 0 N-CA-C 108.881 -0.785 . . . . 0.0 108.881 176.774 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' PHE . . . . . 0.456 ' CE2' ' HB3' ' A' ' 25' ' ' SER . 14.8 m-30 -69.83 -33.82 72.83 Favored 'General case' 0 C--N 1.339 0.126 0 N-CA-C 112.2 0.444 . . . . 0.0 112.2 174.904 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 70.5 mttt -64.54 -27.08 68.72 Favored 'General case' 0 C--N 1.339 0.134 0 N-CA-C 109.243 -0.651 . . . . 0.0 109.243 174.944 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 43.8 t0 -79.41 -22.24 44.54 Favored 'General case' 0 CA--C 1.535 0.368 0 CA-C-N 115.701 -0.681 . . . . 0.0 111.898 177.009 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 81.1 mt -72.65 148.54 44.69 Favored 'General case' 0 N--CA 1.457 -0.11 0 O-C-N 121.152 -0.968 . . . . 0.0 110.674 179.649 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 1.6 mppt? -86.73 20.31 2.6 Favored 'General case' 0 CA--C 1.534 0.351 0 CA-C-N 115.653 -0.703 . . . . 0.0 109.33 175.713 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 79.9 p -147.46 -32.51 0.29 Allowed 'General case' 0 CA--C 1.53 0.198 0 C-N-CA 123.953 0.901 . . . . 0.0 111.237 -176.803 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 80.07 -19.91 6.17 Favored Glycine 0 CA--C 1.527 0.841 0 CA-C-O 119.601 -0.555 . . . . 0.0 113.63 176.194 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 96.3 mt -89.86 145.88 6.86 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.128 0 CA-C-N 118.059 0.93 . . . . 0.0 109.549 176.188 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' SER . . . . . 0.456 ' HB3' ' CE2' ' A' ' 17' ' ' PHE . 33.4 t -166.71 88.53 0.34 Allowed 'General case' 0 N--CA 1.455 -0.225 0 CA-C-N 117.679 0.218 . . . . 0.0 110.813 176.517 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -47.58 -56.55 8.27 Favored Glycine 0 CA--C 1.528 0.861 0 CA-C-O 119.111 -0.827 . . . . 0.0 114.623 -170.753 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' SER . . . . . 0.572 ' HA ' ' HE3' ' A' ' 30' ' ' LYS . 38.9 m -63.55 -36.25 83.17 Favored 'General case' 0 CA--C 1.524 -0.027 0 CA-C-N 119.2 1.5 . . . . 0.0 112.026 -176.328 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -75.76 -37.54 59.17 Favored 'General case' 0 CA--C 1.529 0.172 0 N-CA-C 109.846 -0.427 . . . . 0.0 109.846 179.079 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 60.6 mt -58.03 -42.82 83.72 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.501 0 N-CA-C 108.237 -1.023 . . . . 0.0 108.237 172.163 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . 0.572 ' HE3' ' HA ' ' A' ' 27' ' ' SER . 45.2 mtmt -69.1 -23.36 63.99 Favored 'General case' 0 N--CA 1.454 -0.226 0 CA-C-O 118.846 -0.597 . . . . 0.0 111.497 178.777 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . 0.447 ' CE ' ' HA ' ' A' ' 31' ' ' LYS . 3.9 mmpt? -67.64 -51.59 48.18 Favored 'General case' 0 C--N 1.34 0.183 0 CA-C-N 118.904 0.775 . . . . 0.0 110.314 175.405 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 4.2 pp -75.0 -23.25 58.21 Favored 'General case' 0 CA--C 1.531 0.227 0 C-N-CA 119.943 -0.703 . . . . 0.0 110.671 179.431 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 51.9 m -71.54 -39.34 70.76 Favored 'General case' 0 CA--C 1.523 -0.095 0 N-CA-C 109.678 -0.489 . . . . 0.0 109.678 177.125 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 99.7 m -70.61 -41.46 72.22 Favored 'General case' 0 N--CA 1.45 -0.47 0 N-CA-C 109.685 -0.487 . . . . 0.0 109.685 -177.881 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 29.1 t80 -66.07 -30.29 70.78 Favored 'General case' 0 N--CA 1.453 -0.282 0 C-N-CA 119.772 -0.771 . . . . 0.0 109.815 178.206 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -71.03 -27.86 63.97 Favored 'General case' 0 N--CA 1.449 -0.489 0 CA-C-O 119.492 -0.289 . . . . 0.0 111.375 176.102 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 11.4 mt -81.18 -39.63 25.17 Favored 'General case' 0 CA--C 1.519 -0.242 0 N-CA-C 108.926 -0.768 . . . . 0.0 108.926 -179.943 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 86.1 m-20 -58.65 -30.79 67.58 Favored 'General case' 0 N--CA 1.44 -0.949 0 C-N-CA 123.843 0.857 . . . . 0.0 110.633 175.076 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 78.4 m80 -149.93 103.3 3.2 Favored 'General case' 0 N--CA 1.453 -0.306 0 C-N-CA 122.885 0.474 . . . . 0.0 111.299 179.147 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 40' ' ' ILE . . . . . 0.587 HD11 ' H ' ' A' ' 40' ' ' ILE . 0.0 OUTLIER -75.72 -9.92 13.1 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.449 0 N-CA-C 109.136 -0.69 . . . . 0.0 109.136 172.672 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 4.6 m-20 -55.21 -25.11 30.95 Favored 'General case' 0 N--CA 1.455 -0.224 0 C-N-CA 124.026 0.931 . . . . 0.0 111.58 -177.744 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -105.62 16.33 6.45 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.328 0 C-N-CA 123.454 0.701 . . . . 0.0 112.105 -179.656 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 2.7 pp20? -52.31 -31.31 32.48 Favored 'General case' 0 CA--C 1.529 0.135 0 CA-C-N 118.641 0.655 . . . . 0.0 111.051 178.583 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 40.8 t -62.27 -46.85 86.95 Favored 'General case' 0 CA--C 1.531 0.238 0 N-CA-C 112.265 0.469 . . . . 0.0 112.265 -177.879 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . 0.494 ' HD3' ' CD1' ' A' ' 7' ' ' PHE . 14.6 ptpt -74.34 -23.49 59.05 Favored 'General case' 0 C--N 1.341 0.219 0 O-C-N 121.892 -0.505 . . . . 0.0 110.149 179.21 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 85.5 mt -73.74 -47.81 42.45 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.307 0 N-CA-C 110.059 -0.348 . . . . 0.0 110.059 -178.697 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 40.7 mm -66.93 -38.28 81.08 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.13 0 N-CA-C 109.781 -0.452 . . . . 0.0 109.781 179.415 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 27.8 t -64.78 -34.25 77.91 Favored 'General case' 0 N--CA 1.454 -0.258 0 C-N-CA 121.103 -0.239 . . . . 0.0 110.459 178.14 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 40.9 tp -75.15 -34.51 61.63 Favored 'General case' 0 N--CA 1.452 -0.353 0 N-CA-C 112.673 0.62 . . . . 0.0 112.673 -176.605 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 11.4 pt -71.23 -43.21 74.73 Favored 'Isoleucine or valine' 0 C--N 1.339 0.151 0 CA-C-N 118.459 0.572 . . . . 0.0 110.162 178.574 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 35.4 pt -65.29 -39.77 86.41 Favored 'Isoleucine or valine' 0 C--O 1.231 0.103 0 C-N-CA 119.87 -0.732 . . . . 0.0 110.842 -178.516 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 78.3 m-20 -65.11 -51.46 61.14 Favored 'General case' 0 N--CA 1.454 -0.254 0 CA-C-N 117.462 0.119 . . . . 0.0 111.214 179.04 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 15.9 t80 -63.95 -45.54 88.72 Favored 'General case' 0 N--CA 1.453 -0.306 0 N-CA-C 110.1 -0.334 . . . . 0.0 110.1 -179.293 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 31.7 t -65.2 -29.9 70.75 Favored 'General case' 0 N--CA 1.455 -0.216 0 N-CA-C 112.646 0.61 . . . . 0.0 112.646 -175.204 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 17.0 tpt85 -82.14 -36.67 27.2 Favored 'General case' 0 N--CA 1.454 -0.235 0 C-N-CA 119.697 -0.801 . . . . 0.0 111.193 -178.492 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 57.7 mt -80.98 -43.26 19.93 Favored 'General case' 0 C--O 1.227 -0.111 0 N-CA-C 112.764 0.654 . . . . 0.0 112.764 -178.482 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 57' ' ' CYS . . . . . 0.449 ' HB2' ' HD2' ' A' ' 58' ' ' PRO . 13.3 p -62.06 159.78 35.09 Favored Pre-proline 0 CA--C 1.536 0.419 0 N-CA-C 112.875 0.695 . . . . 0.0 112.875 -173.93 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 58' ' ' PRO . . . . . 0.449 ' HD2' ' HB2' ' A' ' 57' ' ' CYS . 84.3 Cg_endo -74.7 169.94 21.45 Favored 'Trans proline' 0 N--CA 1.451 -1.014 0 C-N-CA 124.209 3.272 . . . . 0.0 110.183 179.4 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -50.5 -47.04 57.45 Favored 'General case' 0 N--CA 1.457 -0.124 0 N-CA-C 114.287 1.218 . . . . 0.0 114.287 -170.795 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 16.6 t -66.79 -32.1 73.16 Favored 'General case' 0 N--CA 1.455 -0.198 0 C-N-CA 119.539 -0.864 . . . . 0.0 110.038 -177.323 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 54.8 m170 -76.03 -27.55 57.36 Favored 'General case' 0 N--CA 1.453 -0.276 0 N-CA-C 109.973 -0.38 . . . . 0.0 109.973 177.221 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 68.0 mttm -65.73 -39.87 91.58 Favored 'General case' 0 C--N 1.343 0.305 0 N-CA-C 109.106 -0.702 . . . . 0.0 109.106 174.074 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -63.08 -41.64 99.46 Favored 'General case' 0 N--CA 1.452 -0.374 0 N-CA-C 108.283 -1.006 . . . . 0.0 108.283 176.702 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -67.63 -31.56 76.51 Favored Glycine 0 CA--C 1.525 0.704 0 CA-C-O 119.713 -0.493 . . . . 0.0 112.271 -179.197 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 22.6 t -74.28 -32.75 63.02 Favored 'General case' 0 N--CA 1.453 -0.277 0 CA-C-N 118.118 0.959 . . . . 0.0 110.566 178.157 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 69.1 mt -71.99 -24.86 61.64 Favored 'General case' 0 N--CA 1.452 -0.328 0 N-CA-C 109.336 -0.616 . . . . 0.0 109.336 176.037 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -72.47 -36.88 68.59 Favored 'General case' 0 N--CA 1.455 -0.19 0 N-CA-C 110.333 -0.247 . . . . 0.0 110.333 174.533 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 68' ' ' ILE . . . . . . . . . . . . . 27.1 mt -66.65 -49.58 73.53 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.356 0 N-CA-C 108.811 -0.811 . . . . 0.0 108.811 174.886 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 67.1 mt -54.14 -34.68 27.43 Favored 'Isoleucine or valine' 0 C--O 1.226 -0.177 0 C-N-CA 123.085 0.554 . . . . 0.0 111.702 175.78 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 28.9 t70 -68.3 -44.58 75.11 Favored 'General case' 0 N--CA 1.452 -0.331 0 CA-C-N 119.112 0.869 . . . . 0.0 110.651 176.538 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 31.9 t -67.45 -57.22 6.93 Favored 'General case' 0 N--CA 1.451 -0.382 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.926 -176.804 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -75.12 -30.58 23.38 Favored 'Isoleucine or valine' 0 CA--C 1.523 -0.075 0 N-CA-C 110.465 -0.198 . . . . 0.0 110.465 -177.469 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -68.49 -54.3 16.64 Favored Glycine 0 C--N 1.336 0.545 0 N-CA-C 111.582 -0.607 . . . . 0.0 111.582 -175.774 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 44.3 mtm105 -69.75 -37.34 76.4 Favored 'General case' 0 N--CA 1.452 -0.327 0 C-N-CA 120.273 -0.571 . . . . 0.0 109.737 179.294 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -60.29 -37.02 79.22 Favored 'General case' 0 N--CA 1.45 -0.456 0 C-N-CA 120.299 -0.56 . . . . 0.0 110.323 179.486 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 2.1 m-30 -68.05 -54.08 20.94 Favored 'General case' 0 N--CA 1.451 -0.378 0 CA-C-N 118.075 0.398 . . . . 0.0 111.045 178.765 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 1.5 tt -67.84 -42.27 81.66 Favored 'General case' 0 N--CA 1.448 -0.531 0 C-N-CA 118.813 -1.155 . . . . 0.0 109.003 -174.837 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 79.6 m-20 -61.72 -49.45 76.4 Favored 'General case' 0 CA--C 1.531 0.235 0 N-CA-C 112.946 0.721 . . . . 0.0 112.946 179.07 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 65.5 mm-40 -66.32 -42.96 87.5 Favored 'General case' 0 C--N 1.34 0.158 0 CA-C-N 119.452 1.024 . . . . 0.0 111.688 -178.279 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 42.6 p -65.03 -35.34 80.87 Favored 'General case' 0 N--CA 1.45 -0.432 0 N-CA-C 109.737 -0.468 . . . . 0.0 109.737 178.15 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 33.1 ttp180 -69.16 -43.22 74.71 Favored 'General case' 0 N--CA 1.45 -0.432 0 C-N-CA 123.613 0.765 . . . . 0.0 111.792 179.259 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 42.0 t -83.59 -35.66 24.52 Favored 'General case' 0 N--CA 1.454 -0.254 0 N-CA-C 113.568 0.951 . . . . 0.0 113.568 -176.56 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 50.7 m-20 -131.18 -8.65 3.81 Favored 'General case' 0 C--N 1.34 0.165 0 N-CA-C 115.471 1.656 . . . . 0.0 115.471 -166.967 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 92.0 p -161.26 77.95 0.57 Allowed 'General case' 0 N--CA 1.461 0.11 0 CA-C-N 119.844 1.202 . . . . 0.0 111.621 179.11 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 4.5 m120 -65.14 137.57 57.73 Favored 'General case' 0 CA--C 1.529 0.156 0 N-CA-C 109.258 -0.645 . . . . 0.0 109.258 177.642 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 86' ' ' SER . . . . . 0.444 ' C ' ' H ' ' A' ' 88' ' ' SER . 76.6 p -83.24 -17.07 43.97 Favored 'General case' 0 CA--C 1.528 0.124 0 O-C-N 122.294 -0.254 . . . . 0.0 111.447 -179.423 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 37.5 p 58.65 -5.42 0.06 Allowed 'General case' 0 N--CA 1.463 0.216 0 C-N-CA 125.787 1.635 . . . . 0.0 113.73 -177.001 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 88' ' ' SER . . . . . 0.444 ' H ' ' C ' ' A' ' 86' ' ' SER . 46.6 t -162.89 162.4 26.3 Favored 'General case' 0 N--CA 1.454 -0.258 0 C-N-CA 122.963 0.505 . . . . 0.0 110.119 179.841 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 1.1 t30 -82.97 114.22 21.09 Favored 'General case' 0 N--CA 1.454 -0.229 0 N-CA-C 109.468 -0.567 . . . . 0.0 109.468 175.424 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 46.8 mmtm -149.62 142.11 15.57 Favored Pre-proline 0 N--CA 1.456 -0.128 0 N-CA-C 108.628 -0.879 . . . . 0.0 108.628 177.866 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 70.5 Cg_exo -52.8 144.77 42.47 Favored 'Trans proline' 0 N--CA 1.45 -1.075 0 C-N-CA 122.639 2.226 . . . . 0.0 109.727 173.815 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 92.69 20.27 34.86 Favored Glycine 0 CA--C 1.528 0.851 0 CA-C-O 119.21 -0.772 . . . . 0.0 112.487 -178.246 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 60.6 p -151.67 167.61 27.61 Favored 'General case' 0 CA--C 1.522 -0.119 0 CA-C-N 118.11 0.955 . . . . 0.0 110.26 176.118 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 94' ' ' CYS . . . . . 0.443 ' HB2' HD11 ' A' ' 98' ' ' ILE . 17.2 p -59.51 -24.69 63.85 Favored 'General case' 0 N--CA 1.449 -0.512 0 CA-C-N 115.623 -0.717 . . . . 0.0 109.779 175.794 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -63.4 -57.65 9.61 Favored 'General case' 0 N--CA 1.446 -0.656 0 N-CA-C 109.376 -0.601 . . . . 0.0 109.376 -173.59 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 66.5 t60 -74.78 -29.28 61.06 Favored 'General case' 0 N--CA 1.449 -0.524 0 CA-C-N 116.553 -0.294 . . . . 0.0 110.631 -179.464 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -67.41 -54.52 19.7 Favored 'General case' 0 N--CA 1.452 -0.336 0 N-CA-C 111.643 0.238 . . . . 0.0 111.643 -179.125 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 98' ' ' ILE . . . . . 0.443 HD11 ' HB2' ' A' ' 94' ' ' CYS . 2.5 mp -70.0 -31.51 48.05 Favored 'Isoleucine or valine' 0 C--N 1.341 0.202 0 C-N-CA 120.817 -0.353 . . . . 0.0 110.504 -179.577 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 77.0 m-20 -68.65 -38.25 80.32 Favored 'General case' 0 N--CA 1.452 -0.37 0 CA-C-N 118.458 0.572 . . . . 0.0 111.379 176.544 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 58.2 m -73.14 -36.93 66.77 Favored 'General case' 0 N--CA 1.454 -0.228 0 CA-C-N 117.996 0.362 . . . . 0.0 110.378 179.874 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 60.0 tp -74.86 -31.92 61.75 Favored 'General case' 0 N--CA 1.452 -0.372 0 C-N-CA 121.394 -0.122 . . . . 0.0 111.089 179.137 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -62.91 -20.86 62.76 Favored Glycine 0 CA--C 1.525 0.71 0 CA-C-O 119.614 -0.548 . . . . 0.0 112.465 -176.047 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 6.1 mm-40 -85.92 -32.77 21.43 Favored 'General case' 0 N--CA 1.456 -0.164 0 CA-C-N 118.213 1.006 . . . . 0.0 111.428 177.711 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 43.9 t -96.06 -19.35 6.25 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.221 0 N-CA-C 112.701 0.63 . . . . 0.0 112.701 -175.415 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 105' ' ' ILE . . . . . . . . . . . . . 10.5 tp -57.59 -24.95 23.42 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.229 0 CA-C-N 118.604 0.638 . . . . 0.0 111.8 -177.025 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 27.5 pt20 -68.17 -25.3 65.18 Favored 'General case' 0 N--CA 1.452 -0.368 0 O-C-N 122.1 -0.375 . . . . 0.0 110.325 178.506 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 65.0 mm-40 -75.58 -39.95 57.31 Favored 'General case' 0 N--CA 1.456 -0.13 0 CA-C-N 118.271 0.487 . . . . 0.0 109.913 176.471 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 8.3 mp -70.56 -41.16 72.81 Favored 'General case' 0 N--CA 1.451 -0.376 0 N-CA-C 109.769 -0.456 . . . . 0.0 109.769 -178.583 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 89.1 mt -67.69 -61.45 1.88 Allowed 'General case' 0 N--CA 1.452 -0.337 0 CA-C-O 119.351 -0.357 . . . . 0.0 110.246 178.451 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 19.5 p -44.36 -51.24 8.69 Favored 'General case' 0 CA--C 1.52 -0.205 0 C-N-CA 122.993 0.517 . . . . 0.0 112.238 -178.076 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 62.3 t0 -63.69 -42.01 98.05 Favored 'General case' 0 N--CA 1.448 -0.539 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.438 -178.047 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -72.42 -35.75 68.44 Favored 'General case' 0 N--CA 1.447 -0.593 0 C-N-CA 120.762 -0.375 . . . . 0.0 111.268 -178.028 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 113' ' ' ILE . . . . . . . . . . . . . 34.9 mm -68.42 -38.27 79.06 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.185 0 CA-C-N 119.185 0.902 . . . . 0.0 109.569 -177.533 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -75.0 -45.46 41.79 Favored 'General case' 0 N--CA 1.451 -0.396 0 CA-C-N 117.471 0.123 . . . . 0.0 111.242 179.765 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 115' ' ' LYS . . . . . 0.599 ' HE2' ' HA ' ' A' ' 115' ' ' LYS . 0.2 OUTLIER -82.07 -31.16 30.94 Favored 'General case' 0 N--CA 1.455 -0.209 0 N-CA-C 113.869 1.063 . . . . 0.0 113.869 -173.111 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 116' ' ' SER . . . . . 0.466 ' HB2' ' CB ' ' A' ' 120' ' ' HIS . 45.5 p -76.39 156.12 33.48 Favored 'General case' 0 CA--C 1.528 0.13 0 N-CA-C 112.261 0.467 . . . . 0.0 112.261 -172.984 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 53.6 t30 -73.02 165.67 24.57 Favored 'General case' 0 N--CA 1.453 -0.277 0 C-N-CA 123.383 0.673 . . . . 0.0 110.708 -178.863 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 118' ' ' GLN . . . . . . . . . . . . . 20.5 mm100 -53.68 -38.1 63.86 Favored 'General case' 0 CA--C 1.531 0.226 0 N-CA-C 112.908 0.707 . . . . 0.0 112.908 -172.765 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 7.5 p-10 -71.65 -38.42 70.71 Favored 'General case' 0 N--CA 1.454 -0.272 0 N-CA-C 109.899 -0.408 . . . . 0.0 109.899 179.227 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 120' ' ' HIS . . . . . 0.466 ' CB ' ' HB2' ' A' ' 116' ' ' SER . 34.3 m170 -65.3 -40.78 94.26 Favored 'General case' 0 N--CA 1.451 -0.406 0 C-N-CA 122.681 0.392 . . . . 0.0 110.044 176.457 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 56.7 mttm -58.55 -42.94 89.02 Favored 'General case' 0 C--N 1.341 0.231 0 N-CA-C 108.895 -0.779 . . . . 0.0 108.895 178.225 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 43.8 tp10 -73.73 -36.5 65.18 Favored 'General case' 0 N--CA 1.451 -0.417 0 CA-C-N 116.661 -0.245 . . . . 0.0 111.468 -176.863 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 13.0 tppt? -62.41 -36.04 81.1 Favored 'General case' 0 N--CA 1.45 -0.431 0 N-CA-C 109.333 -0.617 . . . . 0.0 109.333 177.828 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 124' ' ' ILE . . . . . . . . . . . . . 61.2 mt -69.37 -36.26 71.14 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.261 0 O-C-N 121.957 -0.464 . . . . 0.0 109.892 177.51 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 13.7 mtp-105 -68.05 -35.34 78.07 Favored 'General case' 0 N--CA 1.457 -0.099 0 CA-C-O 119.468 -0.301 . . . . 0.0 111.511 -178.472 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 126' ' ' MET . . . . . . . . . . . . . 27.2 ptm -72.92 -28.01 62.2 Favored 'General case' 0 N--CA 1.455 -0.177 0 C-N-CA 119.488 -0.885 . . . . 0.0 109.452 174.666 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 4.2 mp -65.77 -31.62 72.69 Favored 'General case' 0 CA--C 1.529 0.163 0 CA-C-N 118.084 0.402 . . . . 0.0 110.134 172.999 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 95.6 mt -70.12 -38.72 75.66 Favored 'General case' 0 C--N 1.34 0.19 0 CA-C-N 118.755 0.707 . . . . 0.0 109.868 176.237 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 10.7 t70 -60.37 -44.02 96.01 Favored 'General case' 0 N--CA 1.454 -0.231 0 N-CA-C 109.182 -0.673 . . . . 0.0 109.182 175.561 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 130' ' ' ILE . . . . . 0.411 ' HA ' ' HD3' ' A' ' 133' ' ' ARG . 73.9 mt -61.87 -39.07 82.18 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.417 0 CA-C-N 116.418 -0.355 . . . . 0.0 110.632 -179.532 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 131' ' ' TRP . . . . . . . . . . . . . 48.1 m0 -75.39 -32.64 60.86 Favored 'General case' 0 N--CA 1.45 -0.43 0 N-CA-C 112.355 0.502 . . . . 0.0 112.355 -179.045 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 62.9 m-20 -70.53 -27.56 64.26 Favored 'General case' 0 C--O 1.228 -0.067 0 CA-C-N 118.504 0.593 . . . . 0.0 110.881 177.535 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 133' ' ' ARG . . . . . 0.45 HH21 ' C ' ' B' 2063 ' ' SER . 23.6 mtp180 -73.28 -42.95 61.85 Favored 'General case' 0 CA--C 1.521 -0.163 0 N-CA-C 109.741 -0.466 . . . . 0.0 109.741 177.019 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 46.4 t -77.08 -19.1 57.5 Favored 'General case' 0 CA--C 1.536 0.421 0 C-N-CA 122.185 0.194 . . . . 0.0 111.289 178.898 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 135' ' ' GLY . . . . . . . . . . . . . . . 91.09 14.13 58.01 Favored Glycine 0 CA--C 1.528 0.904 0 CA-C-O 119.346 -0.697 . . . . 0.0 114.356 174.444 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 136' ' ' LEU . . . . . . . . . . . . . 7.8 mp -73.08 154.65 40.32 Favored 'General case' 0 CA--C 1.529 0.154 0 CA-C-N 118.591 1.196 . . . . 0.0 109.881 178.667 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 137' ' ' PHE . . . . . . . . . . . . . 16.2 m-85 -77.68 148.38 35.01 Favored 'General case' 0 N--CA 1.455 -0.207 0 N-CA-C 109.77 -0.455 . . . . 0.0 109.77 176.648 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 138' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -150.9 -3.39 0.33 Allowed 'General case' 0 CA--C 1.532 0.271 0 N-CA-C 114.382 1.253 . . . . 0.0 114.382 -178.322 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 139' ' ' LYS . . . . . 0.471 ' C ' ' H ' ' A' ' 141' ' ' TYR . 53.7 mttp 49.95 28.7 3.0 Favored 'General case' 0 CA--C 1.536 0.407 0 CA-C-N 118.955 0.798 . . . . 0.0 111.746 -175.776 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 140' ' ' SER . . . . . . . . . . . . . 34.0 t -68.75 26.41 0.03 OUTLIER 'General case' 0 CA--C 1.532 0.281 0 C-N-CA 124.58 1.152 . . . . 0.0 113.139 -176.06 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 141' ' ' TYR . . . . . 0.471 ' H ' ' C ' ' A' ' 139' ' ' LYS . 43.7 p90 -137.24 2.18 2.5 Favored 'General case' 0 N--CA 1.452 -0.34 0 C-N-CA 123.562 0.745 . . . . 0.0 111.001 178.837 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 142' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -80.65 147.83 30.49 Favored 'General case' 0 N--CA 1.455 -0.192 0 N-CA-C 109.379 -0.6 . . . . 0.0 109.379 175.957 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 4.4 m120 -63.34 -15.06 56.24 Favored 'General case' 0 CA--C 1.53 0.194 0 C-N-CA 122.713 0.405 . . . . 0.0 111.805 -178.692 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . -72.15 -32.5 66.94 Favored 'General case' 0 N--CA 1.45 -0.432 0 C-N-CA 122.185 0.194 . . . . 0.0 110.586 178.356 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 145' ' ' ILE . . . . . . . . . . . . . 38.5 mm -70.54 -35.11 60.12 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.209 0 N-CA-C 110.069 -0.345 . . . . 0.0 110.069 -178.114 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 146' ' ' ARG . . . . . . . . . . . . . 9.2 tpp180 -73.61 -31.9 63.8 Favored 'General case' 0 N--CA 1.454 -0.233 0 N-CA-C 108.905 -0.776 . . . . 0.0 108.905 176.495 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 147' ' ' SER . . . . . . . . . . . . . 42.9 t 46.45 52.65 10.59 Favored 'General case' 0 N--CA 1.456 -0.143 0 CA-C-O 120.941 0.401 . . . . 0.0 110.433 178.275 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 148' ' ' LYS . . . . . 0.424 ' H ' ' HD3' ' A' ' 148' ' ' LYS . 0.0 OUTLIER -49.22 -18.85 0.39 Allowed 'General case' 0 N--CA 1.453 -0.32 0 C-N-CA 125.004 1.322 . . . . 0.0 113.608 -175.527 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 149' ' ' CYS . . . . . . . . . . . . . 60.1 m -62.73 -34.53 77.38 Favored 'General case' 0 N--CA 1.452 -0.368 0 CA-C-N 118.575 0.625 . . . . 0.0 110.226 178.231 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 150' ' ' PHE . . . . . . . . . . . . . 70.2 t80 -69.83 -28.3 65.58 Favored 'General case' 0 N--CA 1.452 -0.339 0 N-CA-C 110.212 -0.292 . . . . 0.0 110.212 179.495 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 151' ' ' ALA . . . . . . . . . . . . . . . -76.44 -27.52 56.23 Favored 'General case' 0 N--CA 1.452 -0.337 0 C-N-CA 122.16 0.184 . . . . 0.0 110.573 177.073 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 152' ' ' MET . . . . . . . . . . . . . 96.4 mmm -75.84 -27.11 57.71 Favored 'General case' 0 N--CA 1.455 -0.202 0 N-CA-C 110.435 -0.209 . . . . 0.0 110.435 175.143 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 153' ' ' ASP . . . . . . . . . . . . . 67.0 m-20 -73.55 -42.98 60.95 Favored 'General case' 0 N--CA 1.454 -0.265 0 N-CA-C 110.305 -0.258 . . . . 0.0 110.305 175.144 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 154' ' ' LEU . . . . . . . . . . . . . 49.2 mt -143.11 121.17 12.11 Favored 'General case' 0 CA--C 1.53 0.176 0 C-N-CA 123.174 0.59 . . . . 0.0 109.962 177.772 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 155' ' ' GLU . . . . . . . . . . . . . 92.0 mt-10 -73.76 0.76 12.09 Favored 'General case' 0 CA--C 1.53 0.195 0 C-N-CA 122.405 0.282 . . . . 0.0 111.071 178.055 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 156' ' ' HIS . . . . . . . . . . . . . 33.2 m170 -76.41 13.41 0.96 Allowed 'General case' 0 N--CA 1.456 -0.16 0 C-N-CA 124.092 0.957 . . . . 0.0 112.678 -175.57 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 157' ' ' HIS . . . . . . . . . . . . . 76.6 m-70 -137.63 147.91 45.35 Favored 'General case' 0 N--CA 1.454 -0.256 0 CA-C-N 118.214 0.461 . . . . 0.0 111.849 -174.733 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 158' ' ' HIS . . . . . . . . . . . . . 20.8 p80 -156.04 5.19 0.19 Allowed 'General case' 0 C--O 1.227 -0.099 0 C-N-CA 123.87 0.868 . . . . 0.0 110.384 178.042 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 159' ' ' HIS . . . . . . . . . . . . . 13.6 m80 . . . . . 0 C--O 1.248 0.993 0 CA-C-O 117.282 -1.342 . . . . 0.0 111.21 -174.44 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' B' B 2052 ' ' ASP . . . . . . . . . . . . . 3.0 m-20 . . . . . 0 N--CA 1.467 0.399 0 N-CA-C 110.407 -0.22 . . . . 0.0 110.407 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' B' B 2053 ' ' ASP . . . . . . . . . . . . . 19.4 m-20 -68.78 175.55 3.53 Favored 'General case' 0 CA--C 1.53 0.176 0 C-N-CA 123.16 0.584 . . . . 0.0 112.518 -178.045 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B 2054 ' ' ASP . . . . . . . . . . . . . 42.4 p30 -136.32 23.2 3.22 Favored 'General case' 0 CA--C 1.533 0.297 0 C-N-CA 123.79 0.836 . . . . 0.0 112.882 -170.036 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B 2055 ' ' GLU . . . . . . . . . . . . . 65.0 tt0 -149.17 48.0 0.98 Allowed 'General case' 0 CA--C 1.528 0.123 0 O-C-N 121.742 -0.599 . . . . 0.0 110.617 -177.088 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B 2056 ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -67.78 13.16 0.08 Allowed 'General case' 0 CA--C 1.535 0.372 0 N-CA-C 114.304 1.224 . . . . 0.0 114.304 -176.004 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B 2057 ' ' ASP . . . . . . . . . . . . . 47.4 t0 -157.11 74.18 0.77 Allowed 'General case' 0 N--CA 1.453 -0.316 0 CA-C-N 118.469 0.577 . . . . 0.0 110.289 172.897 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B 2058 ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -59.14 131.52 51.28 Favored 'General case' 0 C--N 1.341 0.231 0 N-CA-C 108.994 -0.743 . . . . 0.0 108.994 175.832 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B 2059 ' ' THR . . . . . . . . . . . . . 49.2 m -83.37 115.76 60.93 Favored Pre-proline 0 N--CA 1.454 -0.27 0 N-CA-C 108.94 -0.763 . . . . 0.0 108.94 179.07 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B 2060 ' ' PRO . . . . . . . . . . . . . 98.7 Cg_endo -74.22 122.18 7.38 Favored 'Trans proline' 0 N--CA 1.447 -1.23 0 C-N-CA 122.819 2.346 . . . . 0.0 110.832 -178.934 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B 2061 ' ' SER . . . . . . . . . . . . . 76.6 p -79.46 126.55 31.0 Favored 'General case' 0 N--CA 1.451 -0.393 0 N-CA-C 108.158 -1.053 . . . . 0.0 108.158 173.207 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B 2062 ' ' ILE . . . . . . . . . . . . . 4.6 tp -151.86 133.05 4.78 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.382 0 N-CA-C 112.308 0.484 . . . . 0.0 112.308 -175.963 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B 2063 ' ' SER . . . . . 0.45 ' C ' HH21 ' A' ' 133' ' ' ARG . 35.1 m . . . . . 0 C--O 1.252 1.205 0 CA-C-O 117.628 -1.177 . . . . 0.0 109.548 175.418 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 2.9 mpp? . . . . . 0 N--CA 1.475 0.806 0 CA-C-O 119.983 -0.056 . . . . 0.0 111.1 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 5.1 pm0 -150.35 -19.09 0.24 Allowed 'General case' 0 CA--C 1.532 0.265 0 N-CA-C 111.972 0.36 . . . . 0.0 111.972 -179.82 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 18.8 pt20 -157.69 20.31 0.27 Allowed 'General case' 0 CA--C 1.529 0.139 0 N-CA-C 107.496 -1.298 . . . . 0.0 107.496 173.455 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 11.0 p30 -158.32 -179.97 8.6 Favored 'General case' 0 N--CA 1.445 -0.724 0 C-N-CA 125.892 1.677 . . . . 0.0 108.312 -168.502 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 8.4 m-20 56.94 20.13 5.1 Favored 'General case' 0 N--CA 1.456 -0.146 0 C-N-CA 123.604 0.762 . . . . 0.0 112.848 179.5 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 26.8 p-10 -73.44 -28.85 62.19 Favored 'General case' 0 N--CA 1.454 -0.27 0 C-N-CA 123.13 0.572 . . . . 0.0 110.017 -178.764 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 7' ' ' PHE . . . . . 0.435 ' HA ' ' HZ1' ' A' ' 45' ' ' LYS . 1.6 t80 -53.83 -37.54 63.7 Favored 'General case' 0 N--CA 1.45 -0.461 0 CA-C-N 115.965 -0.561 . . . . 0.0 109.983 178.966 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 53.3 tp60 -56.58 -32.17 64.95 Favored 'General case' 0 N--CA 1.452 -0.369 0 C-N-CA 123.166 0.586 . . . . 0.0 111.813 -177.017 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 13.7 t-20 -71.45 -34.45 70.25 Favored 'General case' 0 N--CA 1.452 -0.346 0 N-CA-C 109.832 -0.433 . . . . 0.0 109.832 177.964 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 10' ' ' PHE . . . . . 0.465 ' CE2' ' HB2' ' A' ' 32' ' ' LEU . 6.7 t80 -68.97 -38.85 79.61 Favored 'General case' 0 N--CA 1.45 -0.43 0 C-N-CA 123.176 0.591 . . . . 0.0 109.5 176.014 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 87.4 t -64.48 -55.14 23.05 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.316 0 N-CA-C 109.092 -0.707 . . . . 0.0 109.092 178.279 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -59.7 -28.45 67.33 Favored 'General case' 0 N--CA 1.452 -0.334 0 C-N-CA 122.973 0.509 . . . . 0.0 112.1 -178.932 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 90.7 m -74.57 -39.94 61.94 Favored 'General case' 0 N--CA 1.456 -0.174 0 N-CA-C 109.222 -0.659 . . . . 0.0 109.222 176.99 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . 0.454 ' HA ' ' CD1' ' A' ' 17' ' ' PHE . 13.0 tp -65.77 -44.48 85.71 Favored 'General case' 0 N--CA 1.452 -0.367 0 N-CA-C 109.3 -0.63 . . . . 0.0 109.3 179.366 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 67.7 mm-40 -62.48 -29.65 70.69 Favored 'General case' 0 N--CA 1.45 -0.458 0 C-N-CA 124.304 1.042 . . . . 0.0 109.446 177.591 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 40.8 t -69.13 -28.44 66.45 Favored 'General case' 0 N--CA 1.451 -0.392 0 CA-C-O 119.052 -0.499 . . . . 0.0 110.147 177.52 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 17' ' ' PHE . . . . . 0.454 ' CD1' ' HA ' ' A' ' 14' ' ' LEU . 29.2 m-85 -71.98 -36.67 69.86 Favored 'General case' 0 C--N 1.339 0.115 0 CA-C-N 118.693 0.679 . . . . 0.0 110.824 171.979 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 80.6 mttt -63.25 -24.21 67.77 Favored 'General case' 0 C--N 1.339 0.144 0 N-CA-C 110.169 -0.308 . . . . 0.0 110.169 177.429 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 30.1 t0 -76.59 -16.76 59.5 Favored 'General case' 0 CA--C 1.538 0.505 0 N-CA-C 112.466 0.543 . . . . 0.0 112.466 176.697 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . 0.418 ' C ' ' HE3' ' A' ' 21' ' ' LYS . 10.1 mt -85.44 161.08 19.56 Favored 'General case' 0 N--CA 1.457 -0.107 0 CA-C-N 118.728 0.694 . . . . 0.0 111.983 -174.043 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . 0.53 ' HE3' ' N ' ' A' ' 21' ' ' LYS . 0.8 OUTLIER -82.64 -36.59 25.9 Favored 'General case' 0 N--CA 1.454 -0.229 0 N-CA-C 108.803 -0.814 . . . . 0.0 108.803 176.797 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 35.9 t -90.16 -24.77 20.96 Favored 'General case' 0 C--N 1.341 0.231 0 C-N-CA 124.034 0.934 . . . . 0.0 111.648 -179.791 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 77.7 -10.52 24.14 Favored Glycine 0 CA--C 1.532 1.146 0 CA-C-O 119.675 -0.514 . . . . 0.0 111.896 -177.372 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 70.0 mt -96.05 148.93 4.93 Favored 'Isoleucine or valine' 0 C--N 1.34 0.188 0 CA-C-N 117.507 0.654 . . . . 0.0 111.155 178.447 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 19.1 t -167.68 100.82 0.48 Allowed 'General case' 0 CA--C 1.518 -0.252 0 N-CA-C 108.777 -0.823 . . . . 0.0 108.777 176.177 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -54.67 -45.62 77.68 Favored Glycine 0 CA--C 1.527 0.8 0 C-N-CA 120.861 -0.685 . . . . 0.0 112.025 -175.106 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 8.9 m -64.51 -42.72 95.64 Favored 'General case' 0 N--CA 1.456 -0.135 0 CA-C-N 118.232 1.016 . . . . 0.0 111.349 -177.327 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 28.7 mtt180 -74.63 -39.12 62.32 Favored 'General case' 0 N--CA 1.453 -0.281 0 CA-C-N 118.231 0.468 . . . . 0.0 110.083 -177.821 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 69.8 mt -58.95 -45.23 92.12 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.607 0 N-CA-C 109.045 -0.724 . . . . 0.0 109.045 174.516 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 50.4 mtmt -69.18 -25.04 64.14 Favored 'General case' 0 C--O 1.231 0.092 0 CA-C-O 119.069 -0.491 . . . . 0.0 111.403 -179.994 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . 0.444 ' HA ' ' CE ' ' A' ' 31' ' ' LYS . 3.1 mmpt? -66.22 -55.95 13.71 Favored 'General case' 0 N--CA 1.455 -0.203 0 CA-C-N 118.662 0.665 . . . . 0.0 110.14 177.856 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . 0.465 ' HB2' ' CE2' ' A' ' 10' ' ' PHE . 1.6 pp -75.43 -17.64 60.11 Favored 'General case' 0 CA--C 1.53 0.207 0 C-N-CA 119.165 -1.014 . . . . 0.0 111.554 -179.613 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 29.8 m -73.03 -41.6 64.06 Favored 'General case' 0 C--N 1.341 0.201 0 N-CA-C 108.926 -0.768 . . . . 0.0 108.926 176.378 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 97.0 m -69.59 -37.92 77.12 Favored 'General case' 0 N--CA 1.449 -0.499 0 N-CA-C 110.414 -0.217 . . . . 0.0 110.414 -178.36 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 14.8 t80 -62.92 -40.12 96.64 Favored 'General case' 0 N--CA 1.455 -0.216 0 N-CA-C 110.103 -0.332 . . . . 0.0 110.103 175.576 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -70.92 -31.95 68.72 Favored 'General case' 0 N--CA 1.45 -0.455 0 C-N-CA 122.337 0.255 . . . . 0.0 111.148 179.954 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 20.1 mt -71.34 -40.08 70.94 Favored 'General case' 0 N--CA 1.453 -0.296 0 C-N-CA 122.618 0.367 . . . . 0.0 110.733 179.844 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 42.6 t0 -65.55 -23.41 66.86 Favored 'General case' 0 N--CA 1.453 -0.285 0 CA-C-N 116.463 -0.335 . . . . 0.0 110.847 177.037 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 98.1 m-70 -149.27 98.39 2.8 Favored 'General case' 0 N--CA 1.452 -0.336 0 CA-C-O 121.071 0.462 . . . . 0.0 111.651 -175.96 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 40' ' ' ILE . . . . . 0.583 ' H ' HD11 ' A' ' 40' ' ' ILE . 0.0 OUTLIER -76.59 -10.54 13.35 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.368 0 C-N-CA 122.847 0.459 . . . . 0.0 110.357 175.385 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 8.0 m-20 -57.42 -23.99 52.83 Favored 'General case' 0 N--CA 1.455 -0.18 0 C-N-CA 123.0 0.52 . . . . 0.0 111.66 -178.322 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . 0.484 ' HB ' ' HE2' ' A' ' 45' ' ' LYS . 0.0 OUTLIER -101.92 15.77 5.07 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.244 0 C-N-CA 122.877 0.471 . . . . 0.0 112.163 177.999 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 3.0 pp20? -52.43 -29.64 25.42 Favored 'General case' 0 CA--C 1.531 0.247 0 CA-C-N 119.067 0.849 . . . . 0.0 110.812 179.262 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 39.5 t -62.0 -52.61 63.31 Favored 'General case' 0 C--O 1.234 0.28 0 N-CA-C 112.028 0.381 . . . . 0.0 112.028 -178.706 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . 0.484 ' HE2' ' HB ' ' A' ' 42' ' ' ILE . 17.7 pttt -68.43 -25.89 65.25 Favored 'General case' 0 C--N 1.34 0.184 0 CA-C-N 118.245 0.475 . . . . 0.0 109.924 179.897 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 46' ' ' ILE . . . . . 0.4 HG12 ' CZ ' ' A' ' 10' ' ' PHE . 87.0 mt -73.28 -45.8 51.89 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.493 0 C-N-CA 122.649 0.38 . . . . 0.0 110.425 -176.656 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 34.2 mm -64.89 -34.7 72.17 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.215 0 N-CA-C 109.584 -0.525 . . . . 0.0 109.584 177.84 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 23.3 t -63.78 -46.84 83.42 Favored 'General case' 0 C--O 1.227 -0.09 0 C-N-CA 119.968 -0.693 . . . . 0.0 110.367 177.708 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 6.6 mp -66.65 -30.65 70.96 Favored 'General case' 0 N--CA 1.454 -0.273 0 CA-C-O 118.635 -0.698 . . . . 0.0 112.317 -175.135 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 20.3 pt -71.93 -42.76 68.88 Favored 'Isoleucine or valine' 0 C--N 1.34 0.192 0 CA-C-N 119.64 1.109 . . . . 0.0 110.126 176.982 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 38.0 pt -68.94 -42.33 82.27 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.239 0 C-N-CA 119.459 -0.896 . . . . 0.0 110.487 179.395 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 74.3 m-20 -62.54 -37.68 87.07 Favored 'General case' 0 N--CA 1.455 -0.201 0 CA-C-N 117.779 0.263 . . . . 0.0 110.806 179.767 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 26.8 t80 -72.79 -29.75 63.53 Favored 'General case' 0 CA--C 1.528 0.118 0 N-CA-C 110.29 -0.263 . . . . 0.0 110.29 177.211 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 37.7 m -75.28 -21.94 58.15 Favored 'General case' 0 N--CA 1.455 -0.221 0 N-CA-C 111.952 0.353 . . . . 0.0 111.952 179.532 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 22.6 mmm180 -93.95 -53.23 4.07 Favored 'General case' 0 N--CA 1.453 -0.284 0 N-CA-C 112.686 0.624 . . . . 0.0 112.686 -179.569 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 46.6 mt -74.18 -46.11 44.18 Favored 'General case' 0 C--N 1.334 -0.099 0 N-CA-C 112.507 0.558 . . . . 0.0 112.507 -170.188 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 57' ' ' CYS . . . . . 0.446 ' HB3' ' HD2' ' A' ' 58' ' ' PRO . 74.4 m -74.08 158.28 85.87 Favored Pre-proline 0 CA--C 1.535 0.382 0 C-N-CA 122.539 0.336 . . . . 0.0 111.598 -176.209 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 58' ' ' PRO . . . . . 0.446 ' HD2' ' HB3' ' A' ' 57' ' ' CYS . 91.8 Cg_endo -76.89 175.09 11.82 Favored 'Trans proline' 0 N--CA 1.453 -0.894 0 C-N-CA 125.127 3.885 . . . . 0.0 112.009 -169.46 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 35.3 p-10 -46.95 -46.33 21.41 Favored 'General case' 0 CA--C 1.528 0.115 0 C-N-CA 125.182 1.393 . . . . 0.0 113.677 -171.728 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 36.3 m -67.36 -36.3 81.1 Favored 'General case' 0 N--CA 1.453 -0.298 0 N-CA-C 109.992 -0.373 . . . . 0.0 109.992 -177.17 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 61' ' ' HIS . . . . . 0.418 ' ND1' ' HD2' ' A' ' 58' ' ' PRO . 53.6 m170 -75.41 -23.9 57.06 Favored 'General case' 0 N--CA 1.452 -0.366 0 N-CA-C 110.023 -0.362 . . . . 0.0 110.023 178.261 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 57.2 mttm -68.55 -34.42 75.8 Favored 'General case' 0 CA--C 1.528 0.107 0 N-CA-C 109.405 -0.591 . . . . 0.0 109.405 172.978 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -64.64 -44.47 90.37 Favored 'General case' 0 CA--C 1.532 0.261 0 N-CA-C 108.029 -1.1 . . . . 0.0 108.029 174.579 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -66.6 -28.45 73.75 Favored Glycine 0 C--N 1.336 0.576 0 N-CA-C 111.538 -0.625 . . . . 0.0 111.538 -179.749 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 38.7 t -69.88 -44.16 70.34 Favored 'General case' 0 N--CA 1.451 -0.401 0 CA-C-N 117.387 0.594 . . . . 0.0 110.08 177.371 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 60.6 mt -65.7 -25.04 67.14 Favored 'General case' 0 N--CA 1.453 -0.307 0 N-CA-C 109.581 -0.526 . . . . 0.0 109.581 178.781 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 1.2 m-85 -72.24 -37.67 69.08 Favored 'General case' 0 N--CA 1.454 -0.235 0 C-N-CA 122.617 0.367 . . . . 0.0 110.811 174.585 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 68' ' ' ILE . . . . . 0.431 HD12 ' CD1' ' A' ' 17' ' ' PHE . 20.2 mt -69.72 -46.76 73.84 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.317 0 N-CA-C 109.137 -0.69 . . . . 0.0 109.137 176.226 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 93.7 mt -57.6 -34.14 46.51 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.258 0 C-N-CA 123.556 0.742 . . . . 0.0 110.784 176.86 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 18.7 t70 -68.73 -43.68 75.42 Favored 'General case' 0 N--CA 1.451 -0.393 0 CA-C-N 118.123 0.419 . . . . 0.0 110.757 178.165 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 30.3 t -69.31 -56.55 7.2 Favored 'General case' 0 N--CA 1.452 -0.352 0 CA-C-N 116.401 -0.363 . . . . 0.0 110.65 -177.304 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -74.97 -31.34 25.09 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.253 0 N-CA-C 110.177 -0.305 . . . . 0.0 110.177 -176.623 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -66.42 -55.61 17.33 Favored Glycine 0 C--N 1.336 0.561 0 N-CA-C 111.214 -0.754 . . . . 0.0 111.214 -176.523 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 37.6 mtm105 -66.41 -40.84 89.82 Favored 'General case' 0 N--CA 1.452 -0.349 0 C-N-CA 120.489 -0.485 . . . . 0.0 109.934 -179.358 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -64.48 -30.29 71.32 Favored 'General case' 0 N--CA 1.45 -0.426 0 C-N-CA 120.058 -0.657 . . . . 0.0 110.998 -177.893 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 1.3 m-30 -69.66 -46.66 65.62 Favored 'General case' 0 C--N 1.34 0.191 0 CA-C-N 118.18 0.446 . . . . 0.0 110.858 177.55 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 50.0 tp -71.82 -38.5 70.17 Favored 'General case' 0 N--CA 1.451 -0.419 0 C-N-CA 118.01 -1.476 . . . . 0.0 109.451 -179.611 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 91.1 m-20 -60.98 -47.84 84.6 Favored 'General case' 0 CA--C 1.529 0.156 0 N-CA-C 112.893 0.701 . . . . 0.0 112.893 178.548 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 21.3 mm-40 -66.84 -45.53 77.92 Favored 'General case' 0 CA--C 1.522 -0.098 0 CA-C-N 119.221 0.919 . . . . 0.0 111.342 179.877 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 60.0 p -65.34 -30.76 71.63 Favored 'General case' 0 N--CA 1.456 -0.142 0 C-N-CA 120.195 -0.602 . . . . 0.0 110.632 179.847 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 38.2 ttp-105 -72.15 -30.86 65.43 Favored 'General case' 0 N--CA 1.454 -0.226 0 CA-C-N 117.98 0.355 . . . . 0.0 111.631 175.415 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 17.2 m -92.34 -23.89 19.1 Favored 'General case' 0 N--CA 1.457 -0.102 0 N-CA-C 113.495 0.924 . . . . 0.0 113.495 -174.422 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 76.1 m-20 -137.71 20.48 2.88 Favored 'General case' 0 N--CA 1.455 -0.2 0 N-CA-C 113.354 0.872 . . . . 0.0 113.354 -172.454 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 42.3 t -150.63 153.34 35.49 Favored 'General case' 0 N--CA 1.456 -0.175 0 O-C-N 121.765 -0.585 . . . . 0.0 111.377 176.705 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 74.5 m-20 -85.8 167.52 15.13 Favored 'General case' 0 N--CA 1.453 -0.323 0 N-CA-C 109.427 -0.583 . . . . 0.0 109.427 175.282 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 41.6 t -68.25 152.58 45.25 Favored 'General case' 0 N--CA 1.454 -0.252 0 C-N-CA 122.332 0.253 . . . . 0.0 110.442 177.583 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 40.2 t -156.4 168.17 28.18 Favored 'General case' 0 N--CA 1.455 -0.197 0 C-N-CA 122.824 0.45 . . . . 0.0 110.43 -179.26 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 69.1 m -70.82 162.76 28.63 Favored 'General case' 0 N--CA 1.454 -0.273 0 C-N-CA 122.683 0.393 . . . . 0.0 110.188 179.284 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -66.3 104.8 1.27 Allowed 'General case' 0 N--CA 1.451 -0.393 0 N-CA-C 110.285 -0.265 . . . . 0.0 110.285 179.689 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 90' ' ' LYS . . . . . 0.484 ' HE3' ' HA ' ' A' ' 90' ' ' LYS . 0.0 OUTLIER -140.65 141.1 23.82 Favored Pre-proline 0 N--CA 1.454 -0.274 0 N-CA-C 108.729 -0.841 . . . . 0.0 108.729 178.091 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 57.5 Cg_exo -54.31 153.6 21.66 Favored 'Trans proline' 0 N--CA 1.452 -0.959 0 C-N-CA 123.036 2.491 . . . . 0.0 111.154 176.218 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 90.52 16.55 54.95 Favored Glycine 0 CA--C 1.523 0.571 0 CA-C-O 119.278 -0.735 . . . . 0.0 112.878 178.539 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 30.9 p -153.04 167.95 27.51 Favored 'General case' 0 CA--C 1.52 -0.202 0 CA-C-N 118.399 1.1 . . . . 0.0 110.591 177.864 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 94' ' ' CYS . . . . . . . . . . . . . 31.1 p -58.34 -24.3 59.33 Favored 'General case' 0 N--CA 1.451 -0.402 0 CA-C-N 115.478 -0.783 . . . . 0.0 110.27 175.561 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -60.9 -59.82 4.77 Favored 'General case' 0 N--CA 1.446 -0.638 0 N-CA-C 109.497 -0.557 . . . . 0.0 109.497 -175.722 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 72.4 t60 -73.56 -32.78 64.35 Favored 'General case' 0 N--CA 1.449 -0.492 0 N-CA-C 110.553 -0.166 . . . . 0.0 110.553 -178.92 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -66.08 -52.53 48.01 Favored 'General case' 0 N--CA 1.453 -0.323 0 N-CA-C 111.836 0.309 . . . . 0.0 111.836 -177.86 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 1.8 mp -71.01 -33.87 53.3 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.146 0 O-C-N 121.916 -0.49 . . . . 0.0 109.908 -178.829 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 75.8 m-20 -68.1 -43.37 78.64 Favored 'General case' 0 N--CA 1.45 -0.429 0 CA-C-N 118.242 0.474 . . . . 0.0 111.626 179.34 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 91.3 m -68.32 -37.6 80.75 Favored 'General case' 0 N--CA 1.455 -0.221 0 CA-C-N 117.886 0.312 . . . . 0.0 110.472 -177.579 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 65.2 tp -75.81 -36.73 59.63 Favored 'General case' 0 N--CA 1.451 -0.424 0 CA-C-N 116.661 -0.245 . . . . 0.0 111.283 179.906 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -65.56 -22.78 69.99 Favored Glycine 0 CA--C 1.522 0.527 0 CA-C-O 119.67 -0.517 . . . . 0.0 112.437 -175.187 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 103' ' ' GLU . . . . . 0.435 ' HA ' ' HE3' ' A' ' 139' ' ' LYS . 17.6 mm-40 -72.68 -44.89 61.21 Favored 'General case' 0 N--CA 1.452 -0.359 0 CA-C-N 118.201 1.0 . . . . 0.0 111.873 178.138 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 25.0 m -92.1 -1.6 10.27 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.171 0 O-C-N 123.928 0.767 . . . . 0.0 112.369 -174.63 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 105' ' ' ILE . . . . . . . . . . . . . 10.1 tp -66.68 -25.15 34.15 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.167 0 CA-C-N 118.384 0.538 . . . . 0.0 110.954 -176.25 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 15.2 pt20 -71.76 -34.29 69.36 Favored 'General case' 0 N--CA 1.452 -0.345 0 CA-C-O 119.181 -0.438 . . . . 0.0 109.841 -178.631 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 57.9 mp0 -73.69 -37.96 65.05 Favored 'General case' 0 C--N 1.341 0.203 0 CA-C-N 118.929 0.786 . . . . 0.0 110.38 177.001 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 94.1 mt -71.74 -41.36 68.57 Favored 'General case' 0 N--CA 1.452 -0.343 0 CA-C-O 119.186 -0.435 . . . . 0.0 111.053 -177.568 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 81.5 mt -69.66 -55.62 9.5 Favored 'General case' 0 N--CA 1.45 -0.441 0 C-N-CA 120.494 -0.483 . . . . 0.0 110.146 179.156 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 14.2 p -49.18 -51.76 30.65 Favored 'General case' 0 CA--C 1.52 -0.181 0 CA-C-N 118.243 0.474 . . . . 0.0 111.48 -177.506 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 43.2 t0 -69.0 -31.17 69.8 Favored 'General case' 0 N--CA 1.447 -0.585 0 C-N-CA 120.897 -0.321 . . . . 0.0 110.508 -177.14 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -72.52 -31.27 65.19 Favored 'General case' 0 N--CA 1.448 -0.545 0 C-N-CA 120.822 -0.351 . . . . 0.0 110.496 178.902 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 113' ' ' ILE . . . . . . . . . . . . . 36.5 mm -66.31 -36.89 78.46 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.175 0 N-CA-C 108.317 -0.994 . . . . 0.0 108.317 176.375 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -74.56 -40.08 61.9 Favored 'General case' 0 N--CA 1.454 -0.26 0 N-CA-C 112.205 0.446 . . . . 0.0 112.205 177.92 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 115' ' ' LYS . . . . . 0.546 ' HZ3' ' HB2' ' A' ' 115' ' ' LYS . 0.0 OUTLIER -77.24 -36.46 54.54 Favored 'General case' 0 C--N 1.339 0.123 0 N-CA-C 112.531 0.567 . . . . 0.0 112.531 -175.536 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 116' ' ' SER . . . . . 0.509 ' HB2' ' CB ' ' A' ' 120' ' ' HIS . 83.8 p -79.38 153.74 29.52 Favored 'General case' 0 N--CA 1.454 -0.246 0 N-CA-C 112.991 0.737 . . . . 0.0 112.991 -170.952 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 47.2 t30 -75.62 167.43 21.9 Favored 'General case' 0 C--O 1.225 -0.22 0 C-N-CA 123.772 0.829 . . . . 0.0 110.251 -178.611 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 118' ' ' GLN . . . . . . . . . . . . . 59.8 mt-30 -45.87 -55.67 6.38 Favored 'General case' 0 C--N 1.34 0.187 0 C-N-CA 123.478 0.711 . . . . 0.0 111.542 -174.438 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 3.9 p30 -63.15 -36.88 85.1 Favored 'General case' 0 C--O 1.232 0.143 0 C-N-CA 122.778 0.431 . . . . 0.0 110.95 -177.341 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 120' ' ' HIS . . . . . 0.509 ' CB ' ' HB2' ' A' ' 116' ' ' SER . 34.0 m170 -64.93 -39.04 92.9 Favored 'General case' 0 N--CA 1.449 -0.501 0 CA-C-O 119.168 -0.444 . . . . 0.0 110.14 176.441 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 57.6 mttm -57.54 -46.88 83.36 Favored 'General case' 0 C--N 1.342 0.271 0 N-CA-C 109.329 -0.619 . . . . 0.0 109.329 179.285 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 40.1 mm-40 -64.22 -40.53 96.23 Favored 'General case' 0 N--CA 1.452 -0.354 0 C-N-CA 122.397 0.279 . . . . 0.0 111.605 -177.022 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 63.5 mttm -64.35 -29.34 70.41 Favored 'General case' 0 N--CA 1.453 -0.277 0 C-N-CA 120.342 -0.543 . . . . 0.0 110.39 179.594 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 124' ' ' ILE . . . . . . . . . . . . . 51.8 mt -75.77 -33.13 25.3 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.218 0 N-CA-C 109.874 -0.417 . . . . 0.0 109.874 176.0 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 11.3 mmm180 -66.44 -39.06 88.67 Favored 'General case' 0 C--N 1.339 0.147 0 CA-C-N 118.135 0.425 . . . . 0.0 110.466 179.676 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 126' ' ' MET . . . . . . . . . . . . . 27.8 ptm -72.43 -33.28 66.98 Favored 'General case' 0 N--CA 1.455 -0.218 0 C-N-CA 120.314 -0.554 . . . . 0.0 109.674 177.793 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 3.3 mp -64.69 -33.96 77.17 Favored 'General case' 0 N--CA 1.455 -0.212 0 N-CA-C 109.644 -0.502 . . . . 0.0 109.644 175.042 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 31.6 tp -66.4 -42.25 88.12 Favored 'General case' 0 N--CA 1.452 -0.329 0 N-CA-C 110.077 -0.342 . . . . 0.0 110.077 179.134 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 18.0 t0 -64.7 -44.72 89.35 Favored 'General case' 0 N--CA 1.455 -0.218 0 N-CA-C 110.243 -0.281 . . . . 0.0 110.243 177.856 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 59.7 mt -58.79 -35.22 54.83 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.203 0 N-CA-C 110.238 -0.282 . . . . 0.0 110.238 -179.176 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 131' ' ' TRP . . . . . . . . . . . . . 45.6 m0 -75.43 -35.97 60.86 Favored 'General case' 0 N--CA 1.455 -0.182 0 N-CA-C 112.874 0.694 . . . . 0.0 112.874 -179.917 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 65.2 m-20 -67.39 -29.88 69.51 Favored 'General case' 0 N--CA 1.456 -0.139 0 CA-C-N 118.392 0.542 . . . . 0.0 110.112 178.206 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 17.8 mtp180 -74.76 -31.89 61.92 Favored 'General case' 0 N--CA 1.456 -0.158 0 C-N-CA 123.684 0.794 . . . . 0.0 110.261 175.851 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 32.1 t -75.08 -10.69 59.7 Favored 'General case' 0 CA--C 1.529 0.142 0 C-N-CA 122.928 0.491 . . . . 0.0 112.262 179.012 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 135' ' ' GLY . . . . . . . . . . . . . . . 75.27 12.73 83.36 Favored Glycine 0 CA--C 1.529 0.957 0 CA-C-O 119.472 -0.627 . . . . 0.0 112.782 178.745 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 136' ' ' LEU . . . . . . . . . . . . . 34.0 mt -62.59 146.1 52.78 Favored 'General case' 0 N--CA 1.457 -0.12 0 CA-C-N 118.051 0.926 . . . . 0.0 109.545 178.417 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 137' ' ' PHE . . . . . . . . . . . . . 7.1 m-30 -77.59 30.98 0.15 Allowed 'General case' 0 CA--C 1.53 0.191 0 C-N-CA 123.773 0.829 . . . . 0.0 112.931 -174.87 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 138' ' ' GLN . . . . . 0.471 ' C ' ' H ' ' A' ' 140' ' ' SER . 24.5 mm-40 -68.45 152.54 45.26 Favored 'General case' 0 N--CA 1.456 -0.136 0 CA-C-O 120.776 0.322 . . . . 0.0 111.312 -177.292 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 139' ' ' LYS . . . . . 0.435 ' HE3' ' HA ' ' A' ' 103' ' ' GLU . 98.8 mttt -76.58 30.08 0.13 Allowed 'General case' 0 CA--C 1.531 0.218 0 C-N-CA 123.288 0.635 . . . . 0.0 110.728 174.971 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 140' ' ' SER . . . . . 0.471 ' H ' ' C ' ' A' ' 138' ' ' GLN . 80.5 p -67.51 -0.74 4.06 Favored 'General case' 0 N--CA 1.453 -0.314 0 C-N-CA 123.913 0.885 . . . . 0.0 112.022 -176.938 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 141' ' ' TYR . . . . . . . . . . . . . 50.7 p90 -90.31 -7.72 52.64 Favored 'General case' 0 CA--C 1.535 0.39 0 CA-C-N 118.094 0.406 . . . . 0.0 111.723 176.779 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 142' ' ' LEU . . . . . . . . . . . . . 90.2 mt -82.69 148.77 27.72 Favored 'General case' 0 CA--C 1.529 0.135 0 CA-C-O 121.269 0.556 . . . . 0.0 111.857 -179.821 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 28.7 p-10 -75.11 -17.38 60.44 Favored 'General case' 0 N--CA 1.455 -0.189 0 C-N-CA 123.171 0.588 . . . . 0.0 111.041 178.746 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . -63.71 -29.73 70.92 Favored 'General case' 0 N--CA 1.453 -0.314 0 N-CA-C 110.427 -0.212 . . . . 0.0 110.427 178.336 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 145' ' ' ILE . . . . . . . . . . . . . 32.9 mm -67.6 -25.91 34.17 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.336 0 C-N-CA 122.218 0.207 . . . . 0.0 110.674 178.122 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 146' ' ' ARG . . . . . . . . . . . . . 9.4 mpt_? -79.12 -55.9 4.77 Favored 'General case' 0 N--CA 1.455 -0.182 0 N-CA-C 109.491 -0.559 . . . . 0.0 109.491 178.707 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 147' ' ' SER . . . . . . . . . . . . . 72.4 m 37.69 57.59 1.44 Allowed 'General case' 0 C--N 1.34 0.153 0 C-N-CA 123.597 0.759 . . . . 0.0 111.261 -179.874 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 148' ' ' LYS . . . . . 0.568 ' HD3' ' H ' ' A' ' 148' ' ' LYS . 0.1 OUTLIER -52.87 -17.67 1.51 Allowed 'General case' 0 CA--C 1.53 0.188 0 C-N-CA 123.754 0.821 . . . . 0.0 112.931 -175.818 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 149' ' ' CYS . . . . . . . . . . . . . 66.4 m -59.94 -34.7 73.59 Favored 'General case' 0 N--CA 1.451 -0.401 0 CA-C-N 118.225 0.466 . . . . 0.0 109.961 179.904 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 150' ' ' PHE . . . . . . . . . . . . . 18.3 m-85 -67.25 -14.45 62.93 Favored 'General case' 0 N--CA 1.453 -0.281 0 CA-C-N 117.714 0.234 . . . . 0.0 111.253 -179.721 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 151' ' ' ALA . . . . . . . . . . . . . . . -101.4 -14.73 17.45 Favored 'General case' 0 N--CA 1.454 -0.275 0 C-N-CA 123.088 0.555 . . . . 0.0 111.068 174.896 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 152' ' ' MET . . . . . . . . . . . . . 93.2 mtp -88.7 -26.41 21.83 Favored 'General case' 0 CA--C 1.528 0.106 0 C-N-CA 122.741 0.416 . . . . 0.0 111.445 173.853 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 153' ' ' ASP . . . . . . . . . . . . . 90.9 m-20 -68.34 -21.63 64.73 Favored 'General case' 0 CA--C 1.53 0.194 0 C-N-CA 123.648 0.779 . . . . 0.0 112.29 -179.522 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 154' ' ' LEU . . . . . . . . . . . . . 4.3 pp -134.27 164.35 27.59 Favored 'General case' 0 N--CA 1.447 -0.579 0 C-N-CA 123.92 0.888 . . . . 0.0 110.017 178.745 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 155' ' ' GLU . . . . . . . . . . . . . 2.1 pp20? -69.38 148.68 49.31 Favored 'General case' 0 N--CA 1.455 -0.202 0 CA-C-O 120.661 0.267 . . . . 0.0 110.825 -177.181 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 156' ' ' HIS . . . . . . . . . . . . . 14.0 t-80 -147.82 150.24 33.83 Favored 'General case' 0 N--CA 1.451 -0.394 0 N-CA-C 109.295 -0.631 . . . . 0.0 109.295 175.737 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 157' ' ' HIS . . . . . . . . . . . . . 26.9 m170 -76.9 4.63 9.43 Favored 'General case' 0 N--CA 1.453 -0.281 0 N-CA-C 112.431 0.53 . . . . 0.0 112.431 -171.971 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 158' ' ' HIS . . . . . . . . . . . . . 7.7 p80 -105.61 2.4 28.19 Favored 'General case' 0 CA--C 1.532 0.27 0 CA-C-O 119.427 -0.321 . . . . 0.0 111.392 174.304 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 159' ' ' HIS . . . . . . . . . . . . . 46.4 m170 . . . . . 0 C--O 1.249 1.071 0 CA-C-O 116.656 -1.64 . . . . 0.0 110.117 176.165 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' B' B 2052 ' ' ASP . . . . . . . . . . . . . 11.1 p-10 . . . . . 0 N--CA 1.473 0.695 0 N-CA-C 109.685 -0.487 . . . . 0.0 109.685 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' B' B 2053 ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -73.76 138.76 44.77 Favored 'General case' 0 N--CA 1.456 -0.126 0 CA-C-O 120.923 0.392 . . . . 0.0 111.948 -177.676 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B 2054 ' ' ASP . . . . . . . . . . . . . 40.8 p30 -157.34 154.62 29.26 Favored 'General case' 0 N--CA 1.452 -0.354 0 C-N-CA 123.752 0.821 . . . . 0.0 109.547 176.189 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B 2055 ' ' GLU . . . . . . . . . . . . . 60.0 tt0 44.16 41.36 4.17 Favored 'General case' 0 CA--C 1.531 0.241 0 C-N-CA 123.602 0.761 . . . . 0.0 111.718 178.382 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B 2056 ' ' ASP . . . . . . . . . . . . . 51.1 t0 -61.42 138.48 58.26 Favored 'General case' 0 N--CA 1.451 -0.403 0 N-CA-C 108.697 -0.853 . . . . 0.0 108.697 177.436 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B 2057 ' ' ASP . . . . . . . . . . . . . 56.6 t0 49.75 86.55 0.03 OUTLIER 'General case' 0 N--CA 1.455 -0.212 0 C-N-CA 124.938 1.295 . . . . 0.0 111.528 -170.045 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B 2058 ' ' TYR . . . . . . . . . . . . . 2.7 p90 -64.9 0.99 1.0 Allowed 'General case' 0 N--CA 1.455 -0.178 0 N-CA-C 112.419 0.526 . . . . 0.0 112.419 -177.929 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B 2059 ' ' THR . . . . . . . . . . . . . 60.4 m 54.23 77.86 0.42 Allowed Pre-proline 0 N--CA 1.455 -0.216 0 C-N-CA 124.362 1.065 . . . . 0.0 111.072 177.224 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B 2060 ' ' PRO . . . . . . . . . . . . . 61.3 Cg_endo -66.62 156.2 66.77 Favored 'Trans proline' 0 N--CA 1.45 -1.066 0 C-N-CA 123.43 2.753 . . . . 0.0 111.209 -179.231 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B 2061 ' ' SER . . . . . . . . . . . . . 46.0 t -152.36 154.46 35.67 Favored 'General case' 0 N--CA 1.455 -0.176 0 C-N-CA 123.231 0.612 . . . . 0.0 109.934 179.454 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B 2062 ' ' ILE . . . . . . . . . . . . . 14.2 tt -162.85 151.68 3.48 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.309 0 C-N-CA 123.122 0.569 . . . . 0.0 109.904 -176.91 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B 2063 ' ' SER . . . . . . . . . . . . . 93.1 p . . . . . 0 C--O 1.25 1.079 0 CA-C-O 117.618 -1.182 . . . . 0.0 109.282 174.334 . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.424 ' H3 ' ' CG ' ' A' ' 5' ' ' ASP . 68.0 mtm . . . . . 0 N--CA 1.475 0.813 0 N-CA-C 109.854 -0.425 . . . . 0.0 109.854 . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 58.1 mm-40 -97.82 -170.02 1.92 Allowed 'General case' 0 C--N 1.333 -0.131 0 N-CA-C 108.101 -1.074 . . . . 0.0 108.101 175.785 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 14.0 pt20 -63.64 -20.27 65.55 Favored 'General case' 0 CA--C 1.53 0.176 0 N-CA-C 109.426 -0.583 . . . . 0.0 109.426 174.072 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 4' ' ' ASP . . . . . 0.455 ' CG ' ' HZ1' ' A' ' 45' ' ' LYS . 11.8 p30 -156.18 126.28 6.53 Favored 'General case' 0 N--CA 1.449 -0.508 0 C-N-CA 124.463 1.105 . . . . 0.0 108.67 176.78 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . 0.424 ' CG ' ' H3 ' ' A' ' 1' ' ' MET . 68.0 m-20 -90.97 17.84 7.42 Favored 'General case' 0 CA--C 1.522 -0.103 0 N-CA-C 112.998 0.74 . . . . 0.0 112.998 -177.179 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 21.2 p-10 -73.91 -29.73 62.2 Favored 'General case' 0 N--CA 1.455 -0.196 0 N-CA-C 108.549 -0.908 . . . . 0.0 108.549 178.156 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 7' ' ' PHE . . . . . 0.59 ' HB2' ' HZ3' ' A' ' 45' ' ' LYS . 1.0 OUTLIER -55.35 -33.06 63.05 Favored 'General case' 0 N--CA 1.447 -0.606 0 C-N-CA 125.584 1.554 . . . . 0.0 111.462 -177.253 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 51.1 tp60 -51.8 -36.89 49.37 Favored 'General case' 0 N--CA 1.454 -0.272 0 C-N-CA 123.201 0.601 . . . . 0.0 112.21 -176.993 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 27.6 m-80 -71.29 -36.22 71.59 Favored 'General case' 0 N--CA 1.455 -0.223 0 CA-C-O 121.175 0.512 . . . . 0.0 110.016 -179.437 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 10' ' ' PHE . . . . . 0.422 ' CE2' ' HB2' ' A' ' 32' ' ' LEU . 7.1 t80 -69.96 -39.8 75.8 Favored 'General case' 0 N--CA 1.451 -0.408 0 C-N-CA 124.05 0.94 . . . . 0.0 109.349 177.139 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 83.2 t -66.17 -51.72 56.2 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.493 0 N-CA-C 109.042 -0.725 . . . . 0.0 109.042 179.693 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -59.45 -32.12 69.93 Favored 'General case' 0 CA--C 1.53 0.175 0 C-N-CA 122.508 0.323 . . . . 0.0 111.381 -179.422 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 85.5 m -71.55 -39.53 70.62 Favored 'General case' 0 CA--C 1.531 0.246 0 N-CA-C 109.025 -0.732 . . . . 0.0 109.025 176.484 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . 0.539 ' HA ' ' CD1' ' A' ' 17' ' ' PHE . 4.9 tp -64.84 -42.15 95.14 Favored 'General case' 0 N--CA 1.45 -0.471 0 CA-C-O 121.215 0.531 . . . . 0.0 110.208 178.624 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 69.0 mm-40 -63.83 -28.06 69.6 Favored 'General case' 0 N--CA 1.45 -0.469 0 C-N-CA 124.762 1.225 . . . . 0.0 109.337 178.09 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 43.6 t -70.23 -27.35 64.4 Favored 'General case' 0 N--CA 1.449 -0.516 0 N-CA-C 110.417 -0.216 . . . . 0.0 110.417 174.942 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 17' ' ' PHE . . . . . 0.539 ' CD1' ' HA ' ' A' ' 14' ' ' LEU . 21.8 m-85 -71.42 -41.1 69.95 Favored 'General case' 0 C--N 1.338 0.108 0 C-N-CA 119.335 -0.946 . . . . 0.0 110.879 170.441 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . 0.521 ' HG2' ' CE1' ' A' ' 53' ' ' TYR . 65.9 mttt -60.62 -25.55 66.36 Favored 'General case' 0 C--N 1.34 0.19 0 CA-C-N 118.138 0.426 . . . . 0.0 111.008 175.799 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 10.6 t0 -72.47 -47.06 51.78 Favored 'General case' 0 C--N 1.331 -0.22 0 C-N-CA 123.231 0.612 . . . . 0.0 110.26 178.784 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 63.3 mt -66.78 136.31 55.28 Favored 'General case' 0 N--CA 1.453 -0.306 0 CA-C-O 120.967 0.413 . . . . 0.0 110.405 -178.769 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 1.2 mppt? -75.3 -24.24 57.46 Favored 'General case' 0 N--CA 1.454 -0.236 0 N-CA-C 109.105 -0.702 . . . . 0.0 109.105 177.35 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 80.7 p -80.94 -23.4 38.87 Favored 'General case' 0 N--CA 1.457 -0.119 0 C-N-CA 123.773 0.829 . . . . 0.0 110.391 175.845 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 72.35 -33.73 0.67 Allowed Glycine 0 CA--C 1.526 0.728 0 C-N-CA 124.846 1.212 . . . . 0.0 112.938 178.239 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 63.0 mt -76.16 147.38 7.89 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.333 0 CA-C-N 117.528 0.664 . . . . 0.0 110.109 178.112 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 32.9 t -162.37 94.2 0.88 Allowed 'General case' 0 N--CA 1.455 -0.198 0 N-CA-C 109.058 -0.719 . . . . 0.0 109.058 171.67 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . 0.414 ' O ' ' HE2' ' A' ' 30' ' ' LYS . . . -55.28 -38.33 67.95 Favored Glycine 0 CA--C 1.524 0.613 0 C-N-CA 121.12 -0.562 . . . . 0.0 111.91 -172.426 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 27' ' ' SER . . . . . 0.526 ' H ' ' HB2' ' B' 2055 ' ' GLU . 74.7 p -71.71 -48.66 45.69 Favored 'General case' 0 N--CA 1.452 -0.354 0 CA-C-N 118.21 1.005 . . . . 0.0 110.898 -177.196 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . 0.408 HH12 ' CG ' ' B' 2054 ' ' ASP . 71.5 mmt-85 -65.53 -38.56 90.0 Favored 'General case' 0 C--O 1.233 0.2 0 N-CA-C 109.617 -0.512 . . . . 0.0 109.617 -179.637 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 47.9 mt -59.96 -44.41 94.49 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.814 0 N-CA-C 108.71 -0.848 . . . . 0.0 108.71 176.06 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . 0.42 ' HE3' ' HA ' ' A' ' 27' ' ' SER . 49.2 mtmt -66.17 -25.79 67.12 Favored 'General case' 0 C--N 1.34 0.166 0 CA-C-O 118.727 -0.654 . . . . 0.0 111.562 177.635 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . 0.513 ' HA ' ' HE2' ' A' ' 31' ' ' LYS . 8.9 mmpt? -66.88 -57.97 5.93 Favored 'General case' 0 C--N 1.341 0.214 0 CA-C-N 119.433 1.015 . . . . 0.0 109.95 179.435 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . 0.422 ' HB2' ' CE2' ' A' ' 10' ' ' PHE . 1.4 pp -75.1 -20.07 59.64 Favored 'General case' 0 CA--C 1.53 0.194 0 C-N-CA 118.929 -1.109 . . . . 0.0 111.917 -176.782 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 54.3 m -71.16 -38.28 72.2 Favored 'General case' 0 N--CA 1.452 -0.366 0 N-CA-C 108.626 -0.879 . . . . 0.0 108.626 175.548 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 63.8 m -69.76 -37.37 76.4 Favored 'General case' 0 N--CA 1.45 -0.431 0 N-CA-C 110.032 -0.358 . . . . 0.0 110.032 -178.949 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 72.8 t80 -67.39 -33.81 75.96 Favored 'General case' 0 N--CA 1.455 -0.18 0 C-N-CA 120.279 -0.569 . . . . 0.0 110.248 177.42 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -69.47 -37.11 77.13 Favored 'General case' 0 N--CA 1.45 -0.472 0 CA-C-N 116.627 -0.261 . . . . 0.0 110.588 178.207 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 2.9 mm? -71.23 -34.5 70.84 Favored 'General case' 0 N--CA 1.456 -0.154 0 C-N-CA 122.478 0.311 . . . . 0.0 110.227 179.781 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 45.5 t0 -67.17 -26.49 66.67 Favored 'General case' 0 N--CA 1.453 -0.297 0 C-N-CA 122.315 0.246 . . . . 0.0 110.475 176.289 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 97.1 m-70 -149.0 100.29 3.05 Favored 'General case' 0 C--N 1.341 0.197 0 N-CA-C 111.82 0.304 . . . . 0.0 111.82 -175.737 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 40' ' ' ILE . . . . . 0.568 ' H ' HD12 ' A' ' 40' ' ' ILE . 0.0 OUTLIER -75.65 -13.49 15.06 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.488 0 CA-C-O 119.158 -0.449 . . . . 0.0 110.061 174.116 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 32.6 m-20 -58.15 -16.68 14.29 Favored 'General case' 0 CA--C 1.532 0.286 0 C-N-CA 123.124 0.57 . . . . 0.0 112.11 -176.07 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -113.65 19.17 7.24 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.177 0 C-N-CA 123.41 0.684 . . . . 0.0 111.834 176.903 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 2.9 pp20? -54.02 -28.84 40.8 Favored 'General case' 0 C--N 1.339 0.131 0 O-C-N 121.544 -0.722 . . . . 0.0 111.693 179.175 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 3.9 m -67.31 -44.04 80.14 Favored 'General case' 0 N--CA 1.454 -0.231 0 O-C-N 121.962 -0.461 . . . . 0.0 111.518 -176.662 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . 0.59 ' HZ3' ' HB2' ' A' ' 7' ' ' PHE . 16.6 ptpt -73.73 -27.47 61.2 Favored 'General case' 0 C--N 1.341 0.206 0 CA-C-N 118.699 0.681 . . . . 0.0 109.789 177.56 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 64.0 mt -71.45 -53.88 19.26 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.274 0 C-N-CA 123.102 0.561 . . . . 0.0 110.721 -178.29 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 34.0 mm -68.18 -39.82 81.84 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.351 0 C-N-CA 122.381 0.272 . . . . 0.0 110.313 -176.49 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 66.0 p -68.15 -33.55 74.68 Favored 'General case' 0 N--CA 1.452 -0.347 0 C-N-CA 120.219 -0.592 . . . . 0.0 110.54 179.922 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 48.4 tp -75.21 -35.13 61.52 Favored 'General case' 0 N--CA 1.453 -0.286 0 N-CA-C 113.033 0.753 . . . . 0.0 113.033 -177.823 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 3.4 pt -73.06 -42.61 59.21 Favored 'Isoleucine or valine' 0 CA--C 1.526 0.041 0 CA-C-N 118.788 0.722 . . . . 0.0 111.137 179.311 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 21.8 pt -65.79 -39.17 84.01 Favored 'Isoleucine or valine' 0 CA--C 1.528 0.112 0 C-N-CA 119.649 -0.821 . . . . 0.0 110.708 177.707 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 84.8 m-20 -68.79 -35.44 77.04 Favored 'General case' 0 N--CA 1.453 -0.325 0 CA-C-N 118.248 0.476 . . . . 0.0 111.279 177.901 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 53' ' ' TYR . . . . . 0.521 ' CE1' ' HG2' ' A' ' 18' ' ' LYS . 7.7 t80 -62.02 -45.33 94.04 Favored 'General case' 0 N--CA 1.453 -0.301 0 N-CA-C 108.501 -0.926 . . . . 0.0 108.501 174.781 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 20.5 m -63.27 -33.93 76.58 Favored 'General case' 0 N--CA 1.454 -0.232 0 C-N-CA 123.258 0.623 . . . . 0.0 111.99 -175.193 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 64.6 mtm180 -79.0 -42.65 26.1 Favored 'General case' 0 N--CA 1.455 -0.201 0 N-CA-C 111.883 0.327 . . . . 0.0 111.883 -176.685 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 45.2 mt -77.47 -43.29 32.81 Favored 'General case' 0 N--CA 1.457 -0.08 0 N-CA-C 112.309 0.485 . . . . 0.0 112.309 -177.743 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 57' ' ' CYS . . . . . 0.443 ' HB2' ' HD2' ' A' ' 58' ' ' PRO . 10.6 p -67.49 161.42 65.37 Favored Pre-proline 0 CA--C 1.532 0.264 0 N-CA-C 113.049 0.759 . . . . 0.0 113.049 -173.489 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 58' ' ' PRO . . . . . 0.443 ' HD2' ' HB2' ' A' ' 57' ' ' CYS . 86.3 Cg_endo -72.89 179.25 5.5 Favored 'Trans proline' 0 N--CA 1.454 -0.823 0 C-N-CA 124.249 3.299 . . . . 0.0 110.59 174.614 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 59' ' ' ASP . . . . . 0.48 ' CG ' ' HA ' ' A' ' 116' ' ' SER . 49.9 t0 -55.37 -52.52 63.24 Favored 'General case' 0 N--CA 1.453 -0.311 0 N-CA-C 113.958 1.095 . . . . 0.0 113.958 -173.479 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 97.4 p -63.4 -39.61 94.96 Favored 'General case' 0 C--O 1.231 0.131 0 CA-C-N 119.091 0.86 . . . . 0.0 110.545 -174.297 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 49.6 m170 -66.11 -34.71 78.67 Favored 'General case' 0 N--CA 1.452 -0.348 0 N-CA-C 109.666 -0.494 . . . . 0.0 109.666 175.54 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . 0.548 ' HE3' HD11 ' A' ' 124' ' ' ILE . 0.0 OUTLIER -72.36 -32.1 66.18 Favored 'General case' 0 N--CA 1.453 -0.283 0 C-N-CA 122.893 0.477 . . . . 0.0 111.954 -178.464 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 1.7 tm? -75.29 -35.11 61.34 Favored 'General case' 0 CA--C 1.532 0.276 0 N-CA-C 107.783 -1.192 . . . . 0.0 107.783 178.699 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -71.49 -31.64 65.42 Favored Glycine 0 CA--C 1.526 0.77 0 N-CA-C 111.601 -0.6 . . . . 0.0 111.601 176.449 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 82.6 p -71.96 -31.47 66.33 Favored 'General case' 0 N--CA 1.451 -0.401 0 O-C-N 121.822 -0.81 . . . . 0.0 109.882 177.797 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 76.8 mt -75.05 -25.08 58.4 Favored 'General case' 0 N--CA 1.455 -0.222 0 CA-C-O 119.568 -0.253 . . . . 0.0 110.413 174.781 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 4.1 m-30 -66.5 -36.26 82.29 Favored 'General case' 0 CA--C 1.516 -0.341 0 N-CA-C 109.453 -0.573 . . . . 0.0 109.453 172.465 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 68' ' ' ILE . . . . . 0.441 HD13 ' CE1' ' A' ' 17' ' ' PHE . 41.0 mt -68.32 -55.82 14.86 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.567 0 N-CA-C 108.758 -0.83 . . . . 0.0 108.758 178.03 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 61.9 mt -47.87 -37.67 6.45 Favored 'Isoleucine or valine' 0 C--N 1.343 0.297 0 C-N-CA 124.089 0.956 . . . . 0.0 111.742 176.016 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 15.4 t70 -70.4 -44.07 68.73 Favored 'General case' 0 C--O 1.233 0.203 0 CA-C-N 118.557 0.617 . . . . 0.0 110.881 178.976 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 20.4 m -68.97 -52.32 30.2 Favored 'General case' 0 N--CA 1.455 -0.183 0 N-CA-C 110.202 -0.296 . . . . 0.0 110.202 -175.46 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 72' ' ' ILE . . . . . 0.462 HD12 ' CZ ' ' A' ' 76' ' ' TYR . 0.0 OUTLIER -73.97 -31.04 29.28 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.403 0 N-CA-C 109.68 -0.489 . . . . 0.0 109.68 -176.403 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -68.76 -53.84 17.87 Favored Glycine 0 C--N 1.338 0.694 0 N-CA-C 111.695 -0.562 . . . . 0.0 111.695 -175.458 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 37.8 mtm105 -68.5 -39.5 81.24 Favored 'General case' 0 N--CA 1.452 -0.335 0 C-N-CA 120.672 -0.411 . . . . 0.0 110.157 179.844 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -65.26 -30.9 71.81 Favored 'General case' 0 N--CA 1.451 -0.386 0 C-N-CA 120.457 -0.497 . . . . 0.0 110.755 -179.183 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 76' ' ' TYR . . . . . 0.462 ' CZ ' HD12 ' A' ' 72' ' ' ILE . 1.4 m-30 -68.23 -48.06 66.14 Favored 'General case' 0 CA--C 1.517 -0.318 0 CA-C-N 118.225 0.466 . . . . 0.0 110.779 176.358 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 51.3 tp -68.59 -37.25 79.69 Favored 'General case' 0 N--CA 1.448 -0.534 0 C-N-CA 118.617 -1.233 . . . . 0.0 110.021 -177.669 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 96.5 m-20 -67.87 -40.27 83.61 Favored 'General case' 0 C--N 1.333 -0.139 0 N-CA-C 113.273 0.842 . . . . 0.0 113.273 -179.584 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 13.6 mm-40 -65.8 -48.37 71.97 Favored 'General case' 0 N--CA 1.456 -0.175 0 C-N-CA 119.917 -0.713 . . . . 0.0 110.336 174.06 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 76.5 p -66.53 -26.86 67.35 Favored 'General case' 0 CA--C 1.529 0.145 0 CA-C-N 118.505 0.593 . . . . 0.0 111.251 -179.632 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 74.7 mtt180 -65.41 -37.75 87.88 Favored 'General case' 0 C--N 1.338 0.067 0 C-N-CA 122.717 0.407 . . . . 0.0 110.393 170.858 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 20.7 m -79.82 -41.95 25.36 Favored 'General case' 0 N--CA 1.452 -0.326 0 N-CA-C 112.07 0.396 . . . . 0.0 112.07 -176.645 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -167.22 155.84 9.86 Favored 'General case' 0 C--O 1.226 -0.164 0 C-N-CA 122.858 0.463 . . . . 0.0 110.974 -177.171 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 78.9 p -84.39 94.63 8.54 Favored 'General case' 0 N--CA 1.454 -0.265 0 N-CA-C 109.094 -0.706 . . . . 0.0 109.094 175.241 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 2.0 m120 -69.0 -13.94 62.75 Favored 'General case' 0 CA--C 1.532 0.278 0 C-N-CA 122.361 0.264 . . . . 0.0 111.583 -179.431 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 45.7 t -160.8 173.16 15.78 Favored 'General case' 0 N--CA 1.453 -0.28 0 C-N-CA 123.425 0.69 . . . . 0.0 109.487 -179.699 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 26.6 m -144.61 145.72 31.93 Favored 'General case' 0 N--CA 1.455 -0.183 0 C-N-CA 123.252 0.621 . . . . 0.0 109.941 -179.428 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 35.1 t -163.86 168.32 19.66 Favored 'General case' 0 N--CA 1.453 -0.275 0 C-N-CA 122.608 0.363 . . . . 0.0 110.263 -176.238 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 7.5 m120 -69.15 -34.86 75.66 Favored 'General case' 0 N--CA 1.454 -0.263 0 C-N-CA 122.462 0.305 . . . . 0.0 111.707 -178.312 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 29.9 tptp -161.32 -64.28 0.02 OUTLIER Pre-proline 0 CA--C 1.535 0.379 0 CA-C-O 118.265 -0.874 . . . . 0.0 111.7 176.013 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 91.0 Cg_endo -71.77 159.72 49.95 Favored 'Trans proline' 0 N--CA 1.454 -0.83 0 C-N-CA 122.527 2.152 . . . . 0.0 108.951 176.913 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 92' ' ' GLY . . . . . 0.426 ' HA2' ' O ' ' A' ' 40' ' ' ILE . . . 97.73 16.65 33.09 Favored Glycine 0 CA--C 1.527 0.842 0 CA-C-O 119.507 -0.607 . . . . 0.0 113.793 179.944 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 21.9 p -152.22 169.36 22.66 Favored 'General case' 0 C--O 1.231 0.099 0 CA-C-N 118.14 0.97 . . . . 0.0 110.508 178.179 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 94' ' ' CYS . . . . . 0.443 ' HB2' HD13 ' A' ' 98' ' ' ILE . 30.0 p -57.8 -23.24 51.52 Favored 'General case' 0 N--CA 1.449 -0.514 0 CA-C-N 115.956 -0.565 . . . . 0.0 109.64 175.88 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -60.38 -55.84 28.68 Favored 'General case' 0 N--CA 1.446 -0.659 0 N-CA-C 109.358 -0.608 . . . . 0.0 109.358 -178.013 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 53.9 t60 -76.06 -29.5 58.04 Favored 'General case' 0 N--CA 1.451 -0.401 0 N-CA-C 111.608 0.225 . . . . 0.0 111.608 179.997 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -67.58 -49.46 63.04 Favored 'General case' 0 N--CA 1.448 -0.528 0 N-CA-C 110.493 -0.188 . . . . 0.0 110.493 -178.596 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 98' ' ' ILE . . . . . 0.443 HD13 ' HB2' ' A' ' 94' ' ' CYS . 2.1 mp -72.47 -26.84 24.83 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.313 0 C-N-CA 120.546 -0.461 . . . . 0.0 110.062 178.78 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 3.7 m120 -63.69 -45.0 92.02 Favored 'General case' 0 N--CA 1.454 -0.264 0 CA-C-N 118.912 0.778 . . . . 0.0 110.193 173.251 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 85.0 m -65.04 -35.5 81.38 Favored 'General case' 0 N--CA 1.455 -0.189 0 C-N-CA 122.705 0.402 . . . . 0.0 110.967 -176.395 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 93.3 mt -75.74 -35.36 60.24 Favored 'General case' 0 N--CA 1.448 -0.559 0 N-CA-C 110.501 -0.185 . . . . 0.0 110.501 176.461 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -75.44 -30.23 58.73 Favored Glycine 0 CA--C 1.527 0.813 0 CA-C-O 119.785 -0.453 . . . . 0.0 112.941 -175.843 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 25.8 pt-20 -75.99 -6.11 49.43 Favored 'General case' 0 CA--C 1.53 0.183 0 CA-C-N 117.856 0.828 . . . . 0.0 111.926 -177.348 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 27.0 m -140.17 21.04 0.56 Allowed 'Isoleucine or valine' 0 CA--C 1.531 0.218 0 CA-C-N 118.102 0.41 . . . . 0.0 111.064 175.524 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 105' ' ' ILE . . . . . . . . . . . . . 10.0 tp -62.05 -39.21 82.95 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.288 0 CA-C-N 118.033 0.379 . . . . 0.0 111.768 -173.958 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 13.3 pt20 -73.86 -31.08 63.0 Favored 'General case' 0 N--CA 1.454 -0.228 0 O-C-N 122.009 -0.432 . . . . 0.0 110.19 -179.421 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 58.7 mm-40 -76.11 -41.42 50.28 Favored 'General case' 0 N--CA 1.454 -0.258 0 CA-C-N 117.743 0.247 . . . . 0.0 110.467 -179.863 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 65.7 tp -70.32 -38.49 74.94 Favored 'General case' 0 N--CA 1.45 -0.463 0 C-N-CA 122.657 0.383 . . . . 0.0 110.61 -177.775 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 88.5 mt -73.44 -42.51 61.9 Favored 'General case' 0 N--CA 1.453 -0.31 0 C-N-CA 120.692 -0.403 . . . . 0.0 110.16 177.386 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 45.6 t -58.07 -43.96 87.26 Favored 'General case' 0 N--CA 1.456 -0.129 0 CA-C-N 118.187 0.449 . . . . 0.0 110.465 178.753 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 55.0 t0 -64.48 -39.72 94.33 Favored 'General case' 0 N--CA 1.453 -0.299 0 N-CA-C 108.682 -0.859 . . . . 0.0 108.682 175.59 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -66.39 -38.32 87.26 Favored 'General case' 0 N--CA 1.444 -0.742 0 N-CA-C 112.202 0.445 . . . . 0.0 112.202 -175.89 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 113' ' ' ILE . . . . . . . . . . . . . 9.3 mm -71.83 -38.99 67.26 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.287 0 CA-C-N 118.462 0.574 . . . . 0.0 109.809 179.816 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -71.26 -35.44 71.4 Favored 'General case' 0 CA--C 1.531 0.23 0 N-CA-C 112.247 0.462 . . . . 0.0 112.247 178.916 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 5.2 tppp? -74.15 -32.91 63.33 Favored 'General case' 0 N--CA 1.456 -0.141 0 C-N-CA 123.004 0.522 . . . . 0.0 110.779 178.436 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 116' ' ' SER . . . . . 0.48 ' HA ' ' CG ' ' A' ' 59' ' ' ASP . 94.4 p -90.93 142.86 27.32 Favored 'General case' 0 N--CA 1.452 -0.37 0 N-CA-C 113.188 0.811 . . . . 0.0 113.188 -169.972 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 14.0 t-20 -76.82 170.53 16.3 Favored 'General case' 0 N--CA 1.454 -0.23 0 N-CA-C 109.013 -0.736 . . . . 0.0 109.013 173.456 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 118' ' ' GLN . . . . . . . . . . . . . 13.9 mm100 -58.88 -32.2 69.27 Favored 'General case' 0 CA--C 1.528 0.097 0 N-CA-C 112.489 0.551 . . . . 0.0 112.489 -170.859 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 10.5 t0 -63.22 -51.81 64.78 Favored 'General case' 0 C--O 1.233 0.221 0 CA-C-O 121.508 0.671 . . . . 0.0 109.257 175.572 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 120' ' ' HIS . . . . . 0.468 ' CE1' ' HZ1' ' A' ' 123' ' ' LYS . 98.5 m-70 -72.83 -25.44 61.13 Favored 'General case' 0 N--CA 1.447 -0.595 0 CA-C-N 116.046 -0.524 . . . . 0.0 111.098 -177.555 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 56.3 mttp -61.44 -44.65 96.75 Favored 'General case' 0 C--N 1.338 0.073 0 N-CA-C 108.973 -0.751 . . . . 0.0 108.973 172.012 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 41.0 tp10 -67.63 -35.78 79.56 Favored 'General case' 0 N--CA 1.454 -0.246 0 C-N-CA 122.185 0.194 . . . . 0.0 111.123 -177.223 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 123' ' ' LYS . . . . . 0.468 ' HZ1' ' CE1' ' A' ' 120' ' ' HIS . 43.7 mtmt -71.21 -30.23 66.12 Favored 'General case' 0 N--CA 1.454 -0.246 0 O-C-N 122.129 -0.357 . . . . 0.0 110.537 178.147 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 124' ' ' ILE . . . . . 0.548 HD11 ' HE3' ' A' ' 62' ' ' LYS . 56.4 mt -68.8 -37.69 77.78 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.195 0 N-CA-C 108.891 -0.781 . . . . 0.0 108.891 171.802 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 6.1 mmm180 -61.5 -45.33 94.65 Favored 'General case' 0 N--CA 1.453 -0.284 0 CA-C-O 118.717 -0.659 . . . . 0.0 111.476 -179.606 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 126' ' ' MET . . . . . . . . . . . . . 28.5 ptm -64.85 -34.34 78.15 Favored 'General case' 0 N--CA 1.455 -0.176 0 C-N-CA 119.187 -1.005 . . . . 0.0 108.923 177.712 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 3.6 mp -64.41 -39.82 94.59 Favored 'General case' 0 CA--C 1.531 0.224 0 CA-C-N 118.317 0.508 . . . . 0.0 110.873 175.742 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 81.3 mt -70.23 -30.59 67.71 Favored 'General case' 0 N--CA 1.454 -0.263 0 CA-C-N 118.404 0.547 . . . . 0.0 111.191 179.755 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 48.5 m-20 -73.97 -35.86 64.52 Favored 'General case' 0 N--CA 1.456 -0.143 0 N-CA-C 109.951 -0.389 . . . . 0.0 109.951 176.102 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 60.1 mt -62.15 -35.8 70.87 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.22 0 N-CA-C 109.133 -0.691 . . . . 0.0 109.133 175.273 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 131' ' ' TRP . . . . . . . . . . . . . 43.3 m0 -73.14 -34.74 66.26 Favored 'General case' 0 N--CA 1.455 -0.21 0 N-CA-C 112.975 0.732 . . . . 0.0 112.975 179.536 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 96.0 m-20 -64.92 -35.59 81.65 Favored 'General case' 0 C--N 1.339 0.149 0 CA-C-N 118.767 0.712 . . . . 0.0 110.388 176.19 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 12.6 mtp180 -74.65 -32.02 62.14 Favored 'General case' 0 N--CA 1.456 -0.171 0 C-N-CA 122.99 0.516 . . . . 0.0 110.346 179.486 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 41.3 m -77.51 -14.65 59.62 Favored 'General case' 0 N--CA 1.452 -0.331 0 C-N-CA 123.043 0.537 . . . . 0.0 111.662 179.797 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 135' ' ' GLY . . . . . . . . . . . . . . . 66.26 15.18 62.93 Favored Glycine 0 CA--C 1.529 0.922 0 CA-C-O 119.487 -0.618 . . . . 0.0 111.571 -179.699 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 136' ' ' LEU . . . . . . . . . . . . . 3.0 tt -66.44 -52.47 46.05 Favored 'General case' 0 N--CA 1.454 -0.235 0 CA-C-N 117.826 0.813 . . . . 0.0 109.088 -178.496 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 137' ' ' PHE . . . . . . . . . . . . . 69.7 t80 -161.34 142.67 11.5 Favored 'General case' 0 N--CA 1.45 -0.447 0 N-CA-C 108.252 -1.018 . . . . 0.0 108.252 174.922 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 138' ' ' GLN . . . . . . . . . . . . . 22.6 mp0 -74.31 139.3 44.1 Favored 'General case' 0 N--CA 1.454 -0.271 0 CA-C-O 120.826 0.346 . . . . 0.0 110.749 -176.581 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 139' ' ' LYS . . . . . . . . . . . . . 4.5 ttmp? -55.44 131.05 44.99 Favored 'General case' 0 N--CA 1.452 -0.364 0 C-N-CA 123.63 0.772 . . . . 0.0 109.816 176.1 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 140' ' ' SER . . . . . . . . . . . . . 46.9 t -74.15 154.93 38.89 Favored 'General case' 0 N--CA 1.454 -0.269 0 C-N-CA 122.631 0.372 . . . . 0.0 110.211 179.447 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 141' ' ' TYR . . . . . . . . . . . . . 55.4 p90 -128.01 6.15 5.98 Favored 'General case' 0 N--CA 1.455 -0.186 0 N-CA-C 112.099 0.407 . . . . 0.0 112.099 -175.406 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 142' ' ' LEU . . . . . . . . . . . . . 10.0 mp -69.3 151.71 45.89 Favored 'General case' 0 N--CA 1.454 -0.233 0 N-CA-C 109.427 -0.582 . . . . 0.0 109.427 -179.877 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 16.2 p30 -65.43 -12.19 49.97 Favored 'General case' 0 N--CA 1.453 -0.279 0 CA-C-N 116.48 -0.327 . . . . 0.0 111.088 -179.336 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . -64.37 -38.02 89.58 Favored 'General case' 0 N--CA 1.451 -0.4 0 N-CA-C 109.128 -0.693 . . . . 0.0 109.128 174.04 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 145' ' ' ILE . . . . . . . . . . . . . 26.1 mm -68.26 -40.32 82.45 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.418 0 N-CA-C 109.124 -0.695 . . . . 0.0 109.124 176.474 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 146' ' ' ARG . . . . . . . . . . . . . 32.3 tpt180 -59.45 -29.95 68.15 Favored 'General case' 0 N--CA 1.456 -0.129 0 C-N-CA 123.002 0.521 . . . . 0.0 110.391 -177.195 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 147' ' ' SER . . . . . . . . . . . . . 17.7 m 49.15 35.95 8.15 Favored 'General case' 0 C--N 1.339 0.129 0 C-N-CA 123.187 0.595 . . . . 0.0 111.534 174.715 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 148' ' ' LYS . . . . . 0.579 ' HD3' ' H ' ' A' ' 148' ' ' LYS . 0.0 OUTLIER -40.67 -41.87 1.6 Allowed 'General case' 0 CA--C 1.531 0.227 0 C-N-CA 124.867 1.267 . . . . 0.0 113.279 -172.762 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 149' ' ' CYS . . . . . . . . . . . . . 59.7 m -70.1 -64.72 0.83 Allowed 'General case' 0 N--CA 1.454 -0.271 0 CA-C-N 118.392 0.542 . . . . 0.0 110.783 -177.97 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 150' ' ' PHE . . . . . . . . . . . . . 45.8 m-85 -62.82 -22.33 66.57 Favored 'General case' 0 N--CA 1.455 -0.223 0 N-CA-C 111.53 0.196 . . . . 0.0 111.53 -175.28 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 151' ' ' ALA . . . . . . . . . . . . . . . -75.72 -41.1 54.39 Favored 'General case' 0 N--CA 1.452 -0.344 0 C-N-CA 121.298 -0.161 . . . . 0.0 110.995 177.208 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 152' ' ' MET . . . . . . . . . . . . . 94.6 mtp -76.82 -22.74 53.17 Favored 'General case' 0 CA--C 1.529 0.152 0 N-CA-C 112.088 0.403 . . . . 0.0 112.088 178.884 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 153' ' ' ASP . . . . . . . . . . . . . 80.6 m-20 -69.61 -14.75 62.99 Favored 'General case' 0 CA--C 1.529 0.142 0 N-CA-C 112.659 0.614 . . . . 0.0 112.659 -179.813 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 154' ' ' LEU . . . . . . . . . . . . . 78.1 mt -78.24 159.27 28.6 Favored 'General case' 0 N--CA 1.456 -0.152 0 CA-C-O 121.247 0.546 . . . . 0.0 112.181 -179.305 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 155' ' ' GLU . . . . . 0.424 ' HG2' ' CD2' ' A' ' 156' ' ' HIS . 3.2 pm0 -72.16 -5.84 38.44 Favored 'General case' 0 N--CA 1.454 -0.247 0 C-N-CA 124.145 0.978 . . . . 0.0 112.947 -177.326 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 156' ' ' HIS . . . . . 0.424 ' CD2' ' HG2' ' A' ' 155' ' ' GLU . 93.8 m-70 -143.59 151.36 40.09 Favored 'General case' 0 N--CA 1.454 -0.259 0 C-N-CA 123.518 0.727 . . . . 0.0 109.314 176.361 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 157' ' ' HIS . . . . . . . . . . . . . 42.7 m170 -123.64 155.06 38.45 Favored 'General case' 0 N--CA 1.455 -0.22 0 C-N-CA 123.444 0.698 . . . . 0.0 109.764 -179.06 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 158' ' ' HIS . . . . . . . . . . . . . 79.0 t60 -164.87 -22.03 0.03 OUTLIER 'General case' 0 N--CA 1.465 0.301 0 C-N-CA 123.168 0.587 . . . . 0.0 110.083 -178.016 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 159' ' ' HIS . . . . . . . . . . . . . 20.0 p-80 . . . . . 0 C--O 1.257 1.464 0 CA-C-O 116.283 -1.817 . . . . 0.0 110.164 178.061 . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' B' B 2052 ' ' ASP . . . . . . . . . . . . . 28.4 p-10 . . . . . 0 N--CA 1.474 0.744 0 N-CA-C 110.604 -0.147 . . . . 0.0 110.604 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' B' B 2053 ' ' ASP . . . . . . . . . . . . . 47.3 t0 -160.13 162.08 33.89 Favored 'General case' 0 N--CA 1.454 -0.265 0 C-N-CA 122.317 0.247 . . . . 0.0 111.143 -179.745 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B 2054 ' ' ASP . . . . . 0.408 ' CG ' HH12 ' A' ' 28' ' ' ARG . 0.5 OUTLIER -155.29 10.95 0.33 Allowed 'General case' 0 CA--C 1.538 0.501 0 CA-C-N 115.728 -0.669 . . . . 0.0 110.497 173.213 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' B' B 2055 ' ' GLU . . . . . 0.526 ' HB2' ' H ' ' A' ' 27' ' ' SER . 70.9 mt-10 -146.09 93.02 2.26 Favored 'General case' 0 C--N 1.34 0.167 0 C-N-CA 125.495 1.518 . . . . 0.0 107.341 173.46 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B 2056 ' ' ASP . . . . . . . . . . . . . 35.4 p-10 -70.31 -0.33 7.89 Favored 'General case' 0 CA--C 1.53 0.205 0 N-CA-C 113.153 0.797 . . . . 0.0 113.153 -171.477 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B 2057 ' ' ASP . . . . . . . . . . . . . 38.7 t0 -154.14 175.78 13.04 Favored 'General case' 0 N--CA 1.453 -0.317 0 CA-C-N 118.664 0.666 . . . . 0.0 110.565 179.619 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B 2058 ' ' TYR . . . . . . . . . . . . . 1.3 t80 -146.21 131.26 18.28 Favored 'General case' 0 N--CA 1.451 -0.418 0 C-N-CA 124.887 1.275 . . . . 0.0 107.848 179.103 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B 2059 ' ' THR . . . . . . . . . . . . . 80.5 p -125.58 101.52 30.35 Favored Pre-proline 0 N--CA 1.454 -0.241 0 N-CA-C 109.729 -0.471 . . . . 0.0 109.729 -174.936 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B 2060 ' ' PRO . . . . . . . . . . . . . 79.5 Cg_endo -72.34 167.86 25.78 Favored 'Trans proline' 0 N--CA 1.45 -1.049 0 C-N-CA 123.391 2.727 . . . . 0.0 110.359 176.135 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B 2061 ' ' SER . . . . . . . . . . . . . 41.1 t -146.0 140.01 26.55 Favored 'General case' 0 N--CA 1.452 -0.365 0 N-CA-C 108.653 -0.869 . . . . 0.0 108.653 177.266 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B 2062 ' ' ILE . . . . . . . . . . . . . 18.8 tt -163.72 157.75 1.71 Allowed 'Isoleucine or valine' 0 N--CA 1.453 -0.301 0 N-CA-C 110.096 -0.335 . . . . 0.0 110.096 -176.116 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B 2063 ' ' SER . . . . . . . . . . . . . 81.7 p . . . . . 0 C--O 1.251 1.16 0 CA-C-O 117.272 -1.347 . . . . 0.0 109.769 175.521 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 44.9 ttp . . . . . 0 N--CA 1.476 0.848 0 N-CA-C 109.901 -0.407 . . . . 0.0 109.901 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 42.4 tp60 -63.27 -16.9 61.71 Favored 'General case' 0 CA--C 1.531 0.232 0 C-N-CA 122.875 0.47 . . . . 0.0 111.114 179.053 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 56.7 tt0 -148.24 132.11 17.08 Favored 'General case' 0 N--CA 1.451 -0.379 0 N-CA-C 106.916 -1.513 . . . . 0.0 106.916 175.713 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 39.4 t0 58.21 174.42 0.06 Allowed 'General case' 0 CA--C 1.537 0.465 0 C-N-CA 123.309 0.644 . . . . 0.0 110.392 -170.184 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 47.5 t0 52.73 44.42 30.22 Favored 'General case' 0 CA--C 1.528 0.121 0 O-C-N 121.601 -0.687 . . . . 0.0 110.365 -179.465 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 28.6 p-10 -63.17 -32.85 74.34 Favored 'General case' 0 N--CA 1.452 -0.342 0 CA-C-N 116.385 -0.37 . . . . 0.0 110.434 -177.45 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 7' ' ' PHE . . . . . 0.526 ' HB2' ' HZ3' ' A' ' 45' ' ' LYS . 1.5 t80 -59.18 -41.97 89.73 Favored 'General case' 0 N--CA 1.449 -0.508 0 CA-C-N 116.746 -0.207 . . . . 0.0 110.489 -178.984 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 9.7 tp60 -55.18 -32.74 62.41 Favored 'General case' 0 N--CA 1.454 -0.252 0 C-N-CA 122.635 0.374 . . . . 0.0 110.934 -178.793 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 27.4 m-20 -70.84 -34.64 71.88 Favored 'General case' 0 N--CA 1.45 -0.455 0 N-CA-C 109.49 -0.559 . . . . 0.0 109.49 179.856 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 10' ' ' PHE . . . . . 0.515 ' CE2' ' HB2' ' A' ' 32' ' ' LEU . 11.7 t80 -69.14 -41.45 77.29 Favored 'General case' 0 N--CA 1.453 -0.284 0 C-N-CA 123.295 0.638 . . . . 0.0 109.411 175.503 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 94.6 t -63.68 -50.1 79.42 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.36 0 N-CA-C 109.032 -0.729 . . . . 0.0 109.032 179.771 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -61.13 -28.45 69.11 Favored 'General case' 0 N--CA 1.451 -0.409 0 C-N-CA 122.702 0.401 . . . . 0.0 111.137 179.731 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 85.8 m -73.98 -38.22 64.23 Favored 'General case' 0 N--CA 1.454 -0.266 0 N-CA-C 109.335 -0.617 . . . . 0.0 109.335 175.817 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . 0.405 ' HA ' ' CD1' ' A' ' 17' ' ' PHE . 0.1 OUTLIER -64.67 -43.82 92.36 Favored 'General case' 0 N--CA 1.453 -0.285 0 N-CA-C 108.809 -0.811 . . . . 0.0 108.809 176.916 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 66.4 mm-40 -65.22 -29.05 69.82 Favored 'General case' 0 N--CA 1.454 -0.243 0 C-N-CA 123.88 0.872 . . . . 0.0 109.988 178.633 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 67.0 m -69.76 -29.03 66.28 Favored 'General case' 0 N--CA 1.451 -0.397 0 N-CA-C 109.787 -0.449 . . . . 0.0 109.787 176.968 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 17' ' ' PHE . . . . . 0.412 ' CD1' HD12 ' A' ' 68' ' ' ILE . 18.4 m-85 -68.55 -40.49 80.62 Favored 'General case' 0 N--CA 1.456 -0.151 0 C-N-CA 120.195 -0.602 . . . . 0.0 109.869 172.814 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 65.5 mttt -65.48 -26.14 67.8 Favored 'General case' 0 N--CA 1.463 0.187 0 CA-C-O 121.134 0.492 . . . . 0.0 110.544 178.338 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 31.7 t0 -81.04 -6.81 59.24 Favored 'General case' 0 CA--C 1.536 0.442 0 C-N-CA 123.748 0.819 . . . . 0.0 112.99 -178.537 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . 0.428 ' CD1' ' HB2' ' A' ' 25' ' ' SER . 18.4 mt -93.6 151.01 19.96 Favored 'General case' 0 N--CA 1.455 -0.2 0 N-CA-C 113.17 0.804 . . . . 0.0 113.17 -176.558 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -71.75 -6.36 40.77 Favored 'General case' 0 CA--C 1.53 0.188 0 C-N-CA 124.049 0.939 . . . . 0.0 112.978 178.532 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 22' ' ' SER . . . . . 0.449 ' C ' ' H ' ' A' ' 24' ' ' ILE . 58.9 m -137.85 -7.8 1.63 Allowed 'General case' 0 CA--C 1.522 -0.096 0 N-CA-C 112.925 0.713 . . . . 0.0 112.925 -176.875 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 72.52 -25.69 0.74 Allowed Glycine 0 CA--C 1.528 0.859 0 C-N-CA 123.758 0.694 . . . . 0.0 112.512 -179.805 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . 0.449 ' H ' ' C ' ' A' ' 22' ' ' SER . 94.8 mt -76.98 141.64 15.35 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.263 0 N-CA-C 108.012 -1.107 . . . . 0.0 108.012 175.388 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 25' ' ' SER . . . . . 0.428 ' HB2' ' CD1' ' A' ' 20' ' ' LEU . 7.5 t -160.51 79.88 0.65 Allowed 'General case' 0 CA--C 1.518 -0.254 0 N-CA-C 110.209 -0.293 . . . . 0.0 110.209 -174.598 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -48.28 -49.95 24.19 Favored Glycine 0 CA--C 1.527 0.782 0 CA-C-O 118.851 -0.972 . . . . 0.0 114.17 -171.002 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 27' ' ' SER . . . . . 0.509 ' HA ' ' HE3' ' A' ' 30' ' ' LYS . 47.3 p -73.27 -33.34 65.2 Favored 'General case' 0 C--N 1.339 0.14 0 CA-C-N 119.962 1.881 . . . . 0.0 111.641 -174.54 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 2.3 mpt_? -73.91 -36.8 64.76 Favored 'General case' 0 N--CA 1.456 -0.147 0 N-CA-C 109.253 -0.647 . . . . 0.0 109.253 177.344 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 74.5 mt -61.25 -47.51 93.17 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.287 0 N-CA-C 109.007 -0.738 . . . . 0.0 109.007 175.417 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . 0.509 ' HE3' ' HA ' ' A' ' 27' ' ' SER . 52.1 mtmt -64.87 -30.15 71.14 Favored 'General case' 0 C--N 1.339 0.122 0 CA-C-O 119.36 -0.352 . . . . 0.0 111.135 179.65 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . 0.456 ' CE ' ' HA ' ' A' ' 31' ' ' LYS . 2.8 mmpt? -65.87 -60.07 3.23 Favored 'General case' 0 N--CA 1.455 -0.223 0 CA-C-N 118.455 0.57 . . . . 0.0 111.328 -179.942 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . 0.515 ' HB2' ' CE2' ' A' ' 10' ' ' PHE . 1.2 pp -75.89 -16.55 60.02 Favored 'General case' 0 CA--C 1.532 0.276 0 C-N-CA 119.247 -0.981 . . . . 0.0 111.687 -177.925 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 24.7 m -70.26 -42.94 71.49 Favored 'General case' 0 N--CA 1.454 -0.232 0 N-CA-C 108.398 -0.964 . . . . 0.0 108.398 173.338 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 93.5 m -66.65 -41.46 88.19 Favored 'General case' 0 N--CA 1.45 -0.459 0 N-CA-C 109.664 -0.495 . . . . 0.0 109.664 -178.728 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 23.8 t80 -60.49 -36.53 78.54 Favored 'General case' 0 C--N 1.339 0.122 0 N-CA-C 110.155 -0.313 . . . . 0.0 110.155 177.073 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -72.3 -28.12 62.88 Favored 'General case' 0 N--CA 1.451 -0.391 0 CA-C-O 119.211 -0.423 . . . . 0.0 111.516 179.457 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 2.7 mm? -82.12 -34.08 29.4 Favored 'General case' 0 CA--C 1.518 -0.281 0 N-CA-C 108.822 -0.807 . . . . 0.0 108.822 -177.923 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 86.7 m-20 -64.4 -27.19 68.83 Favored 'General case' 0 N--CA 1.444 -0.766 0 C-N-CA 123.652 0.781 . . . . 0.0 110.959 174.274 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 65.8 m80 -151.53 106.62 3.29 Favored 'General case' 0 N--CA 1.454 -0.234 0 C-N-CA 122.624 0.37 . . . . 0.0 111.621 -179.187 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 40' ' ' ILE . . . . . 0.554 ' H ' HD13 ' A' ' 40' ' ' ILE . 0.0 OUTLIER -80.53 -10.15 12.3 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.359 0 C-N-CA 123.058 0.543 . . . . 0.0 109.728 173.631 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -55.4 -23.39 24.45 Favored 'General case' 0 N--CA 1.457 -0.122 0 C-N-CA 123.86 0.864 . . . . 0.0 111.86 -178.016 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -108.6 18.0 6.74 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.246 0 C-N-CA 124.032 0.933 . . . . 0.0 111.95 -179.83 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 3.0 pp20? -53.33 -30.1 37.46 Favored 'General case' 0 CA--C 1.53 0.183 0 O-C-N 121.649 -0.657 . . . . 0.0 111.598 178.985 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 47.1 t -65.33 -44.49 87.61 Favored 'General case' 0 CA--C 1.53 0.196 0 N-CA-C 111.756 0.28 . . . . 0.0 111.756 -175.89 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . 0.526 ' HZ3' ' HB2' ' A' ' 7' ' ' PHE . 19.4 ptpt -73.94 -24.79 59.71 Favored 'General case' 0 C--N 1.341 0.22 0 O-C-N 121.738 -0.601 . . . . 0.0 110.167 179.253 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 84.8 mt -72.99 -48.17 45.4 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.327 0 C-N-CA 122.873 0.469 . . . . 0.0 109.948 -179.475 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 35.5 mm -63.92 -35.54 73.69 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.323 0 N-CA-C 109.646 -0.501 . . . . 0.0 109.646 178.977 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 15.4 t -63.25 -45.76 90.06 Favored 'General case' 0 N--CA 1.453 -0.276 0 C-N-CA 119.813 -0.755 . . . . 0.0 110.557 178.158 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 25.7 mt -66.6 -33.6 76.03 Favored 'General case' 0 N--CA 1.451 -0.415 0 CA-C-O 118.677 -0.677 . . . . 0.0 112.684 -175.671 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 15.9 pt -69.58 -42.64 80.67 Favored 'Isoleucine or valine' 0 C--N 1.339 0.12 0 CA-C-N 119.553 1.069 . . . . 0.0 110.85 177.077 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 37.7 pt -71.03 -39.86 75.32 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.173 0 C-N-CA 119.926 -0.71 . . . . 0.0 111.13 179.8 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 79.7 m-20 -65.99 -42.31 89.98 Favored 'General case' 0 N--CA 1.454 -0.238 0 C-N-CA 122.492 0.317 . . . . 0.0 110.589 178.984 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 14.5 t80 -64.95 -45.23 86.63 Favored 'General case' 0 N--CA 1.451 -0.419 0 N-CA-C 109.566 -0.531 . . . . 0.0 109.566 178.266 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 23.7 m -63.84 -30.16 71.27 Favored 'General case' 0 N--CA 1.456 -0.156 0 N-CA-C 111.502 0.186 . . . . 0.0 111.502 -177.522 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 15.6 tpp180 -75.63 -45.07 39.44 Favored 'General case' 0 N--CA 1.453 -0.281 0 O-C-N 122.957 0.161 . . . . 0.0 110.822 -177.16 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 42.0 mt -83.71 -43.4 15.56 Favored 'General case' 0 N--CA 1.456 -0.154 0 N-CA-C 113.379 0.881 . . . . 0.0 113.379 -174.912 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 9.0 p -64.42 154.42 83.85 Favored Pre-proline 0 CA--C 1.535 0.4 0 N-CA-C 113.074 0.768 . . . . 0.0 113.074 -172.088 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 94.6 Cg_endo -74.43 171.6 17.79 Favored 'Trans proline' 0 N--CA 1.455 -0.745 0 C-N-CA 125.125 3.883 . . . . 0.0 111.824 179.806 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -43.5 -49.14 7.39 Favored 'General case' 0 CA--C 1.532 0.255 0 C-N-CA 125.909 1.684 . . . . 0.0 113.794 -174.173 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 87.9 p -70.08 -35.34 74.12 Favored 'General case' 0 N--CA 1.457 -0.118 0 O-C-N 121.967 -0.458 . . . . 0.0 110.684 -176.408 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 62.3 m170 -75.33 -24.91 57.45 Favored 'General case' 0 N--CA 1.45 -0.438 0 CA-C-O 119.28 -0.39 . . . . 0.0 110.379 178.617 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 66.3 mttm -64.61 -47.76 77.43 Favored 'General case' 0 C--N 1.342 0.251 0 N-CA-C 109.094 -0.706 . . . . 0.0 109.094 172.913 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -58.93 -43.23 91.12 Favored 'General case' 0 CA--C 1.533 0.316 0 N-CA-C 108.003 -1.11 . . . . 0.0 108.003 177.454 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -63.02 -34.84 91.05 Favored Glycine 0 CA--C 1.526 0.733 0 N-CA-C 111.146 -0.782 . . . . 0.0 111.146 -179.582 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 44.6 t -67.32 -39.18 85.84 Favored 'General case' 0 N--CA 1.452 -0.337 0 CA-C-N 117.61 0.705 . . . . 0.0 109.644 177.409 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 8.0 mp -64.27 -28.92 70.05 Favored 'General case' 0 N--CA 1.453 -0.324 0 N-CA-C 110.098 -0.334 . . . . 0.0 110.098 178.38 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 0.9 OUTLIER -69.96 -41.27 74.71 Favored 'General case' 0 CA--C 1.528 0.123 0 CA-C-N 117.784 0.265 . . . . 0.0 110.59 175.673 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 68' ' ' ILE . . . . . 0.412 HD12 ' CD1' ' A' ' 17' ' ' PHE . 8.3 mt -64.19 -48.56 85.11 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.269 0 N-CA-C 109.73 -0.471 . . . . 0.0 109.73 176.874 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 91.2 mt -57.75 -33.71 46.02 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.317 0 C-N-CA 123.129 0.572 . . . . 0.0 111.504 178.117 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 17.6 t70 -69.63 -41.84 75.11 Favored 'General case' 0 CA--C 1.521 -0.139 0 CA-C-N 119.116 0.871 . . . . 0.0 110.563 176.986 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 35.4 t -66.24 -59.6 3.58 Favored 'General case' 0 N--CA 1.45 -0.431 0 C-N-CA 122.672 0.389 . . . . 0.0 110.279 -177.381 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -75.17 -33.05 27.56 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.272 0 O-C-N 122.262 -0.274 . . . . 0.0 110.511 -177.217 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -68.33 -50.32 39.41 Favored Glycine 0 CA--C 1.524 0.613 0 N-CA-C 111.739 -0.544 . . . . 0.0 111.739 -174.119 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 41.6 mtm105 -72.13 -39.17 69.0 Favored 'General case' 0 N--CA 1.452 -0.347 0 CA-C-N 117.482 0.641 . . . . 0.0 109.753 179.061 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -62.56 -30.33 71.23 Favored 'General case' 0 N--CA 1.45 -0.461 0 C-N-CA 119.788 -0.765 . . . . 0.0 110.334 -179.611 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 1.7 m-30 -70.02 -53.46 17.49 Favored 'General case' 0 CA--C 1.518 -0.25 0 CA-C-N 118.161 0.437 . . . . 0.0 111.133 176.317 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -71.4 -32.0 67.92 Favored 'General case' 0 N--CA 1.449 -0.512 0 C-N-CA 117.751 -1.58 . . . . 0.0 109.865 -175.04 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 85.5 m-20 -68.9 -45.57 70.57 Favored 'General case' 0 N--CA 1.457 -0.096 0 CA-C-N 118.218 0.463 . . . . 0.0 112.152 179.378 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 15.7 tm-20 -65.19 -50.13 67.08 Favored 'General case' 0 N--CA 1.444 -0.727 0 C-N-CA 120.764 -0.374 . . . . 0.0 110.64 179.705 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 69.3 p -64.74 -27.11 68.68 Favored 'General case' 0 N--CA 1.454 -0.262 0 N-CA-C 111.708 0.262 . . . . 0.0 111.708 -179.242 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 32.8 ttp-105 -75.26 -30.56 60.51 Favored 'General case' 0 N--CA 1.456 -0.156 0 C-N-CA 122.806 0.442 . . . . 0.0 110.807 175.468 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 19.8 m -85.11 -24.71 27.91 Favored 'General case' 0 N--CA 1.454 -0.232 0 C-N-CA 122.894 0.478 . . . . 0.0 111.673 -179.75 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 6.7 t-20 -88.37 160.72 17.47 Favored 'General case' 0 N--CA 1.453 -0.294 0 C-N-CA 123.201 0.6 . . . . 0.0 111.242 -177.176 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 99.6 p -86.24 12.93 8.79 Favored 'General case' 0 N--CA 1.456 -0.162 0 C-N-CA 124.006 0.922 . . . . 0.0 111.29 179.818 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -60.46 147.4 41.26 Favored 'General case' 0 N--CA 1.453 -0.28 0 C-N-CA 123.248 0.619 . . . . 0.0 112.626 -175.485 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 32.9 t -163.45 150.45 12.43 Favored 'General case' 0 N--CA 1.453 -0.296 0 N-CA-C 107.892 -1.151 . . . . 0.0 107.892 176.0 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 87.1 p -160.89 150.22 16.96 Favored 'General case' 0 N--CA 1.453 -0.293 0 CA-C-O 120.887 0.375 . . . . 0.0 111.708 -177.277 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 43.0 t -71.4 -35.8 71.15 Favored 'General case' 0 N--CA 1.455 -0.198 0 N-CA-C 108.937 -0.764 . . . . 0.0 108.937 175.812 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 8.0 p-10 -75.76 167.53 21.71 Favored 'General case' 0 N--CA 1.452 -0.373 0 N-CA-C 108.416 -0.957 . . . . 0.0 108.416 172.138 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 90' ' ' LYS . . . . . 0.581 ' H ' ' CD ' ' A' ' 91' ' ' PRO . 43.2 mmtm -124.3 -34.31 0.04 OUTLIER Pre-proline 0 N--CA 1.454 -0.239 0 CA-C-O 118.235 -0.888 . . . . 0.0 111.267 178.507 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 91' ' ' PRO . . . . . 0.581 ' CD ' ' H ' ' A' ' 90' ' ' LYS . 31.2 Cg_exo -61.91 150.45 86.14 Favored 'Trans proline' 0 N--CA 1.451 -1.022 0 C-N-CA 122.269 1.979 . . . . 0.0 109.368 167.268 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 83.6 13.81 74.9 Favored Glycine 0 CA--C 1.528 0.871 0 N-CA-C 111.65 -0.58 . . . . 0.0 111.65 -177.088 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -153.52 165.23 36.53 Favored 'General case' 0 N--CA 1.454 -0.245 0 C-N-CA 124.534 1.134 . . . . 0.0 109.469 -179.845 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 94' ' ' CYS . . . . . . . . . . . . . 29.4 p -56.22 -21.35 22.76 Favored 'General case' 0 N--CA 1.453 -0.305 0 C-N-CA 123.519 0.728 . . . . 0.0 110.925 177.323 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -58.31 -63.44 1.27 Allowed 'General case' 0 N--CA 1.447 -0.616 0 O-C-N 122.297 -0.252 . . . . 0.0 110.327 -176.111 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 76.8 t60 -71.62 -33.28 68.83 Favored 'General case' 0 N--CA 1.451 -0.418 0 CA-C-N 117.609 0.186 . . . . 0.0 110.514 -179.489 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -62.75 -52.78 61.89 Favored 'General case' 0 N--CA 1.451 -0.388 0 O-C-N 123.229 0.331 . . . . 0.0 111.535 -176.837 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 1.8 mp -71.82 -36.11 57.31 Favored 'Isoleucine or valine' 0 C--N 1.338 0.097 0 C-N-CA 121.001 -0.28 . . . . 0.0 110.75 -178.69 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 24.4 m-80 -69.02 -38.51 79.25 Favored 'General case' 0 N--CA 1.455 -0.2 0 CA-C-N 118.442 0.565 . . . . 0.0 111.736 -179.996 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 99.6 m -73.37 -33.68 65.18 Favored 'General case' 0 N--CA 1.456 -0.143 0 CA-C-N 118.422 0.555 . . . . 0.0 110.449 -178.98 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 62.6 tp -75.29 -37.56 60.79 Favored 'General case' 0 N--CA 1.449 -0.489 0 N-CA-C 110.317 -0.253 . . . . 0.0 110.317 179.707 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -61.96 -22.75 62.83 Favored Glycine 0 CA--C 1.527 0.81 0 CA-C-O 119.448 -0.64 . . . . 0.0 113.138 -173.752 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 13.7 mm-40 -80.14 -39.32 29.67 Favored 'General case' 0 N--CA 1.452 -0.36 0 CA-C-N 117.702 0.751 . . . . 0.0 112.403 -179.939 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 21.7 m -100.61 -14.77 7.8 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.092 0 N-CA-C 112.992 0.738 . . . . 0.0 112.992 -175.746 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 105' ' ' ILE . . . . . . . . . . . . . 9.8 tp -63.5 -26.8 41.62 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.206 0 CA-C-N 118.511 0.596 . . . . 0.0 111.206 -177.458 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 106' ' ' GLN . . . . . 0.436 ' HA ' ' CD1' ' A' ' 145' ' ' ILE . 20.3 pt20 -66.27 -29.85 70.17 Favored 'General case' 0 N--CA 1.452 -0.361 0 O-C-N 122.006 -0.434 . . . . 0.0 111.039 -179.937 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 84.0 mt-10 -73.74 -40.7 63.34 Favored 'General case' 0 N--CA 1.453 -0.31 0 N-CA-C 109.511 -0.552 . . . . 0.0 109.511 177.395 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 66.1 mt -74.96 -35.94 62.08 Favored 'General case' 0 N--CA 1.451 -0.405 0 C-N-CA 122.996 0.518 . . . . 0.0 111.343 -174.853 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 92.7 mt -70.54 -52.71 19.84 Favored 'General case' 0 N--CA 1.452 -0.341 0 N-CA-C 109.583 -0.525 . . . . 0.0 109.583 177.163 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 13.1 t -59.26 -37.43 77.6 Favored 'General case' 0 N--CA 1.453 -0.276 0 CA-C-N 117.749 0.249 . . . . 0.0 111.034 -178.153 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 36.9 t0 -62.87 -45.75 91.1 Favored 'General case' 0 N--CA 1.454 -0.267 0 N-CA-C 108.883 -0.784 . . . . 0.0 108.883 174.59 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -65.7 -30.36 71.03 Favored 'General case' 0 N--CA 1.448 -0.569 0 CA-C-O 118.959 -0.543 . . . . 0.0 110.837 -176.538 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 113' ' ' ILE . . . . . . . . . . . . . 49.6 mm -68.19 -50.78 54.91 Favored 'Isoleucine or valine' 0 C--N 1.34 0.156 0 CA-C-N 119.073 0.851 . . . . 0.0 109.56 177.647 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -69.63 -41.29 75.82 Favored 'General case' 0 N--CA 1.449 -0.501 0 O-C-N 123.03 0.207 . . . . 0.0 111.088 -175.381 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 115' ' ' LYS . . . . . 0.58 ' HE2' ' HA ' ' A' ' 115' ' ' LYS . 0.6 OUTLIER -75.61 -40.42 56.4 Favored 'General case' 0 N--CA 1.45 -0.429 0 N-CA-C 113.977 1.103 . . . . 0.0 113.977 -176.521 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 116' ' ' SER . . . . . 0.437 ' HB3' ' CB ' ' A' ' 120' ' ' HIS . 2.4 m -80.53 157.33 26.14 Favored 'General case' 0 CA--C 1.53 0.188 0 C-N-CA 120.181 -0.608 . . . . 0.0 112.539 -169.156 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 62.9 t30 -72.74 171.35 12.76 Favored 'General case' 0 CA--C 1.531 0.213 0 C-N-CA 124.05 0.94 . . . . 0.0 111.887 -174.845 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 118' ' ' GLN . . . . . . . . . . . . . 53.6 mt-30 -51.4 -44.3 62.18 Favored 'General case' 0 C--O 1.231 0.115 0 C-N-CA 123.615 0.766 . . . . 0.0 111.553 -176.826 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 22.5 t0 -65.97 -33.04 74.9 Favored 'General case' 0 N--CA 1.454 -0.234 0 CA-C-O 121.469 0.652 . . . . 0.0 109.975 -179.717 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 120' ' ' HIS . . . . . 0.437 ' CB ' ' HB3' ' A' ' 116' ' ' SER . 21.9 m170 -75.98 -45.88 32.5 Favored 'General case' 0 N--CA 1.447 -0.576 0 CA-C-N 115.746 -0.661 . . . . 0.0 110.342 -178.824 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 52.8 mttm -57.7 -37.77 74.07 Favored 'General case' 0 C--N 1.341 0.234 0 N-CA-C 108.856 -0.794 . . . . 0.0 108.856 179.792 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 7.0 tm-20 -62.48 -51.99 65.29 Favored 'General case' 0 N--CA 1.452 -0.373 0 C-N-CA 122.251 0.221 . . . . 0.0 110.758 179.004 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 3.1 mtmm -64.77 -27.12 68.68 Favored 'General case' 0 N--CA 1.454 -0.226 0 CA-C-N 116.761 -0.2 . . . . 0.0 111.244 179.866 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 124' ' ' ILE . . . . . . . . . . . . . 54.6 mt -74.81 -39.65 45.81 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.242 0 O-C-N 121.576 -0.702 . . . . 0.0 109.517 175.706 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 7.2 mmm180 -59.79 -41.5 91.3 Favored 'General case' 0 N--CA 1.454 -0.271 0 CA-C-O 119.073 -0.489 . . . . 0.0 111.09 178.584 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 126' ' ' MET . . . . . . . . . . . . . 28.1 ptm -66.23 -39.98 89.93 Favored 'General case' 0 N--CA 1.449 -0.48 0 C-N-CA 118.542 -1.263 . . . . 0.0 108.409 176.663 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 4.0 mp -62.29 -36.95 83.7 Favored 'General case' 0 N--CA 1.456 -0.174 0 CA-C-N 118.839 0.745 . . . . 0.0 111.549 179.845 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 93.2 mt -67.61 -42.94 81.58 Favored 'General case' 0 N--CA 1.457 -0.099 0 CA-C-N 118.551 0.614 . . . . 0.0 110.325 178.598 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 27.6 m-20 -69.73 -32.4 70.93 Favored 'General case' 0 N--CA 1.454 -0.261 0 N-CA-C 110.045 -0.354 . . . . 0.0 110.045 178.946 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 130' ' ' ILE . . . . . 0.424 ' HA ' ' HD3' ' A' ' 133' ' ' ARG . 34.5 mt -61.98 -39.76 84.82 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.286 0 N-CA-C 109.885 -0.413 . . . . 0.0 109.885 176.641 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 131' ' ' TRP . . . . . . . . . . . . . 32.3 m0 -74.69 -30.84 61.71 Favored 'General case' 0 N--CA 1.453 -0.302 0 C-N-CA 120.372 -0.531 . . . . 0.0 112.084 -179.779 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 66.3 m-20 -75.55 -28.78 59.18 Favored 'General case' 0 CA--C 1.534 0.341 0 CA-C-N 117.961 0.346 . . . . 0.0 111.128 177.912 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 133' ' ' ARG . . . . . 0.431 HH21 ' C ' ' B' 2063 ' ' SER . 24.6 mtp180 -72.89 -36.61 67.36 Favored 'General case' 0 C--N 1.34 0.166 0 N-CA-C 110.055 -0.35 . . . . 0.0 110.055 175.018 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 47.5 m -75.15 -7.97 55.27 Favored 'General case' 0 N--CA 1.453 -0.292 0 C-N-CA 123.39 0.676 . . . . 0.0 112.306 -176.45 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 135' ' ' GLY . . . . . . . . . . . . . . . 87.62 11.71 68.05 Favored Glycine 0 CA--C 1.527 0.824 0 CA-C-O 119.17 -0.794 . . . . 0.0 113.229 175.898 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 136' ' ' LEU . . . . . . . . . . . . . 6.7 mp -75.77 46.21 0.36 Allowed 'General case' 0 CA--C 1.532 0.267 0 CA-C-N 118.351 1.076 . . . . 0.0 110.553 178.497 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 137' ' ' PHE . . . . . . . . . . . . . 69.4 m-85 -71.96 -2.26 17.47 Favored 'General case' 0 CA--C 1.529 0.161 0 O-C-N 121.85 -0.531 . . . . 0.0 112.281 -179.534 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 138' ' ' GLN . . . . . . . . . . . . . 17.7 mp0 -75.62 -14.92 60.39 Favored 'General case' 0 CA--C 1.53 0.199 0 CA-C-N 118.385 0.539 . . . . 0.0 110.971 -178.585 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 139' ' ' LYS . . . . . . . . . . . . . 23.7 pttm -79.95 163.62 24.14 Favored 'General case' 0 N--CA 1.454 -0.25 0 N-CA-C 109.407 -0.59 . . . . 0.0 109.407 175.271 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 140' ' ' SER . . . . . . . . . . . . . 30.2 t -66.91 134.99 53.14 Favored 'General case' 0 N--CA 1.454 -0.252 0 N-CA-C 109.127 -0.694 . . . . 0.0 109.127 173.054 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 141' ' ' TYR . . . . . . . . . . . . . 39.1 p90 -132.8 22.74 4.24 Favored 'General case' 0 C--O 1.231 0.089 0 C-N-CA 122.93 0.492 . . . . 0.0 110.687 -176.898 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 142' ' ' LEU . . . . . . . . . . . . . 79.6 mt -60.44 167.93 2.34 Favored 'General case' 0 N--CA 1.454 -0.265 0 CA-C-O 121.433 0.635 . . . . 0.0 111.145 -179.709 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 74.0 m-20 -59.59 -14.56 13.87 Favored 'General case' 0 N--CA 1.455 -0.205 0 N-CA-C 112.392 0.516 . . . . 0.0 112.392 -178.444 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . -66.02 -27.5 68.16 Favored 'General case' 0 N--CA 1.451 -0.413 0 C-N-CA 122.494 0.318 . . . . 0.0 111.354 178.396 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 145' ' ' ILE . . . . . 0.436 ' CD1' ' HA ' ' A' ' 106' ' ' GLN . 39.1 mm -69.98 -49.0 59.77 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.203 0 CA-C-N 117.621 0.192 . . . . 0.0 111.164 -179.782 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 146' ' ' ARG . . . . . . . . . . . . . 6.2 mpt_? -75.35 -26.42 58.55 Favored 'General case' 0 N--CA 1.454 -0.241 0 N-CA-C 109.071 -0.714 . . . . 0.0 109.071 176.802 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 147' ' ' SER . . . . . . . . . . . . . 32.0 p 57.97 0.05 0.11 Allowed 'General case' 0 C--N 1.341 0.234 0 C-N-CA 126.425 1.89 . . . . 0.0 115.978 171.502 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 33.7 mmtt 50.63 -88.26 0.01 OUTLIER 'General case' 0 CA--C 1.532 0.275 0 C-N-CA 125.561 1.544 . . . . 0.0 113.053 175.626 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 149' ' ' CYS . . . . . . . . . . . . . 48.6 t -66.17 -35.25 79.96 Favored 'General case' 0 N--CA 1.452 -0.328 0 N-CA-C 112.034 0.383 . . . . 0.0 112.034 -172.482 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 150' ' ' PHE . . . . . . . . . . . . . 95.3 m-85 -75.15 -13.43 60.47 Favored 'General case' 0 N--CA 1.452 -0.351 0 CA-C-N 118.05 0.386 . . . . 0.0 111.325 -178.807 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 151' ' ' ALA . . . . . . . . . . . . . . . -93.0 -37.4 12.21 Favored 'General case' 0 N--CA 1.451 -0.387 0 N-CA-C 110.311 -0.255 . . . . 0.0 110.311 172.834 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 152' ' ' MET . . . . . . . . . . . . . 93.5 mtp -79.35 -10.27 59.77 Favored 'General case' 0 N--CA 1.454 -0.257 0 C-N-CA 123.346 0.658 . . . . 0.0 112.109 178.902 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 153' ' ' ASP . . . . . . . . . . . . . 42.3 p-10 -51.9 -36.71 49.78 Favored 'General case' 0 CA--C 1.529 0.152 0 C-N-CA 123.416 0.686 . . . . 0.0 112.446 -174.691 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 154' ' ' LEU . . . . . . . . . . . . . 76.5 mt -138.5 37.35 2.25 Favored 'General case' 0 C--O 1.231 0.12 0 C-N-CA 124.216 1.006 . . . . 0.0 110.94 -178.735 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 155' ' ' GLU . . . . . . . . . . . . . 25.3 pt-20 -68.21 163.75 22.05 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-O 121.421 0.629 . . . . 0.0 111.467 -177.804 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 156' ' ' HIS . . . . . . . . . . . . . 92.1 m-70 -72.72 162.11 29.9 Favored 'General case' 0 N--CA 1.452 -0.342 0 CA-C-N 115.784 -0.644 . . . . 0.0 110.73 178.808 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 157' ' ' HIS . . . . . . . . . . . . . 32.2 p-80 -68.0 152.15 45.98 Favored 'General case' 0 N--CA 1.453 -0.278 0 C-N-CA 122.879 0.471 . . . . 0.0 110.691 -179.449 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 158' ' ' HIS . . . . . . . . . . . . . 88.9 m-70 -109.37 -0.41 19.03 Favored 'General case' 0 CA--C 1.529 0.153 0 C-N-CA 122.997 0.519 . . . . 0.0 111.688 -179.854 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 159' ' ' HIS . . . . . . . . . . . . . 42.0 m170 . . . . . 0 C--O 1.25 1.127 0 CA-C-O 117.353 -1.308 . . . . 0.0 109.905 -177.01 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' B' B 2052 ' ' ASP . . . . . . . . . . . . . 23.1 p-10 . . . . . 0 N--CA 1.472 0.649 0 N-CA-C 109.668 -0.493 . . . . 0.0 109.668 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' B' B 2053 ' ' ASP . . . . . . . . . . . . . 68.0 m-20 -145.64 153.77 41.4 Favored 'General case' 0 N--CA 1.454 -0.269 0 C-N-CA 124.454 1.102 . . . . 0.0 109.961 178.822 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B 2054 ' ' ASP . . . . . . . . . . . . . 50.4 t0 -155.76 -169.59 3.15 Favored 'General case' 0 N--CA 1.452 -0.363 0 N-CA-C 107.735 -1.209 . . . . 0.0 107.735 -179.761 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B 2055 ' ' GLU . . . . . . . . . . . . . 12.0 pt-20 -65.83 -8.04 19.54 Favored 'General case' 0 CA--C 1.534 0.349 0 O-C-N 121.934 -0.479 . . . . 0.0 110.087 173.006 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B 2056 ' ' ASP . . . . . . . . . . . . . 51.8 m-20 48.91 15.05 0.09 Allowed 'General case' 0 CA--C 1.533 0.326 0 C-N-CA 126.651 1.98 . . . . 0.0 115.505 173.638 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B 2057 ' ' ASP . . . . . . . . . . . . . 40.6 t0 -152.04 170.64 19.41 Favored 'General case' 0 N--CA 1.454 -0.26 0 CA-C-N 118.761 0.71 . . . . 0.0 109.963 177.56 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B 2058 ' ' TYR . . . . . . . . . . . . . 0.7 OUTLIER -160.74 140.84 11.18 Favored 'General case' 0 N--CA 1.452 -0.37 0 C-N-CA 123.811 0.844 . . . . 0.0 109.286 -178.23 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B 2059 ' ' THR . . . . . . . . . . . . . 92.4 m -107.61 126.84 28.99 Favored Pre-proline 0 CA--C 1.529 0.172 0 N-CA-C 109.687 -0.486 . . . . 0.0 109.687 -179.293 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B 2060 ' ' PRO . . . . . . . . . . . . . 91.2 Cg_endo -72.99 -16.1 25.83 Favored 'Trans proline' 0 N--CA 1.454 -0.846 0 C-N-CA 124.124 3.216 . . . . 0.0 113.159 -175.963 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B 2061 ' ' SER . . . . . . . . . . . . . 37.5 t 51.51 35.15 13.73 Favored 'General case' 0 CA--C 1.53 0.209 0 C-N-CA 123.523 0.729 . . . . 0.0 111.972 -179.057 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B 2062 ' ' ILE . . . . . . . . . . . . . 5.8 tp -76.27 132.85 32.27 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.259 0 N-CA-C 114.225 1.194 . . . . 0.0 114.225 -172.356 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B 2063 ' ' SER . . . . . 0.431 ' C ' HH21 ' A' ' 133' ' ' ARG . 83.5 p . . . . . 0 C--O 1.254 1.342 0 CA-C-O 117.549 -1.215 . . . . 0.0 109.371 172.918 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 64.1 mtt . . . . . 0 N--CA 1.474 0.742 0 CA-C-O 120.573 0.225 . . . . 0.0 110.527 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 4.2 pm0 -153.19 157.71 40.68 Favored 'General case' 0 N--CA 1.456 -0.15 0 N-CA-C 109.328 -0.619 . . . . 0.0 109.328 -179.215 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 37.4 mm-40 -128.19 4.4 5.8 Favored 'General case' 0 CA--C 1.529 0.171 0 C-N-CA 123.053 0.541 . . . . 0.0 111.454 -177.759 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 6.1 m-20 -71.14 127.93 34.21 Favored 'General case' 0 N--CA 1.452 -0.34 0 N-CA-C 109.476 -0.564 . . . . 0.0 109.476 179.161 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 25.0 m-20 47.63 34.66 3.77 Favored 'General case' 0 CA--C 1.532 0.261 0 C-N-CA 123.211 0.605 . . . . 0.0 111.388 -176.546 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 21.3 p-10 -53.69 -49.71 67.43 Favored 'General case' 0 CA--C 1.518 -0.28 0 C-N-CA 123.129 0.572 . . . . 0.0 111.678 -172.718 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 7' ' ' PHE . . . . . 0.481 ' HB2' ' HZ3' ' A' ' 45' ' ' LYS . 0.6 OUTLIER -75.65 -41.58 53.7 Favored 'General case' 0 N--CA 1.441 -0.905 0 C-N-CA 120.356 -0.538 . . . . 0.0 111.534 -170.501 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 52.2 tp60 -52.52 -36.57 55.62 Favored 'General case' 0 N--CA 1.453 -0.298 0 N-CA-C 112.169 0.433 . . . . 0.0 112.169 -176.179 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 54.2 m-80 -71.74 -35.64 70.2 Favored 'General case' 0 N--CA 1.453 -0.291 0 C-N-CA 120.541 -0.463 . . . . 0.0 110.139 179.391 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 10' ' ' PHE . . . . . 0.416 ' CZ ' HG12 ' A' ' 46' ' ' ILE . 1.9 t80 -71.99 -37.49 69.84 Favored 'General case' 0 N--CA 1.451 -0.394 0 C-N-CA 123.011 0.524 . . . . 0.0 110.891 178.987 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 99.3 t -65.79 -57.3 11.23 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.337 0 N-CA-C 108.625 -0.88 . . . . 0.0 108.625 179.6 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -59.06 -31.35 68.79 Favored 'General case' 0 N--CA 1.453 -0.284 0 C-N-CA 122.894 0.477 . . . . 0.0 112.021 -177.246 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 79.2 m -70.31 -39.36 74.85 Favored 'General case' 0 N--CA 1.456 -0.144 0 CA-C-N 118.723 0.692 . . . . 0.0 109.588 176.707 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . 0.433 ' HA ' ' CD1' ' A' ' 17' ' ' PHE . 2.8 tp -70.15 -39.66 75.24 Favored 'General case' 0 N--CA 1.453 -0.285 0 CA-C-O 121.169 0.509 . . . . 0.0 110.489 -179.479 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . 0.404 ' CD ' ' HZ1' ' A' ' 18' ' ' LYS . 61.7 mm-40 -64.07 -29.69 70.81 Favored 'General case' 0 N--CA 1.45 -0.431 0 N-CA-C 108.872 -0.788 . . . . 0.0 108.872 177.617 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 32.3 t -71.59 -29.18 64.41 Favored 'General case' 0 N--CA 1.45 -0.455 0 CA-C-O 119.476 -0.297 . . . . 0.0 110.427 177.306 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 17' ' ' PHE . . . . . 0.433 ' CD1' ' HA ' ' A' ' 14' ' ' LEU . 27.3 m-85 -67.6 -36.66 81.29 Favored 'General case' 0 C--N 1.342 0.253 0 CA-C-N 118.508 0.595 . . . . 0.0 110.845 172.503 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . 0.488 ' HG2' ' CE1' ' A' ' 53' ' ' TYR . 61.2 mttt -61.49 -37.72 84.66 Favored 'General case' 0 C--N 1.341 0.202 0 C-N-CA 120.088 -0.645 . . . . 0.0 109.367 176.643 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 39.1 t0 -81.07 -18.87 45.13 Favored 'General case' 0 CA--C 1.534 0.331 0 N-CA-C 113.176 0.806 . . . . 0.0 113.176 -178.908 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 1.4 mt -64.8 -7.51 11.38 Favored 'General case' 0 C--O 1.227 -0.1 0 CA-C-O 118.439 -0.791 . . . . 0.0 112.816 178.722 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 36.0 mmtm 64.19 -48.08 0.29 Allowed 'General case' 0 CA--C 1.528 0.111 0 C-N-CA 126.506 1.923 . . . . 0.0 112.547 179.602 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 53.3 m -85.74 -13.26 48.9 Favored 'General case' 0 N--CA 1.451 -0.418 0 C-N-CA 123.186 0.594 . . . . 0.0 110.861 174.309 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 79.31 -34.33 1.99 Allowed Glycine 0 CA--C 1.527 0.834 0 C-N-CA 124.45 1.024 . . . . 0.0 113.16 175.553 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 93.9 mt -80.45 146.15 8.02 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.252 0 CA-C-N 118.025 0.912 . . . . 0.0 111.401 -178.933 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 35.1 t -169.02 97.68 0.36 Allowed 'General case' 0 CA--C 1.517 -0.326 0 N-CA-C 108.274 -1.01 . . . . 0.0 108.274 173.438 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -53.41 -34.72 49.22 Favored Glycine 0 CA--C 1.526 0.742 0 CA-C-O 119.405 -0.664 . . . . 0.0 111.672 -176.518 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 98.4 p -66.6 -49.92 64.74 Favored 'General case' 0 N--CA 1.456 -0.157 0 CA-C-N 118.255 1.027 . . . . 0.0 110.432 -178.261 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . 0.418 HH22 ' CB ' ' B' 2053 ' ' ASP . 33.8 mtm180 -73.83 -34.9 64.75 Favored 'General case' 0 C--O 1.231 0.127 0 C-N-CA 122.383 0.273 . . . . 0.0 110.788 -179.077 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 59.7 mt -58.79 -50.44 79.32 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.467 0 N-CA-C 109.228 -0.656 . . . . 0.0 109.228 174.55 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 70.9 mttt -64.47 -28.73 69.87 Favored 'General case' 0 CA--C 1.529 0.141 0 CA-C-O 118.904 -0.569 . . . . 0.0 111.43 178.773 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . 0.433 ' HA ' ' CE ' ' A' ' 31' ' ' LYS . 3.4 mmpt? -63.41 -58.88 5.65 Favored 'General case' 0 N--CA 1.457 -0.083 0 CA-C-N 118.624 0.647 . . . . 0.0 111.205 179.124 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . 0.407 HD23 ' CE1' ' A' ' 10' ' ' PHE . 1.4 pp -75.78 -18.42 59.53 Favored 'General case' 0 N--CA 1.454 -0.256 0 C-N-CA 118.732 -1.187 . . . . 0.0 111.739 -178.714 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 38.6 m -70.76 -41.49 71.68 Favored 'General case' 0 N--CA 1.455 -0.201 0 N-CA-C 108.664 -0.865 . . . . 0.0 108.664 175.931 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 98.2 m -69.54 -38.31 77.43 Favored 'General case' 0 N--CA 1.45 -0.46 0 CA-C-N 116.459 -0.337 . . . . 0.0 110.441 -178.188 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 26.6 t80 -69.89 -29.81 67.1 Favored 'General case' 0 N--CA 1.454 -0.259 0 C-N-CA 119.826 -0.75 . . . . 0.0 110.899 178.369 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -68.94 -32.15 71.55 Favored 'General case' 0 N--CA 1.448 -0.571 0 N-CA-C 110.313 -0.254 . . . . 0.0 110.313 176.53 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -76.98 -34.26 57.56 Favored 'General case' 0 N--CA 1.456 -0.154 0 N-CA-C 110.173 -0.306 . . . . 0.0 110.173 174.171 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 40.4 t0 -60.55 -24.81 65.7 Favored 'General case' 0 CA--C 1.531 0.229 0 C-N-CA 122.926 0.49 . . . . 0.0 110.563 175.547 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 27.3 m-70 -158.32 110.19 2.25 Favored 'General case' 0 N--CA 1.455 -0.193 0 C-N-CA 123.374 0.67 . . . . 0.0 111.28 172.691 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 40' ' ' ILE . . . . . 0.529 ' H ' HD13 ' A' ' 40' ' ' ILE . 0.0 OUTLIER -77.35 -11.39 13.59 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.385 0 N-CA-C 109.626 -0.509 . . . . 0.0 109.626 173.45 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 48.0 m-20 -59.33 -19.91 50.28 Favored 'General case' 0 CA--C 1.532 0.264 0 C-N-CA 122.987 0.515 . . . . 0.0 111.87 -177.916 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -102.95 13.36 6.93 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.195 0 C-N-CA 123.068 0.547 . . . . 0.0 111.848 176.576 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 3.0 pp20? -52.78 -32.01 41.51 Favored 'General case' 0 CA--C 1.527 0.093 0 O-C-N 121.613 -0.679 . . . . 0.0 112.096 -179.659 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 48.2 t -61.99 -48.86 78.46 Favored 'General case' 0 N--CA 1.455 -0.199 0 O-C-N 122.172 -0.33 . . . . 0.0 111.563 -176.113 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . 0.481 ' HZ3' ' HB2' ' A' ' 7' ' ' PHE . 19.6 ptpt -71.9 -24.66 61.69 Favored 'General case' 0 C--N 1.34 0.156 0 O-C-N 121.857 -0.527 . . . . 0.0 109.837 179.764 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 46' ' ' ILE . . . . . 0.416 HG12 ' CZ ' ' A' ' 10' ' ' PHE . 89.6 mt -71.87 -46.0 62.51 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.263 0 C-N-CA 122.763 0.425 . . . . 0.0 110.427 -179.393 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 33.9 mm -63.99 -35.67 74.26 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.224 0 N-CA-C 109.478 -0.564 . . . . 0.0 109.478 178.058 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 13.3 t -63.25 -41.6 99.08 Favored 'General case' 0 N--CA 1.453 -0.319 0 C-N-CA 119.644 -0.822 . . . . 0.0 110.36 177.801 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 4.4 mp -67.99 -37.13 81.12 Favored 'General case' 0 N--CA 1.454 -0.272 0 CA-C-O 118.791 -0.623 . . . . 0.0 112.172 -176.202 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 15.6 pt -69.33 -41.54 80.98 Favored 'Isoleucine or valine' 0 C--O 1.23 0.076 0 CA-C-N 119.168 0.895 . . . . 0.0 110.597 179.901 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 27.5 pt -71.48 -39.75 71.3 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.178 0 C-N-CA 120.084 -0.647 . . . . 0.0 110.646 179.164 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 90.1 m-20 -68.19 -41.67 81.05 Favored 'General case' 0 N--CA 1.452 -0.33 0 CA-C-N 118.1 0.409 . . . . 0.0 112.002 -179.93 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 53' ' ' TYR . . . . . 0.488 ' CE1' ' HG2' ' A' ' 18' ' ' LYS . 8.5 t80 -67.1 -47.04 72.42 Favored 'General case' 0 N--CA 1.453 -0.292 0 N-CA-C 109.202 -0.666 . . . . 0.0 109.202 178.512 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 39.8 t -65.19 -28.16 69.2 Favored 'General case' 0 N--CA 1.453 -0.288 0 N-CA-C 111.589 0.218 . . . . 0.0 111.589 -178.052 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 55.7 ttp85 -75.48 -41.46 55.44 Favored 'General case' 0 N--CA 1.454 -0.232 0 C-N-CA 123.405 0.682 . . . . 0.0 112.251 -179.078 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 46.8 mt -86.98 -43.54 12.28 Favored 'General case' 0 C--O 1.227 -0.111 0 N-CA-C 112.541 0.571 . . . . 0.0 112.541 -176.448 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 8.2 p -66.48 156.8 84.83 Favored Pre-proline 0 CA--C 1.538 0.486 0 N-CA-C 113.416 0.895 . . . . 0.0 113.416 -172.666 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 87.2 Cg_endo -73.49 173.3 14.06 Favored 'Trans proline' 0 N--CA 1.456 -0.711 0 C-N-CA 124.707 3.605 . . . . 0.0 111.048 178.887 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -51.78 -42.78 62.68 Favored 'General case' 0 CA--C 1.53 0.197 0 N-CA-C 113.581 0.956 . . . . 0.0 113.581 -172.96 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 51.0 m -66.88 -40.39 87.78 Favored 'General case' 0 N--CA 1.455 -0.189 0 CA-C-N 118.076 0.398 . . . . 0.0 110.283 -177.006 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 39.9 m170 -75.78 -24.11 55.97 Favored 'General case' 0 N--CA 1.45 -0.44 0 N-CA-C 109.89 -0.411 . . . . 0.0 109.89 177.272 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 19.7 ttmm -73.61 -34.02 64.86 Favored 'General case' 0 N--CA 1.454 -0.257 0 C-N-CA 123.744 0.817 . . . . 0.0 109.595 178.51 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -66.54 -45.18 80.28 Favored 'General case' 0 CA--C 1.53 0.186 0 N-CA-C 107.334 -1.358 . . . . 0.0 107.334 172.719 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -64.96 -30.45 78.04 Favored Glycine 0 C--N 1.34 0.768 0 N-CA-C 111.193 -0.763 . . . . 0.0 111.193 179.241 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 59.4 m -67.54 -40.63 85.02 Favored 'General case' 0 N--CA 1.454 -0.255 0 N-CA-C 109.419 -0.586 . . . . 0.0 109.419 177.649 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 59.6 mt -70.82 -24.05 62.47 Favored 'General case' 0 N--CA 1.452 -0.326 0 N-CA-C 110.187 -0.301 . . . . 0.0 110.187 178.885 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -72.43 -37.91 68.47 Favored 'General case' 0 C--O 1.231 0.101 0 CA-C-N 117.932 0.333 . . . . 0.0 110.105 175.421 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 68' ' ' ILE . . . . . 0.427 HD11 ' CD1' ' A' ' 17' ' ' PHE . 18.2 mt -68.48 -44.94 82.79 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.342 0 N-CA-C 109.114 -0.699 . . . . 0.0 109.114 176.609 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 76.2 mt -58.34 -32.01 44.06 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.114 0 C-N-CA 123.156 0.582 . . . . 0.0 110.748 175.791 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 19.7 t70 -69.57 -47.11 64.72 Favored 'General case' 0 N--CA 1.454 -0.263 0 CA-C-N 117.967 0.349 . . . . 0.0 111.325 179.696 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 99.2 p -71.59 -47.35 55.38 Favored 'General case' 0 N--CA 1.449 -0.503 0 C-N-CA 121.092 -0.243 . . . . 0.0 110.73 -176.538 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -75.66 -34.04 27.88 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.28 0 N-CA-C 109.879 -0.415 . . . . 0.0 109.879 -178.539 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -66.23 -52.41 36.5 Favored Glycine 0 C--N 1.334 0.466 0 N-CA-C 111.248 -0.741 . . . . 0.0 111.248 -175.745 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 44.5 mtm105 -71.46 -38.65 71.26 Favored 'General case' 0 N--CA 1.451 -0.408 0 CA-C-O 119.168 -0.444 . . . . 0.0 110.767 -179.926 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -63.16 -30.94 71.99 Favored 'General case' 0 N--CA 1.451 -0.401 0 C-N-CA 119.763 -0.775 . . . . 0.0 109.972 -179.231 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 1.8 m-30 -69.76 -52.14 27.94 Favored 'General case' 0 N--CA 1.454 -0.234 0 CA-C-O 119.265 -0.398 . . . . 0.0 110.965 176.473 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 8.0 tt -70.28 -45.53 66.17 Favored 'General case' 0 N--CA 1.448 -0.547 0 C-N-CA 117.328 -1.749 . . . . 0.0 109.458 -176.474 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 91.0 m-20 -56.96 -47.64 80.25 Favored 'General case' 0 N--CA 1.455 -0.189 0 CA-C-O 119.17 -0.443 . . . . 0.0 111.795 -176.244 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 75.5 mm-40 -70.41 -41.38 73.05 Favored 'General case' 0 N--CA 1.455 -0.22 0 CA-C-N 118.498 0.59 . . . . 0.0 111.902 -179.614 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 80.9 p -72.38 -28.14 62.82 Favored 'General case' 0 CA--C 1.529 0.148 0 CA-C-N 118.804 0.729 . . . . 0.0 111.574 -179.429 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 5.7 tmm_? -82.48 -35.05 27.79 Favored 'General case' 0 N--CA 1.457 -0.09 0 C-N-CA 123.22 0.608 . . . . 0.0 111.48 179.372 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 40.0 t -90.47 -34.68 15.49 Favored 'General case' 0 N--CA 1.457 -0.082 0 N-CA-C 113.086 0.773 . . . . 0.0 113.086 -179.326 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 28.7 m-20 -134.03 174.95 9.93 Favored 'General case' 0 N--CA 1.452 -0.338 0 CA-C-O 121.251 0.548 . . . . 0.0 112.346 -167.729 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 44.6 t -65.42 157.33 29.68 Favored 'General case' 0 N--CA 1.455 -0.192 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.324 178.9 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 8.8 p30 -154.77 -172.51 4.22 Favored 'General case' 0 N--CA 1.453 -0.284 0 N-CA-C 109.359 -0.608 . . . . 0.0 109.359 -176.553 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 38.5 t -59.66 -16.84 29.24 Favored 'General case' 0 CA--C 1.532 0.27 0 C-N-CA 123.125 0.57 . . . . 0.0 112.0 -176.396 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 33.7 t 52.85 29.14 7.25 Favored 'General case' 0 CA--C 1.532 0.285 0 N-CA-C 113.389 0.885 . . . . 0.0 113.389 174.919 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 43.2 t -65.39 162.7 17.16 Favored 'General case' 0 N--CA 1.453 -0.302 0 C-N-CA 122.596 0.358 . . . . 0.0 111.123 -179.963 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 72.1 m-20 -65.79 -34.21 77.64 Favored 'General case' 0 N--CA 1.454 -0.266 0 C-N-CA 122.533 0.333 . . . . 0.0 111.735 -175.827 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 90' ' ' LYS . . . . . 0.418 ' HB3' ' CD ' ' A' ' 91' ' ' PRO . 55.1 tptt -161.06 -67.63 0.02 OUTLIER Pre-proline 0 CA--C 1.535 0.396 0 CA-C-O 117.861 -1.066 . . . . 0.0 111.187 176.47 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 91' ' ' PRO . . . . . 0.418 ' CD ' ' HB3' ' A' ' 90' ' ' LYS . 83.7 Cg_endo -73.32 152.93 50.39 Favored 'Trans proline' 0 N--CA 1.453 -0.877 0 C-N-CA 122.523 2.148 . . . . 0.0 108.94 174.819 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 88.64 15.33 60.05 Favored Glycine 0 CA--C 1.526 0.762 0 C-N-CA 121.186 -0.53 . . . . 0.0 112.175 -177.753 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -152.48 164.35 37.75 Favored 'General case' 0 N--CA 1.455 -0.187 0 C-N-CA 124.025 0.93 . . . . 0.0 110.042 179.679 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 94' ' ' CYS . . . . . 0.4 ' SG ' HD12 ' A' ' 98' ' ' ILE . 2.5 t -52.63 -26.47 13.74 Favored 'General case' 0 N--CA 1.453 -0.317 0 C-N-CA 123.316 0.646 . . . . 0.0 110.716 175.93 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -55.74 -58.76 6.48 Favored 'General case' 0 N--CA 1.449 -0.501 0 O-C-N 122.164 -0.335 . . . . 0.0 110.598 -176.98 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 76.3 t60 -75.49 -32.96 60.74 Favored 'General case' 0 N--CA 1.453 -0.306 0 O-C-N 122.286 -0.259 . . . . 0.0 111.117 -179.833 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -65.4 -51.86 57.45 Favored 'General case' 0 N--CA 1.449 -0.493 0 O-C-N 122.977 0.173 . . . . 0.0 111.453 -176.255 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 98' ' ' ILE . . . . . 0.4 HD12 ' SG ' ' A' ' 94' ' ' CYS . 1.7 mp -72.03 -34.18 49.67 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.153 0 N-CA-C 110.18 -0.304 . . . . 0.0 110.18 -179.248 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 1.7 m120 -66.87 -46.18 75.78 Favored 'General case' 0 N--CA 1.452 -0.355 0 C-N-CA 120.319 -0.552 . . . . 0.0 111.304 178.281 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 87.8 m -67.95 -35.03 77.7 Favored 'General case' 0 N--CA 1.456 -0.125 0 CA-C-N 118.077 0.399 . . . . 0.0 110.896 -176.319 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 57.7 tp -75.9 -39.83 55.57 Favored 'General case' 0 N--CA 1.449 -0.489 0 CA-C-O 119.779 -0.153 . . . . 0.0 111.05 -179.261 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -66.37 -16.09 64.49 Favored Glycine 0 CA--C 1.528 0.849 0 CA-C-O 119.634 -0.537 . . . . 0.0 112.717 -175.549 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 103' ' ' GLU . . . . . 0.425 ' HA ' ' HE3' ' A' ' 139' ' ' LYS . 14.9 mm-40 -78.83 -34.77 44.9 Favored 'General case' 0 N--CA 1.455 -0.211 0 CA-C-N 117.754 0.777 . . . . 0.0 112.133 179.908 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 18.9 m -112.44 3.47 8.4 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.135 0 O-C-N 124.007 0.817 . . . . 0.0 112.88 -174.027 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 105' ' ' ILE . . . . . . . . . . . . . 10.9 tp -68.93 -26.93 33.68 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.224 0 O-C-N 121.927 -0.483 . . . . 0.0 111.49 -177.915 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 14.1 pt20 -70.32 -31.56 68.93 Favored 'General case' 0 N--CA 1.455 -0.214 0 O-C-N 121.786 -0.571 . . . . 0.0 110.085 -178.888 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 48.4 mp0 -71.49 -38.74 71.15 Favored 'General case' 0 N--CA 1.451 -0.394 0 CA-C-N 118.256 0.48 . . . . 0.0 110.32 177.705 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 87.3 mt -74.11 -36.24 64.2 Favored 'General case' 0 N--CA 1.455 -0.212 0 N-CA-C 110.669 -0.122 . . . . 0.0 110.669 -178.401 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 87.6 mt -71.58 -47.7 53.14 Favored 'General case' 0 N--CA 1.452 -0.344 0 C-N-CA 120.874 -0.33 . . . . 0.0 110.295 176.133 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 48.3 t -57.16 -40.34 77.06 Favored 'General case' 0 N--CA 1.457 -0.105 0 C-N-CA 122.435 0.294 . . . . 0.0 110.604 179.716 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 39.8 t0 -64.12 -42.75 96.72 Favored 'General case' 0 N--CA 1.453 -0.282 0 N-CA-C 109.256 -0.646 . . . . 0.0 109.256 176.156 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -70.79 -39.01 73.39 Favored 'General case' 0 N--CA 1.445 -0.68 0 CA-C-O 119.141 -0.457 . . . . 0.0 111.36 -175.252 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 113' ' ' ILE . . . . . . . . . . . . . 12.1 mm -68.65 -38.53 79.12 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.276 0 CA-C-N 119.592 1.087 . . . . 0.0 109.75 -179.308 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -67.2 -47.6 70.41 Favored 'General case' 0 N--CA 1.45 -0.464 0 C-N-CA 122.839 0.456 . . . . 0.0 111.707 178.234 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 115' ' ' LYS . . . . . 0.561 ' HE2' ' HA ' ' A' ' 115' ' ' LYS . 0.3 OUTLIER -84.05 -34.79 24.16 Favored 'General case' 0 N--CA 1.455 -0.194 0 N-CA-C 114.018 1.118 . . . . 0.0 114.018 -172.907 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 116' ' ' SER . . . . . 0.454 ' HB2' ' CB ' ' A' ' 120' ' ' HIS . 28.3 p -77.63 159.42 29.21 Favored 'General case' 0 CA--C 1.528 0.121 0 N-CA-C 112.527 0.565 . . . . 0.0 112.527 -172.505 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 7.8 t-20 -80.35 164.58 23.02 Favored 'General case' 0 C--O 1.225 -0.22 0 C-N-CA 123.713 0.805 . . . . 0.0 111.127 -178.461 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 118' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -44.76 -48.86 10.85 Favored 'General case' 0 N--CA 1.455 -0.197 0 C-N-CA 124.034 0.934 . . . . 0.0 113.05 -179.176 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 49.8 t0 -60.76 -39.69 89.68 Favored 'General case' 0 CA--C 1.531 0.217 0 CA-C-O 121.002 0.429 . . . . 0.0 110.192 178.51 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 120' ' ' HIS . . . . . 0.454 ' CB ' ' HB2' ' A' ' 116' ' ' SER . 24.9 m170 -68.67 -40.8 79.96 Favored 'General case' 0 N--CA 1.451 -0.38 0 N-CA-C 109.69 -0.485 . . . . 0.0 109.69 -179.053 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 94.8 mttt -59.26 -34.6 72.44 Favored 'General case' 0 C--N 1.339 0.127 0 N-CA-C 109.446 -0.576 . . . . 0.0 109.446 178.87 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 24.2 tt0 -67.58 -45.98 73.97 Favored 'General case' 0 N--CA 1.455 -0.193 0 C-N-CA 122.527 0.331 . . . . 0.0 110.766 179.134 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 14.4 mptt -68.18 -35.42 77.99 Favored 'General case' 0 C--N 1.338 0.099 0 C-N-CA 120.42 -0.512 . . . . 0.0 110.386 -177.753 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 124' ' ' ILE . . . . . . . . . . . . . 63.5 mt -66.7 -38.52 81.74 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.207 0 N-CA-C 108.96 -0.756 . . . . 0.0 108.96 177.513 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 125' ' ' ARG . . . . . 0.401 ' HD2' ' HA ' ' A' ' 125' ' ' ARG . 25.0 tpt85 -66.39 -42.22 88.21 Favored 'General case' 0 N--CA 1.443 -0.776 0 N-CA-C 111.849 0.314 . . . . 0.0 111.849 -172.431 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 126' ' ' MET . . . . . . . . . . . . . 27.1 ptm -67.13 -33.28 75.1 Favored 'General case' 0 N--CA 1.45 -0.436 0 N-CA-C 108.965 -0.754 . . . . 0.0 108.965 175.606 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 2.7 mp -61.92 -34.55 76.28 Favored 'General case' 0 CA--C 1.53 0.203 0 CA-C-O 119.271 -0.395 . . . . 0.0 110.146 176.227 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 53.6 mt -68.1 -43.46 78.4 Favored 'General case' 0 N--CA 1.455 -0.201 0 CA-C-N 119.139 0.881 . . . . 0.0 110.459 178.743 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 55.3 m-20 -65.47 -37.74 87.74 Favored 'General case' 0 CA--C 1.529 0.163 0 C-N-CA 120.314 -0.555 . . . . 0.0 110.042 177.925 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 130' ' ' ILE . . . . . 0.46 ' HA ' ' HD3' ' A' ' 133' ' ' ARG . 53.1 mt -63.06 -36.39 75.65 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.319 0 C-N-CA 122.766 0.426 . . . . 0.0 110.297 178.516 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 131' ' ' TRP . . . . . . . . . . . . . 51.4 m0 -74.55 -34.86 63.06 Favored 'General case' 0 N--CA 1.453 -0.299 0 N-CA-C 112.522 0.564 . . . . 0.0 112.522 -179.27 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 90.1 m-20 -68.21 -28.42 67.23 Favored 'General case' 0 CA--C 1.53 0.188 0 CA-C-N 118.541 0.609 . . . . 0.0 110.531 175.789 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 133' ' ' ARG . . . . . 0.46 ' HD3' ' HA ' ' A' ' 130' ' ' ILE . 13.3 mtp180 -72.42 -33.5 67.16 Favored 'General case' 0 N--CA 1.457 -0.087 0 C-N-CA 122.774 0.43 . . . . 0.0 110.832 177.301 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 30.4 t -74.37 -18.8 60.63 Favored 'General case' 0 CA--C 1.531 0.224 0 CA-C-N 118.014 0.37 . . . . 0.0 110.676 173.449 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 135' ' ' GLY . . . . . . . . . . . . . . . 87.18 17.97 58.29 Favored Glycine 0 CA--C 1.528 0.89 0 CA-C-O 119.423 -0.654 . . . . 0.0 112.221 -179.257 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 136' ' ' LEU . . . . . . . . . . . . . 42.6 mt -62.68 132.79 53.5 Favored 'General case' 0 N--CA 1.456 -0.15 0 CA-C-N 117.959 0.879 . . . . 0.0 110.174 179.641 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 137' ' ' PHE . . . . . . . . . . . . . 78.1 t80 -75.34 128.22 34.89 Favored 'General case' 0 N--CA 1.451 -0.4 0 N-CA-C 109.148 -0.686 . . . . 0.0 109.148 175.529 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 138' ' ' GLN . . . . . . . . . . . . . 20.7 pt20 -159.46 151.53 20.81 Favored 'General case' 0 N--CA 1.45 -0.427 0 CA-C-O 120.803 0.335 . . . . 0.0 111.183 -179.61 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 139' ' ' LYS . . . . . 0.427 ' C ' ' H ' ' A' ' 141' ' ' TYR . 95.1 mttt -84.49 17.12 2.77 Favored 'General case' 0 N--CA 1.457 -0.125 0 C-N-CA 123.706 0.803 . . . . 0.0 110.494 175.306 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 140' ' ' SER . . . . . . . . . . . . . 33.1 t -70.37 27.5 0.03 OUTLIER 'General case' 0 CA--C 1.531 0.216 0 C-N-CA 124.205 1.002 . . . . 0.0 113.356 -174.805 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 141' ' ' TYR . . . . . 0.427 ' H ' ' C ' ' A' ' 139' ' ' LYS . 12.3 m-85 -121.35 -6.52 9.32 Favored 'General case' 0 N--CA 1.454 -0.261 0 O-C-N 122.173 -0.329 . . . . 0.0 111.824 -176.93 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 142' ' ' LEU . . . . . . . . . . . . . 9.4 mp -79.47 163.07 25.04 Favored 'General case' 0 N--CA 1.454 -0.225 0 CA-C-O 121.059 0.457 . . . . 0.0 110.757 178.881 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 76.3 m-20 -66.64 -15.69 63.65 Favored 'General case' 0 CA--C 1.529 0.145 0 N-CA-C 112.442 0.534 . . . . 0.0 112.442 -178.372 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . -65.42 -31.79 73.08 Favored 'General case' 0 N--CA 1.452 -0.339 0 N-CA-C 110.115 -0.328 . . . . 0.0 110.115 179.546 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 145' ' ' ILE . . . . . . . . . . . . . 37.0 mm -64.47 -30.84 51.3 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.35 0 C-N-CA 122.462 0.305 . . . . 0.0 110.523 178.044 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 146' ' ' ARG . . . . . . . . . . . . . 7.4 mpt_? -75.51 -58.18 3.44 Favored 'General case' 0 N--CA 1.453 -0.302 0 N-CA-C 109.808 -0.441 . . . . 0.0 109.808 -179.626 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 147' ' ' SER . . . . . . . . . . . . . 69.9 m 38.77 44.68 0.84 Allowed 'General case' 0 C--N 1.341 0.23 0 C-N-CA 123.238 0.615 . . . . 0.0 111.723 -179.02 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 148' ' ' LYS . . . . . 0.582 ' HD3' ' H ' ' A' ' 148' ' ' LYS . 0.0 OUTLIER -52.18 -23.84 6.18 Favored 'General case' 0 N--CA 1.456 -0.134 0 C-N-CA 124.045 0.938 . . . . 0.0 112.466 -175.695 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 149' ' ' CYS . . . . . . . . . . . . . 59.9 m -66.11 -61.31 2.1 Favored 'General case' 0 N--CA 1.451 -0.383 0 N-CA-C 109.552 -0.536 . . . . 0.0 109.552 -179.771 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 150' ' ' PHE . . . . . . . . . . . . . 9.4 m-85 -62.61 -29.91 70.95 Favored 'General case' 0 N--CA 1.454 -0.254 0 CA-C-O 120.463 0.173 . . . . 0.0 110.716 -177.114 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 151' ' ' ALA . . . . . . . . . . . . . . . -67.5 -35.73 79.69 Favored 'General case' 0 N--CA 1.452 -0.369 0 CA-C-N 116.747 -0.206 . . . . 0.0 110.574 -179.644 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 152' ' ' MET . . . . . 0.431 ' HE3' ' HA ' ' A' ' 152' ' ' MET . 5.2 mmt -88.67 -14.23 37.86 Favored 'General case' 0 CA--C 1.529 0.171 0 N-CA-C 111.935 0.346 . . . . 0.0 111.935 178.493 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 153' ' ' ASP . . . . . . . . . . . . . 94.7 m-20 -75.75 -22.59 56.37 Favored 'General case' 0 CA--C 1.531 0.218 0 N-CA-C 112.906 0.706 . . . . 0.0 112.906 179.507 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 154' ' ' LEU . . . . . . . . . . . . . 39.9 mt -109.37 4.82 22.94 Favored 'General case' 0 C--N 1.34 0.169 0 N-CA-C 113.811 1.041 . . . . 0.0 113.811 -173.22 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 155' ' ' GLU . . . . . . . . . . . . . 23.1 pt-20 -161.57 171.37 18.17 Favored 'General case' 0 C--N 1.33 -0.277 0 C-N-CA 122.71 0.404 . . . . 0.0 110.903 177.104 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 156' ' ' HIS . . . . . . . . . . . . . 69.7 t60 -62.1 154.34 27.31 Favored 'General case' 0 N--CA 1.454 -0.245 0 CA-C-O 120.928 0.394 . . . . 0.0 110.841 179.927 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 157' ' ' HIS . . . . . . . . . . . . . 46.3 m170 -79.78 18.64 0.75 Allowed 'General case' 0 CA--C 1.531 0.221 0 N-CA-C 112.738 0.644 . . . . 0.0 112.738 -174.274 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 158' ' ' HIS . . . . . . . . . . . . . 17.7 m170 61.62 11.04 3.65 Favored 'General case' 0 CA--C 1.53 0.184 0 C-N-CA 124.388 1.075 . . . . 0.0 113.312 179.611 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 159' ' ' HIS . . . . . . . . . . . . . 56.6 m170 . . . . . 0 C--O 1.251 1.139 0 CA-C-O 117.313 -1.327 . . . . 0.0 110.595 178.054 . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' B' B 2052 ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 N--CA 1.471 0.589 0 N-CA-C 109.767 -0.457 . . . . 0.0 109.767 . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B 2053 ' ' ASP . . . . . 0.418 ' CB ' HH22 ' A' ' 28' ' ' ARG . 3.9 m-20 59.69 -73.67 0.03 OUTLIER 'General case' 0 CA--C 1.53 0.192 0 C-N-CA 125.317 1.447 . . . . 0.0 114.3 -179.729 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B 2054 ' ' ASP . . . . . . . . . . . . . 41.9 p-10 -155.6 149.13 25.02 Favored 'General case' 0 N--CA 1.453 -0.307 0 C-N-CA 122.988 0.515 . . . . 0.0 111.811 -172.161 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B 2055 ' ' GLU . . . . . . . . . . . . . 47.2 mt-10 43.99 45.04 6.43 Favored 'General case' 0 C--N 1.339 0.113 0 C-N-CA 124.058 0.943 . . . . 0.0 112.331 175.745 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B 2056 ' ' ASP . . . . . 0.403 ' OD1' ' N ' ' B' 2056 ' ' ASP . 0.0 OUTLIER -62.15 -1.47 0.72 Allowed 'General case' 0 CA--C 1.536 0.422 0 C-N-CA 122.988 0.515 . . . . 0.0 112.108 -177.999 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' B' B 2057 ' ' ASP . . . . . . . . . . . . . 64.3 t0 -154.0 103.76 2.6 Favored 'General case' 0 N--CA 1.453 -0.281 0 N-CA-C 107.382 -1.34 . . . . 0.0 107.382 168.367 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B 2058 ' ' TYR . . . . . . . . . . . . . 0.8 OUTLIER -70.8 -0.62 9.4 Favored 'General case' 0 CA--C 1.529 0.145 0 N-CA-C 111.942 0.349 . . . . 0.0 111.942 -176.139 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B 2059 ' ' THR . . . . . . . . . . . . . 56.0 m 56.0 76.4 0.5 Allowed Pre-proline 0 CA--C 1.531 0.213 0 C-N-CA 124.318 1.047 . . . . 0.0 110.849 178.239 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B 2060 ' ' PRO . . . . . . . . . . . . . 57.9 Cg_endo -65.09 146.67 87.62 Favored 'Trans proline' 0 N--CA 1.451 -1.004 0 C-N-CA 123.306 2.671 . . . . 0.0 110.592 179.385 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B 2061 ' ' SER . . . . . . . . . . . . . 48.0 t -156.15 154.87 31.55 Favored 'General case' 0 N--CA 1.456 -0.154 0 N-CA-C 109.925 -0.398 . . . . 0.0 109.925 -178.767 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B 2062 ' ' ILE . . . . . 0.426 HD13 ' HB2' ' A' ' 133' ' ' ARG . 15.1 tt -164.64 161.91 0.89 Allowed 'Isoleucine or valine' 0 N--CA 1.455 -0.211 0 N-CA-C 108.777 -0.823 . . . . 0.0 108.777 -178.496 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B 2063 ' ' SER . . . . . . . . . . . . . 80.7 p . . . . . 0 C--O 1.252 1.199 0 CA-C-O 117.484 -1.246 . . . . 0.0 109.739 174.84 . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 74.2 mtm . . . . . 0 N--CA 1.476 0.826 0 N-CA-C 109.841 -0.429 . . . . 0.0 109.841 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 3.4 pm0 -63.01 -22.05 66.58 Favored 'General case' 0 N--CA 1.455 -0.195 0 C-N-CA 124.341 1.056 . . . . 0.0 109.932 173.312 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . 0.541 ' HG2' ' H ' ' A' ' 4' ' ' ASP . 6.6 tt0 -162.62 -174.15 3.85 Favored 'General case' 0 N--CA 1.45 -0.463 0 N-CA-C 106.545 -1.65 . . . . 0.0 106.545 177.819 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 4' ' ' ASP . . . . . 0.541 ' H ' ' HG2' ' A' ' 3' ' ' GLN . 12.1 p-10 -72.92 122.16 21.2 Favored 'General case' 0 N--CA 1.452 -0.336 0 N-CA-C 108.309 -0.997 . . . . 0.0 108.309 173.898 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 65.5 m-20 -78.26 10.6 2.9 Favored 'General case' 0 CA--C 1.521 -0.159 0 N-CA-C 114.715 1.376 . . . . 0.0 114.715 -169.892 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 23.1 p-10 -93.19 -42.7 9.22 Favored 'General case' 0 C--N 1.328 -0.348 0 N-CA-C 106.835 -1.543 . . . . 0.0 106.835 170.816 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 7' ' ' PHE . . . . . 0.659 ' HB2' ' HZ3' ' A' ' 45' ' ' LYS . 0.7 OUTLIER -75.05 -34.3 61.82 Favored 'General case' 0 N--CA 1.441 -0.886 0 CA-C-N 115.341 -0.845 . . . . 0.0 110.129 -179.023 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 60.5 tp60 -48.19 -39.84 22.27 Favored 'General case' 0 CA--C 1.529 0.163 0 C-N-CA 123.984 0.914 . . . . 0.0 112.125 -175.427 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 4.1 m-80 -70.16 -38.65 75.49 Favored 'General case' 0 CA--C 1.529 0.173 0 CA-C-O 121.264 0.554 . . . . 0.0 110.283 -178.867 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 1.8 t80 -70.82 -37.38 73.2 Favored 'General case' 0 N--CA 1.451 -0.425 0 C-N-CA 124.289 1.036 . . . . 0.0 109.601 179.503 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 74.9 t -68.6 -52.9 31.26 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.302 0 N-CA-C 108.872 -0.788 . . . . 0.0 108.872 179.322 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -57.91 -31.43 66.77 Favored 'General case' 0 N--CA 1.453 -0.29 0 CA-C-N 117.78 0.264 . . . . 0.0 111.519 -179.135 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 82.9 m -69.31 -42.67 75.1 Favored 'General case' 0 CA--C 1.534 0.332 0 N-CA-C 109.015 -0.735 . . . . 0.0 109.015 175.366 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . 0.431 HD11 ' CD2' ' A' ' 53' ' ' TYR . 0.1 OUTLIER -64.09 -40.23 95.77 Favored 'General case' 0 N--CA 1.454 -0.232 0 C-N-CA 122.947 0.499 . . . . 0.0 110.039 179.152 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 73.1 mm-40 -65.27 -32.5 74.19 Favored 'General case' 0 N--CA 1.451 -0.38 0 C-N-CA 123.565 0.746 . . . . 0.0 109.702 179.558 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 16.2 p -65.14 -34.28 78.02 Favored 'General case' 0 N--CA 1.454 -0.253 0 N-CA-C 109.537 -0.542 . . . . 0.0 109.537 176.068 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 17' ' ' PHE . . . . . 0.43 ' CD1' HD11 ' A' ' 68' ' ' ILE . 14.8 m-30 -67.18 -34.26 77.15 Favored 'General case' 0 N--CA 1.458 -0.038 0 C-N-CA 121.187 -0.205 . . . . 0.0 111.529 175.845 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . 0.507 ' HG2' ' CE1' ' A' ' 53' ' ' TYR . 53.2 mttt -68.99 -24.9 64.28 Favored 'General case' 0 C--O 1.227 -0.089 0 N-CA-C 110.084 -0.339 . . . . 0.0 110.084 175.172 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 30.6 t0 -78.43 -23.9 46.41 Favored 'General case' 0 CA--C 1.534 0.359 0 C-N-CA 123.106 0.563 . . . . 0.0 111.811 178.23 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 93.3 mt -75.53 164.93 25.84 Favored 'General case' 0 CA--C 1.529 0.17 0 CA-C-O 121.132 0.492 . . . . 0.0 111.196 179.101 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -94.01 -45.53 7.55 Favored 'General case' 0 N--CA 1.455 -0.212 0 N-CA-C 108.573 -0.899 . . . . 0.0 108.573 177.533 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 53.9 m -80.43 -16.35 54.62 Favored 'General case' 0 CA--C 1.529 0.139 0 C-N-CA 122.949 0.5 . . . . 0.0 111.563 -179.235 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 72.6 -29.05 0.73 Allowed Glycine 0 CA--C 1.529 0.963 0 C-N-CA 124.29 0.948 . . . . 0.0 113.203 178.134 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 94.6 mt -75.81 147.54 7.95 Favored 'Isoleucine or valine' 0 C--N 1.339 0.109 0 CA-C-N 117.94 0.87 . . . . 0.0 109.455 177.028 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 6.4 t -163.7 78.23 0.41 Allowed 'General case' 0 N--CA 1.453 -0.312 0 N-CA-C 110.322 -0.251 . . . . 0.0 110.322 -178.495 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -45.72 -52.74 9.12 Favored Glycine 0 CA--C 1.527 0.798 0 CA-C-O 118.928 -0.929 . . . . 0.0 114.126 -170.63 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 37.8 t -65.5 -45.04 85.12 Favored 'General case' 0 N--CA 1.456 -0.157 0 CA-C-N 119.432 1.616 . . . . 0.0 110.918 -175.374 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 17.1 mtm180 -70.48 -37.64 74.26 Favored 'General case' 0 CA--C 1.527 0.091 0 CA-C-O 119.385 -0.341 . . . . 0.0 111.228 -179.356 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 63.4 mt -56.5 -43.92 79.25 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.474 0 N-CA-C 108.185 -1.042 . . . . 0.0 108.185 172.105 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 46.0 mtmt -70.81 -19.3 62.69 Favored 'General case' 0 N--CA 1.452 -0.337 0 CA-C-O 118.653 -0.689 . . . . 0.0 111.753 179.382 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . 0.463 ' HA ' ' HE3' ' A' ' 31' ' ' LYS . 0.0 OUTLIER -69.32 -55.17 11.21 Favored 'General case' 0 C--N 1.343 0.284 0 CA-C-N 119.223 0.919 . . . . 0.0 109.585 174.793 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 3.2 pp -75.18 -19.71 59.69 Favored 'General case' 0 N--CA 1.456 -0.145 0 C-N-CA 119.567 -0.853 . . . . 0.0 111.177 -178.773 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 53.3 m -71.84 -43.18 65.97 Favored 'General case' 0 N--CA 1.453 -0.314 0 N-CA-C 108.923 -0.769 . . . . 0.0 108.923 175.535 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 80.6 m -67.39 -37.53 83.27 Favored 'General case' 0 N--CA 1.453 -0.284 0 O-C-N 122.359 -0.213 . . . . 0.0 110.449 -177.7 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 81.0 t80 -68.68 -34.42 75.65 Favored 'General case' 0 N--CA 1.45 -0.467 0 O-C-N 122.285 -0.259 . . . . 0.0 110.493 177.451 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -68.48 -36.18 78.58 Favored 'General case' 0 N--CA 1.451 -0.421 0 O-C-N 122.288 -0.257 . . . . 0.0 110.352 177.688 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -69.86 -33.84 72.8 Favored 'General case' 0 N--CA 1.455 -0.208 0 C-N-CA 122.729 0.412 . . . . 0.0 110.32 179.357 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 43.5 t0 -69.44 -21.59 63.72 Favored 'General case' 0 N--CA 1.451 -0.393 0 C-N-CA 122.564 0.346 . . . . 0.0 110.767 176.129 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 95.6 m-70 -150.67 95.62 2.25 Favored 'General case' 0 C--N 1.341 0.22 0 N-CA-C 112.208 0.447 . . . . 0.0 112.208 -175.413 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 40' ' ' ILE . . . . . 0.555 HD11 ' H ' ' A' ' 40' ' ' ILE . 0.0 OUTLIER -74.28 -13.28 15.64 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.291 0 CA-C-O 119.529 -0.272 . . . . 0.0 110.311 175.09 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 19.1 m-20 -57.68 -22.46 46.16 Favored 'General case' 0 N--CA 1.456 -0.131 0 C-N-CA 122.975 0.51 . . . . 0.0 112.104 -176.997 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -108.77 18.38 6.6 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.185 0 C-N-CA 122.897 0.479 . . . . 0.0 112.255 178.384 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 3.1 pp20? -52.85 -27.58 19.03 Favored 'General case' 0 C--O 1.226 -0.165 0 CA-C-N 118.365 0.529 . . . . 0.0 109.582 174.785 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 90.3 p -58.94 -55.11 39.42 Favored 'General case' 0 N--CA 1.453 -0.294 0 C-N-CA 123.668 0.787 . . . . 0.0 111.315 -178.708 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . 0.659 ' HZ3' ' HB2' ' A' ' 7' ' ' PHE . 17.0 ptpt -73.76 -21.5 60.17 Favored 'General case' 0 C--N 1.338 0.108 0 O-C-N 122.298 -0.251 . . . . 0.0 110.98 -179.858 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 93.5 mt -74.37 -45.61 46.01 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.198 0 N-CA-C 110.045 -0.354 . . . . 0.0 110.045 -179.81 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 34.6 mm -66.35 -38.85 82.71 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.126 0 N-CA-C 109.422 -0.584 . . . . 0.0 109.422 178.66 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 27.4 t -63.05 -38.92 93.11 Favored 'General case' 0 N--CA 1.453 -0.278 0 C-N-CA 119.657 -0.817 . . . . 0.0 109.887 177.332 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 32.7 tp -72.03 -31.89 66.61 Favored 'General case' 0 N--CA 1.449 -0.52 0 N-CA-C 112.615 0.598 . . . . 0.0 112.615 -173.772 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 14.4 pt -70.82 -41.34 77.33 Favored 'Isoleucine or valine' 0 C--N 1.34 0.169 0 CA-C-N 118.785 0.72 . . . . 0.0 110.099 175.996 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 42.4 pt -71.38 -37.74 66.24 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.171 0 C-N-CA 119.875 -0.73 . . . . 0.0 110.85 179.664 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 84.5 m-20 -65.37 -44.99 85.88 Favored 'General case' 0 C--O 1.233 0.214 0 CA-C-N 117.927 0.331 . . . . 0.0 111.307 177.849 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 53' ' ' TYR . . . . . 0.507 ' CE1' ' HG2' ' A' ' 18' ' ' LYS . 9.3 t80 -60.64 -42.94 97.94 Favored 'General case' 0 C--N 1.34 0.189 0 N-CA-C 108.893 -0.78 . . . . 0.0 108.893 176.365 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 25.0 m -69.21 -26.93 65.06 Favored 'General case' 0 N--CA 1.453 -0.319 0 C-N-CA 122.197 0.199 . . . . 0.0 111.479 -177.899 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 51.9 tpt85 -75.78 -35.13 60.21 Favored 'General case' 0 N--CA 1.455 -0.194 0 O-C-N 121.985 -0.447 . . . . 0.0 111.336 -178.697 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 32.4 mt -89.08 -43.17 11.27 Favored 'General case' 0 N--CA 1.457 -0.113 0 N-CA-C 112.772 0.656 . . . . 0.0 112.772 -177.548 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 57' ' ' CYS . . . . . 0.434 ' HB2' ' CB ' ' A' ' 61' ' ' HIS . 3.4 p -65.89 157.86 78.08 Favored Pre-proline 0 CA--C 1.536 0.422 0 N-CA-C 114.981 1.474 . . . . 0.0 114.981 -169.715 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 58' ' ' PRO . . . . . 0.419 ' HD2' ' HB2' ' A' ' 57' ' ' CYS . 51.5 Cg_endo -78.12 -166.92 0.43 Allowed 'Trans proline' 0 N--CA 1.456 -0.677 1 C-N-CA 125.72 4.28 . . . . 0.0 111.243 175.29 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 29.9 p-10 -61.7 -52.26 65.05 Favored 'General case' 0 CA--C 1.53 0.2 0 C-N-CA 125.131 1.372 . . . . 0.0 113.793 -172.15 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 40.3 m -67.73 -34.25 76.47 Favored 'General case' 0 N--CA 1.455 -0.198 0 CA-C-O 120.709 0.29 . . . . 0.0 110.615 -174.234 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 61' ' ' HIS . . . . . 0.434 ' CB ' ' HB2' ' A' ' 57' ' ' CYS . 55.3 m170 -74.33 -23.29 59.03 Favored 'General case' 0 N--CA 1.452 -0.33 0 N-CA-C 109.901 -0.407 . . . . 0.0 109.901 176.132 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 4.4 tppt? -67.36 -39.8 85.73 Favored 'General case' 0 N--CA 1.455 -0.215 0 N-CA-C 108.978 -0.749 . . . . 0.0 108.978 176.558 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -67.49 -42.41 82.96 Favored 'General case' 0 N--CA 1.454 -0.254 0 N-CA-C 108.875 -0.787 . . . . 0.0 108.875 177.221 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -66.14 -31.0 77.94 Favored Glycine 0 C--N 1.339 0.738 0 N-CA-C 111.116 -0.794 . . . . 0.0 111.116 179.533 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 50.5 m -67.29 -43.04 82.75 Favored 'General case' 0 N--CA 1.455 -0.189 0 N-CA-C 109.808 -0.442 . . . . 0.0 109.808 177.571 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 61.3 mt -68.51 -25.98 65.22 Favored 'General case' 0 N--CA 1.453 -0.311 0 CA-C-O 119.554 -0.26 . . . . 0.0 110.79 179.384 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 1.4 m-85 -70.94 -37.81 72.87 Favored 'General case' 0 N--CA 1.455 -0.215 0 CA-C-N 117.778 0.263 . . . . 0.0 110.721 175.473 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 68' ' ' ILE . . . . . 0.43 HD11 ' CD1' ' A' ' 17' ' ' PHE . 14.7 mt -67.69 -46.9 81.78 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.472 0 N-CA-C 108.859 -0.793 . . . . 0.0 108.859 176.401 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 95.7 mt -57.39 -37.5 57.69 Favored 'Isoleucine or valine' 0 C--N 1.339 0.128 0 C-N-CA 123.49 0.716 . . . . 0.0 111.071 176.641 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 17.6 t70 -69.42 -43.6 73.07 Favored 'General case' 0 N--CA 1.455 -0.19 0 CA-C-N 118.161 0.437 . . . . 0.0 110.291 178.421 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 29.4 t -66.63 -57.33 7.42 Favored 'General case' 0 N--CA 1.451 -0.385 0 C-N-CA 122.733 0.413 . . . . 0.0 110.988 -176.993 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -75.57 -32.32 24.71 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.408 0 N-CA-C 109.868 -0.419 . . . . 0.0 109.868 -176.733 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -64.84 -50.55 57.77 Favored Glycine 0 C--N 1.337 0.606 0 N-CA-C 111.385 -0.686 . . . . 0.0 111.385 -175.587 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 37.1 mtm105 -71.88 -39.13 69.84 Favored 'General case' 0 N--CA 1.451 -0.383 0 CA-C-N 117.481 0.64 . . . . 0.0 110.134 178.81 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -62.16 -33.94 75.46 Favored 'General case' 0 N--CA 1.452 -0.357 0 C-N-CA 120.54 -0.464 . . . . 0.0 110.751 -179.122 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 1.4 m-30 -69.79 -49.85 48.8 Favored 'General case' 0 CA--C 1.52 -0.204 0 CA-C-N 118.419 0.554 . . . . 0.0 111.023 175.764 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 2.5 tm? -67.93 -35.85 79.14 Favored 'General case' 0 N--CA 1.45 -0.443 0 C-N-CA 118.689 -1.204 . . . . 0.0 109.092 -175.024 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 92.6 m-20 -65.79 -46.9 76.96 Favored 'General case' 0 C--O 1.231 0.116 0 N-CA-C 112.488 0.551 . . . . 0.0 112.488 177.166 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 13.6 tm-20 -65.02 -47.77 76.25 Favored 'General case' 0 N--CA 1.448 -0.573 0 C-N-CA 121.096 -0.241 . . . . 0.0 110.55 -179.027 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 68.4 p -67.27 -28.33 67.94 Favored 'General case' 0 N--CA 1.45 -0.463 0 CA-C-O 119.502 -0.285 . . . . 0.0 110.913 179.727 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 36.8 ttp-105 -69.93 -26.88 64.35 Favored 'General case' 0 C--N 1.338 0.088 0 CA-C-N 118.544 0.611 . . . . 0.0 110.182 173.401 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 22.5 m -86.29 -29.36 23.12 Favored 'General case' 0 N--CA 1.454 -0.242 0 N-CA-C 112.965 0.728 . . . . 0.0 112.965 -177.669 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 73.1 m-20 -136.41 10.22 3.2 Favored 'General case' 0 C--N 1.341 0.211 0 N-CA-C 113.758 1.022 . . . . 0.0 113.758 -172.852 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 21.9 t -155.12 -158.47 0.84 Allowed 'General case' 0 CA--C 1.533 0.311 0 CA-C-N 118.689 0.677 . . . . 0.0 110.216 -177.253 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 19.7 t-20 -151.35 139.17 19.85 Favored 'General case' 0 CA--C 1.532 0.254 0 N-CA-C 110.071 -0.344 . . . . 0.0 110.071 178.686 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 29.0 t -76.59 -5.4 47.56 Favored 'General case' 0 C--N 1.339 0.141 0 N-CA-C 113.064 0.765 . . . . 0.0 113.064 -174.557 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 80.1 p -73.38 -7.87 53.49 Favored 'General case' 0 C--O 1.231 0.095 0 CA-C-N 118.431 0.56 . . . . 0.0 110.181 175.427 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 77.6 p -75.2 53.49 0.64 Allowed 'General case' 0 CA--C 1.53 0.197 0 C-N-CA 124.301 1.041 . . . . 0.0 110.314 176.192 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 69.3 m-80 -61.12 77.41 0.01 OUTLIER 'General case' 0 C--N 1.342 0.277 0 C-N-CA 125.407 1.483 . . . . 0.0 112.785 -176.657 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -155.73 163.35 25.01 Favored Pre-proline 0 N--CA 1.454 -0.259 0 C-N-CA 124.557 1.143 . . . . 0.0 108.465 172.747 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_exo -58.48 154.87 39.1 Favored 'Trans proline' 0 N--CA 1.453 -0.875 0 C-N-CA 123.415 2.743 . . . . 0.0 111.707 177.419 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 89.31 17.17 56.07 Favored Glycine 0 CA--C 1.528 0.851 0 CA-C-O 119.525 -0.597 . . . . 0.0 113.238 176.427 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -156.21 165.37 36.58 Favored 'General case' 0 N--CA 1.457 -0.076 0 CA-C-N 117.904 0.852 . . . . 0.0 109.557 178.724 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 94' ' ' CYS . . . . . . . . . . . . . 31.5 p -55.55 -23.08 24.75 Favored 'General case' 0 N--CA 1.453 -0.317 0 C-N-CA 123.611 0.764 . . . . 0.0 110.813 178.729 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -60.18 -60.35 3.96 Favored 'General case' 0 N--CA 1.445 -0.681 0 N-CA-C 110.098 -0.334 . . . . 0.0 110.098 -176.076 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 75.0 t60 -72.71 -31.45 65.02 Favored 'General case' 0 N--CA 1.451 -0.386 0 O-C-N 122.052 -0.405 . . . . 0.0 110.728 179.417 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -64.33 -53.67 45.04 Favored 'General case' 0 N--CA 1.452 -0.348 0 CA-C-O 119.686 -0.197 . . . . 0.0 111.366 -178.36 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 1.9 mp -70.91 -34.31 55.33 Favored 'Isoleucine or valine' 0 C--N 1.339 0.109 0 CA-C-N 118.074 0.397 . . . . 0.0 110.244 -179.757 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 73.0 m-20 -62.56 -42.28 99.44 Favored 'General case' 0 N--CA 1.456 -0.165 0 CA-C-N 118.159 0.436 . . . . 0.0 110.883 177.719 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 92.2 m -74.54 -31.78 62.23 Favored 'General case' 0 N--CA 1.455 -0.178 0 N-CA-C 110.443 -0.206 . . . . 0.0 110.443 -178.705 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -70.82 -41.11 71.98 Favored 'General case' 0 N--CA 1.452 -0.359 0 C-N-CA 122.632 0.373 . . . . 0.0 110.742 -179.01 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -62.47 -20.74 61.6 Favored Glycine 0 CA--C 1.529 0.928 0 CA-C-O 119.63 -0.539 . . . . 0.0 113.741 -173.767 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 103' ' ' GLU . . . . . 0.419 ' CD ' ' HZ2' ' A' ' 139' ' ' LYS . 55.9 mm-40 -85.58 -36.06 20.66 Favored 'General case' 0 N--CA 1.455 -0.21 0 CA-C-N 118.362 1.081 . . . . 0.0 112.666 -179.837 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 59.0 t -92.14 -26.57 4.89 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.155 0 O-C-N 123.26 0.35 . . . . 0.0 111.765 -176.985 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 105' ' ' ILE . . . . . . . . . . . . . 10.5 tp -62.45 -26.0 39.32 Favored 'Isoleucine or valine' 0 C--N 1.338 0.075 0 O-C-N 122.111 -0.368 . . . . 0.0 111.672 -174.126 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 24.0 pt20 -69.73 -40.69 76.04 Favored 'General case' 0 N--CA 1.451 -0.404 0 C-N-CA 120.96 -0.296 . . . . 0.0 110.695 -178.765 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 76.8 mm-40 -80.89 -26.15 37.05 Favored 'General case' 0 N--CA 1.454 -0.252 0 CA-C-N 118.367 0.531 . . . . 0.0 110.743 176.696 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 6.8 tt -67.69 -42.59 81.81 Favored 'General case' 0 N--CA 1.454 -0.248 0 N-CA-C 108.891 -0.781 . . . . 0.0 108.891 176.277 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 69.2 mt -68.9 -45.42 70.95 Favored 'General case' 0 N--CA 1.449 -0.475 0 N-CA-C 109.192 -0.67 . . . . 0.0 109.192 173.921 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 43.2 t -47.4 -52.07 17.91 Favored 'General case' 0 C--O 1.234 0.264 0 CA-C-N 118.041 0.382 . . . . 0.0 111.087 178.471 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 40.7 t0 -62.09 -43.8 98.05 Favored 'General case' 0 N--CA 1.455 -0.175 0 N-CA-C 109.135 -0.691 . . . . 0.0 109.135 179.362 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -65.08 -39.69 93.56 Favored 'General case' 0 N--CA 1.45 -0.472 0 N-CA-C 112.237 0.458 . . . . 0.0 112.237 -176.424 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 113' ' ' ILE . . . . . . . . . . . . . 26.8 mm -69.08 -39.44 79.53 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.502 0 CA-C-N 119.133 0.879 . . . . 0.0 109.756 -176.714 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -74.95 -43.83 51.87 Favored 'General case' 0 N--CA 1.453 -0.291 0 C-N-CA 120.624 -0.431 . . . . 0.0 111.878 178.935 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 33.3 ttmt -80.0 -30.74 39.7 Favored 'General case' 0 C--O 1.227 -0.11 0 N-CA-C 113.892 1.071 . . . . 0.0 113.892 -173.159 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 116' ' ' SER . . . . . 0.456 ' HB2' ' CB ' ' A' ' 120' ' ' HIS . 50.6 p -80.0 157.28 26.84 Favored 'General case' 0 CA--C 1.529 0.166 0 N-CA-C 111.974 0.361 . . . . 0.0 111.974 -174.139 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 53.1 t30 -76.21 166.5 23.37 Favored 'General case' 0 N--CA 1.454 -0.226 0 C-N-CA 123.323 0.649 . . . . 0.0 110.269 -179.056 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 118' ' ' GLN . . . . . . . . . . . . . 21.2 mm100 -55.11 -38.46 68.19 Favored 'General case' 0 CA--C 1.528 0.13 0 N-CA-C 112.778 0.658 . . . . 0.0 112.778 -172.426 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 8.0 p30 -69.4 -37.77 77.66 Favored 'General case' 0 N--CA 1.457 -0.084 0 N-CA-C 109.667 -0.494 . . . . 0.0 109.667 178.617 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 120' ' ' HIS . . . . . 0.456 ' CB ' ' HB2' ' A' ' 116' ' ' SER . 31.0 m170 -65.47 -42.11 92.61 Favored 'General case' 0 N--CA 1.45 -0.451 0 N-CA-C 109.445 -0.576 . . . . 0.0 109.445 176.798 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 52.8 mttm -56.74 -38.69 72.75 Favored 'General case' 0 C--N 1.341 0.234 0 N-CA-C 109.299 -0.63 . . . . 0.0 109.299 178.147 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 3.5 tm-20 -68.18 -48.93 63.95 Favored 'General case' 0 N--CA 1.456 -0.142 0 CA-C-O 119.47 -0.3 . . . . 0.0 111.71 179.179 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 40.9 mmtm -58.67 -33.65 70.36 Favored 'General case' 0 N--CA 1.456 -0.133 0 CA-C-N 118.112 0.414 . . . . 0.0 111.05 178.31 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 124' ' ' ILE . . . . . . . . . . . . . 57.1 mt -74.17 -37.41 46.18 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.291 0 N-CA-C 109.606 -0.516 . . . . 0.0 109.606 178.122 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 5.9 tpt180 -68.09 -36.68 80.2 Favored 'General case' 0 N--CA 1.45 -0.451 0 O-C-N 122.07 -0.394 . . . . 0.0 111.066 -176.84 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 126' ' ' MET . . . . . . . . . . . . . 5.6 ppp? -75.05 -27.03 59.86 Favored 'General case' 0 C--O 1.226 -0.139 0 N-CA-C 109.913 -0.402 . . . . 0.0 109.913 176.255 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 1.1 mp -62.11 -39.34 92.18 Favored 'General case' 0 CA--C 1.528 0.119 0 CA-C-N 117.928 0.331 . . . . 0.0 110.269 172.066 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -69.44 -37.81 77.53 Favored 'General case' 0 N--CA 1.457 -0.085 0 CA-C-N 118.162 0.437 . . . . 0.0 109.96 178.158 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 18.6 t70 -59.05 -45.03 91.8 Favored 'General case' 0 N--CA 1.452 -0.337 0 N-CA-C 109.27 -0.641 . . . . 0.0 109.27 175.666 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 55.0 mt -60.14 -35.68 63.19 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.24 0 N-CA-C 110.407 -0.22 . . . . 0.0 110.407 179.909 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 131' ' ' TRP . . . . . . . . . . . . . 46.2 m0 -75.08 -34.58 61.79 Favored 'General case' 0 N--CA 1.453 -0.305 0 N-CA-C 112.937 0.717 . . . . 0.0 112.937 -178.589 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 62.8 m-20 -69.69 -30.36 68.0 Favored 'General case' 0 N--CA 1.456 -0.16 0 CA-C-N 118.313 0.506 . . . . 0.0 110.325 179.107 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 23.3 mtp180 -75.27 -34.49 61.35 Favored 'General case' 0 N--CA 1.455 -0.197 0 C-N-CA 123.393 0.677 . . . . 0.0 109.988 176.439 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 46.6 m -76.74 -14.8 59.9 Favored 'General case' 0 N--CA 1.452 -0.353 0 C-N-CA 123.24 0.616 . . . . 0.0 111.555 -179.943 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 135' ' ' GLY . . . . . . . . . . . . . . . 79.77 16.15 77.91 Favored Glycine 0 CA--C 1.53 1.015 0 CA-C-O 119.341 -0.699 . . . . 0.0 113.773 174.379 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 136' ' ' LEU . . . . . . . . . . . . . 10.7 mp -70.69 -28.58 64.87 Favored 'General case' 0 CA--C 1.53 0.176 0 CA-C-N 118.687 1.244 . . . . 0.0 110.749 179.158 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 137' ' ' PHE . . . . . 0.46 ' C ' ' H ' ' A' ' 139' ' ' LYS . 22.1 m-85 42.69 55.49 4.24 Favored 'General case' 0 CA--C 1.531 0.242 0 C-N-CA 124.014 0.925 . . . . 0.0 112.705 175.12 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 138' ' ' GLN . . . . . . . . . . . . . 18.9 mp0 -69.45 28.35 0.03 OUTLIER 'General case' 0 CA--C 1.534 0.35 0 C-N-CA 123.611 0.765 . . . . 0.0 112.978 -177.784 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 139' ' ' LYS . . . . . 0.46 ' H ' ' C ' ' A' ' 137' ' ' PHE . 65.6 pttt 47.96 20.08 0.22 Allowed 'General case' 0 CA--C 1.532 0.284 0 C-N-CA 125.92 1.688 . . . . 0.0 113.451 -177.854 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 140' ' ' SER . . . . . . . . . . . . . 38.7 t -76.46 54.92 0.96 Allowed 'General case' 0 N--CA 1.455 -0.218 0 C-N-CA 124.464 1.105 . . . . 0.0 111.124 -179.51 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 141' ' ' TYR . . . . . . . . . . . . . 29.8 m-85 -129.36 3.65 5.14 Favored 'General case' 0 CA--C 1.529 0.145 0 N-CA-C 111.869 0.322 . . . . 0.0 111.869 -176.558 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 142' ' ' LEU . . . . . . . . . . . . . 75.0 mt -81.22 165.57 21.37 Favored 'General case' 0 N--CA 1.453 -0.299 0 C-N-CA 122.735 0.414 . . . . 0.0 110.599 178.93 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 74.0 m-20 -61.51 -14.22 27.45 Favored 'General case' 0 CA--C 1.53 0.206 0 C-N-CA 122.449 0.3 . . . . 0.0 110.907 178.032 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 144' ' ' ALA . . . . . 0.469 ' HA ' ' HE3' ' A' ' 148' ' ' LYS . . . -58.82 -31.81 68.81 Favored 'General case' 0 N--CA 1.45 -0.465 0 N-CA-C 109.887 -0.412 . . . . 0.0 109.887 176.735 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 145' ' ' ILE . . . . . . . . . . . . . 26.7 mm -75.1 -27.45 19.83 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.251 0 N-CA-C 109.794 -0.447 . . . . 0.0 109.794 178.549 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 146' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -71.6 -14.77 62.17 Favored 'General case' 0 N--CA 1.454 -0.24 0 N-CA-C 108.77 -0.826 . . . . 0.0 108.77 174.586 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 147' ' ' SER . . . . . . . . . . . . . 17.2 t 65.09 43.47 3.69 Favored 'General case' 0 N--CA 1.454 -0.247 0 N-CA-C 114.136 1.162 . . . . 0.0 114.136 169.282 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 148' ' ' LYS . . . . . 0.469 ' HE3' ' HA ' ' A' ' 144' ' ' ALA . 2.5 mptt 42.25 -85.8 0.01 OUTLIER 'General case' 0 N--CA 1.464 0.263 0 C-N-CA 126.535 1.934 . . . . 0.0 113.963 170.434 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 149' ' ' CYS . . . . . . . . . . . . . 63.4 m -58.7 -39.45 80.79 Favored 'General case' 0 N--CA 1.449 -0.495 0 O-C-N 121.989 -0.444 . . . . 0.0 110.086 -179.075 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 150' ' ' PHE . . . . . . . . . . . . . 91.1 t80 -68.58 -18.26 64.3 Favored 'General case' 0 N--CA 1.453 -0.298 0 CA-C-N 117.983 0.356 . . . . 0.0 111.152 179.942 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 151' ' ' ALA . . . . . . . . . . . . . . . -75.58 -39.88 57.43 Favored 'General case' 0 N--CA 1.451 -0.391 0 O-C-N 121.964 -0.46 . . . . 0.0 110.194 176.199 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 152' ' ' MET . . . . . . . . . . . . . 89.4 mtp -75.75 -36.92 59.73 Favored 'General case' 0 CA--C 1.532 0.287 0 N-CA-C 110.132 -0.321 . . . . 0.0 110.132 175.429 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 153' ' ' ASP . . . . . . . . . . . . . 50.5 m-20 -86.92 14.57 7.1 Favored 'General case' 0 CA--C 1.531 0.238 0 C-N-CA 125.436 1.494 . . . . 0.0 113.119 -178.05 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 154' ' ' LEU . . . . . . . . . . . . . 3.7 pp -57.49 155.34 9.61 Favored 'General case' 0 N--CA 1.456 -0.15 0 CA-C-N 118.575 0.625 . . . . 0.0 111.828 -175.799 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 155' ' ' GLU . . . . . . . . . . . . . 8.1 mp0 -84.13 -41.64 16.87 Favored 'General case' 0 N--CA 1.453 -0.324 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.523 179.431 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 156' ' ' HIS . . . . . . . . . . . . . 98.2 m-70 -156.59 165.14 37.14 Favored 'General case' 0 N--CA 1.455 -0.202 0 C-N-CA 124.349 1.059 . . . . 0.0 109.538 -177.743 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 157' ' ' HIS . . . . . . . . . . . . . 49.7 m170 -84.05 2.4 39.35 Favored 'General case' 0 CA--C 1.53 0.184 0 C-N-CA 123.044 0.538 . . . . 0.0 111.558 178.208 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 158' ' ' HIS . . . . . . . . . . . . . 69.7 m-70 -72.56 -7.68 51.37 Favored 'General case' 0 CA--C 1.529 0.137 0 N-CA-C 112.523 0.564 . . . . 0.0 112.523 -177.211 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 159' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 C--O 1.251 1.166 0 CA-C-O 117.527 -1.225 . . . . 0.0 110.518 178.932 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B 2052 ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.476 0.843 0 N-CA-C 109.8 -0.445 . . . . 0.0 109.8 . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B 2053 ' ' ASP . . . . . . . . . . . . . 6.3 p-10 -71.91 163.01 28.6 Favored 'General case' 0 N--CA 1.449 -0.479 0 N-CA-C 107.764 -1.199 . . . . 0.0 107.764 171.01 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B 2054 ' ' ASP . . . . . . . . . . . . . 41.2 t0 62.79 170.89 0.14 Allowed 'General case' 0 CA--C 1.535 0.366 0 CA-C-O 121.669 0.747 . . . . 0.0 111.026 -173.369 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B 2055 ' ' GLU . . . . . . . . . . . . . 63.2 tt0 -68.05 90.78 0.33 Allowed 'General case' 0 N--CA 1.451 -0.378 0 C-N-CA 125.265 1.426 . . . . 0.0 109.709 179.469 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B 2056 ' ' ASP . . . . . . . . . . . . . 18.1 p30 -72.27 7.2 1.84 Allowed 'General case' 0 CA--C 1.534 0.35 0 N-CA-C 113.166 0.802 . . . . 0.0 113.166 -174.5 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B 2057 ' ' ASP . . . . . . . . . . . . . 65.7 t0 -155.42 94.77 1.63 Allowed 'General case' 0 N--CA 1.454 -0.252 0 N-CA-C 107.725 -1.213 . . . . 0.0 107.725 168.988 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B 2058 ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -67.77 2.57 1.86 Allowed 'General case' 0 C--N 1.34 0.179 0 N-CA-C 113.367 0.877 . . . . 0.0 113.367 -173.898 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B 2059 ' ' THR . . . . . . . . . . . . . 38.0 m 44.48 74.18 0.84 Allowed Pre-proline 0 C--N 1.34 0.16 0 C-N-CA 124.66 1.184 . . . . 0.0 111.771 169.691 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B 2060 ' ' PRO . . . . . . . . . . . . . 55.2 Cg_endo -65.97 122.42 9.97 Favored 'Trans proline' 0 N--CA 1.451 -0.971 0 C-N-CA 123.076 2.518 . . . . 0.0 110.733 -176.119 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B 2061 ' ' SER . . . . . . . . . . . . . 39.5 t -75.16 144.23 42.87 Favored 'General case' 0 N--CA 1.452 -0.361 0 CA-C-N 116.222 -0.444 . . . . 0.0 109.904 177.153 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B 2062 ' ' ILE . . . . . . . . . . . . . 6.4 tp -159.83 141.8 4.61 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.204 0 CA-C-O 120.792 0.33 . . . . 0.0 110.733 -178.1 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B 2063 ' ' SER . . . . . . . . . . . . . 31.2 t . . . . . 0 C--O 1.252 1.201 0 CA-C-O 117.819 -1.086 . . . . 0.0 110.465 -178.932 . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 86.2 mmm . . . . . 0 N--CA 1.472 0.671 0 CA-C-O 120.289 0.09 . . . . 0.0 110.898 . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 2' ' ' GLN . . . . . 0.492 ' HG2' ' H ' ' A' ' 3' ' ' GLN . 7.8 tt0 -159.33 -164.81 1.44 Allowed 'General case' 0 N--CA 1.454 -0.228 0 N-CA-C 107.901 -1.148 . . . . 0.0 107.901 178.099 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . 0.492 ' H ' ' HG2' ' A' ' 2' ' ' GLN . 19.5 mm100 -73.97 41.45 0.13 Allowed 'General case' 0 CA--C 1.532 0.262 0 C-N-CA 123.425 0.69 . . . . 0.0 111.564 -179.802 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 84.6 m-20 56.77 14.38 1.78 Allowed 'General case' 0 C--N 1.34 0.191 0 C-N-CA 124.595 1.158 . . . . 0.0 113.314 -174.495 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 31.8 p30 -99.83 4.15 45.07 Favored 'General case' 0 C--N 1.329 -0.295 0 C-N-CA 123.848 0.859 . . . . 0.0 110.421 175.641 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 23.5 p-10 -90.56 -30.58 17.14 Favored 'General case' 0 N--CA 1.451 -0.408 0 N-CA-C 107.003 -1.48 . . . . 0.0 107.003 171.256 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 7' ' ' PHE . . . . . 0.65 ' HB2' ' HZ2' ' A' ' 45' ' ' LYS . 1.5 t80 -54.58 -34.45 61.95 Favored 'General case' 0 N--CA 1.45 -0.447 0 CA-C-N 114.839 -1.073 . . . . 0.0 109.311 175.006 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 50.9 tp60 -51.82 -35.64 45.06 Favored 'General case' 0 N--CA 1.454 -0.234 0 C-N-CA 124.564 1.145 . . . . 0.0 111.802 -178.157 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 30.3 m-80 -73.0 -34.13 66.21 Favored 'General case' 0 N--CA 1.455 -0.196 0 N-CA-C 109.826 -0.435 . . . . 0.0 109.826 -179.762 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 10' ' ' PHE . . . . . 0.452 ' CE2' ' HB2' ' A' ' 32' ' ' LEU . 5.1 t80 -69.54 -38.95 77.69 Favored 'General case' 0 N--CA 1.447 -0.59 0 C-N-CA 123.57 0.748 . . . . 0.0 109.166 175.774 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 93.3 t -65.47 -53.18 42.52 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.426 0 N-CA-C 109.167 -0.679 . . . . 0.0 109.167 178.548 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -57.59 -29.18 64.26 Favored 'General case' 0 N--CA 1.454 -0.246 0 C-N-CA 122.554 0.341 . . . . 0.0 111.359 178.884 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 87.2 m -72.31 -39.1 68.5 Favored 'General case' 0 N--CA 1.456 -0.16 0 N-CA-C 109.345 -0.613 . . . . 0.0 109.345 176.263 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -64.74 -45.61 85.73 Favored 'General case' 0 N--CA 1.454 -0.236 0 N-CA-C 109.457 -0.572 . . . . 0.0 109.457 178.356 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 57.5 mm-40 -63.83 -32.12 73.53 Favored 'General case' 0 N--CA 1.453 -0.302 0 N-CA-C 109.357 -0.609 . . . . 0.0 109.357 178.37 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 69.7 m -66.25 -34.13 77.32 Favored 'General case' 0 N--CA 1.45 -0.473 0 CA-C-O 118.722 -0.656 . . . . 0.0 110.188 177.456 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 42.8 m-85 -67.77 -39.33 84.13 Favored 'General case' 0 C--N 1.343 0.296 0 CA-C-N 119.036 0.835 . . . . 0.0 110.152 176.274 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . 0.418 ' HG2' ' CE1' ' A' ' 53' ' ' TYR . 46.0 mttt -60.14 -31.2 69.86 Favored 'General case' 0 C--N 1.341 0.208 0 CA-C-N 118.285 0.493 . . . . 0.0 109.844 -179.715 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 45.8 t0 -74.71 -16.78 60.74 Favored 'General case' 0 CA--C 1.534 0.359 0 CA-C-N 115.33 -0.85 . . . . 0.0 112.36 -179.676 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 81.8 mt -73.29 158.72 34.59 Favored 'General case' 0 N--CA 1.456 -0.138 0 O-C-N 121.528 -0.732 . . . . 0.0 112.07 -176.796 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 1.5 mppt? -98.3 -2.97 38.24 Favored 'General case' 0 CA--C 1.533 0.317 0 CA-C-N 115.106 -0.952 . . . . 0.0 109.7 176.087 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 87.0 p -120.65 -20.08 7.2 Favored 'General case' 0 C--N 1.34 0.168 0 C-N-CA 123.885 0.874 . . . . 0.0 111.031 179.428 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 77.03 -28.71 1.63 Allowed Glycine 0 CA--C 1.53 0.986 0 C-N-CA 124.093 0.854 . . . . 0.0 111.952 179.424 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 92.8 mt -85.89 150.21 3.98 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.341 0 N-CA-C 108.889 -0.782 . . . . 0.0 108.889 175.181 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 25' ' ' SER . . . . . 0.492 ' HA ' ' HA ' ' B' 2056 ' ' ASP . 29.7 t -161.56 94.96 0.99 Allowed 'General case' 0 CA--C 1.513 -0.47 0 N-CA-C 109.159 -0.682 . . . . 0.0 109.159 170.006 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . 0.588 ' H ' ' HA ' ' B' 2056 ' ' ASP . . . -55.56 -34.56 60.36 Favored Glycine 0 N--CA 1.445 -0.722 0 N-CA-C 110.881 -0.887 . . . . 0.0 110.881 -177.646 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 15.8 t -65.28 -54.44 29.24 Favored 'General case' 0 N--CA 1.455 -0.218 0 CA-C-N 118.334 1.067 . . . . 0.0 109.905 179.327 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 17.4 mmt85 -68.19 -38.06 81.61 Favored 'General case' 0 N--CA 1.455 -0.217 0 C-N-CA 122.3 0.24 . . . . 0.0 110.69 -176.523 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 75.6 mt -59.71 -43.49 91.55 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.634 0 N-CA-C 108.615 -0.883 . . . . 0.0 108.615 176.109 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 31.6 mtmm -67.02 -27.61 67.55 Favored 'General case' 0 C--N 1.34 0.19 0 CA-C-O 118.928 -0.558 . . . . 0.0 111.466 178.108 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.55 -58.61 5.38 Favored 'General case' 0 C--N 1.343 0.291 0 CA-C-N 118.848 0.749 . . . . 0.0 110.028 -179.969 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . 0.452 ' HB2' ' CE2' ' A' ' 10' ' ' PHE . 2.3 pp -75.31 -19.23 59.77 Favored 'General case' 0 CA--C 1.529 0.144 0 C-N-CA 119.887 -0.725 . . . . 0.0 111.589 -175.964 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 37.9 m -71.61 -40.93 69.49 Favored 'General case' 0 N--CA 1.456 -0.158 0 N-CA-C 107.8 -1.185 . . . . 0.0 107.8 176.517 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 92.6 m -68.21 -37.24 80.67 Favored 'General case' 0 N--CA 1.453 -0.323 0 C-N-CA 121.078 -0.249 . . . . 0.0 110.384 -178.563 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 24.1 t80 -63.06 -37.62 87.93 Favored 'General case' 0 N--CA 1.456 -0.135 0 N-CA-C 109.992 -0.373 . . . . 0.0 109.992 175.749 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -73.52 -36.5 65.73 Favored 'General case' 0 N--CA 1.45 -0.434 0 C-N-CA 122.471 0.309 . . . . 0.0 110.761 -179.026 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -71.32 -34.58 70.69 Favored 'General case' 0 N--CA 1.455 -0.183 0 C-N-CA 122.568 0.347 . . . . 0.0 110.547 179.363 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 43.5 t0 -69.72 -22.81 63.36 Favored 'General case' 0 CA--C 1.534 0.344 0 C-N-CA 122.544 0.338 . . . . 0.0 110.745 176.462 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 96.5 m-70 -151.68 101.23 2.76 Favored 'General case' 0 N--CA 1.454 -0.24 0 N-CA-C 111.914 0.338 . . . . 0.0 111.914 -175.461 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 40' ' ' ILE . . . . . 0.518 ' H ' HD12 ' A' ' 40' ' ' ILE . 0.0 OUTLIER -78.67 -12.78 13.57 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.294 0 N-CA-C 109.728 -0.471 . . . . 0.0 109.728 174.187 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 17.2 m-20 -57.87 -19.43 29.28 Favored 'General case' 0 N--CA 1.454 -0.235 0 C-N-CA 123.774 0.83 . . . . 0.0 112.655 -176.817 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -112.29 19.82 6.79 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.245 0 C-N-CA 123.31 0.644 . . . . 0.0 111.388 178.091 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 3.1 pp20? -52.89 -28.1 21.64 Favored 'General case' 0 CA--C 1.532 0.255 0 O-C-N 121.856 -0.528 . . . . 0.0 111.728 178.055 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 36.6 t -64.97 -48.42 74.11 Favored 'General case' 0 CA--C 1.532 0.269 0 N-CA-C 111.634 0.235 . . . . 0.0 111.634 -177.26 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . 0.65 ' HZ2' ' HB2' ' A' ' 7' ' ' PHE . 17.6 ptpt -73.35 -23.6 60.24 Favored 'General case' 0 C--N 1.341 0.2 0 CA-C-N 117.95 0.341 . . . . 0.0 110.398 179.275 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 67.1 mt -72.58 -51.19 29.63 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.318 0 C-N-CA 122.999 0.52 . . . . 0.0 110.278 -178.835 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 36.6 mm -66.78 -38.35 81.33 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.352 0 N-CA-C 109.996 -0.372 . . . . 0.0 109.996 -179.716 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 33.3 t -67.85 -34.98 77.74 Favored 'General case' 0 N--CA 1.454 -0.272 0 C-N-CA 120.778 -0.369 . . . . 0.0 111.378 -179.046 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 39.7 tp -77.79 -33.67 52.5 Favored 'General case' 0 N--CA 1.451 -0.395 0 O-C-N 121.652 -0.655 . . . . 0.0 112.407 -176.46 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 4.2 pt -70.28 -43.08 78.83 Favored 'Isoleucine or valine' 0 C--N 1.34 0.173 0 CA-C-N 118.832 0.742 . . . . 0.0 110.378 177.55 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 32.3 pt -63.12 -37.32 79.09 Favored 'Isoleucine or valine' 0 N--CA 1.461 0.101 0 C-N-CA 119.444 -0.903 . . . . 0.0 110.766 177.949 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 92.6 m-20 -68.51 -41.5 79.87 Favored 'General case' 0 N--CA 1.452 -0.346 0 O-C-N 121.937 -0.477 . . . . 0.0 111.571 178.409 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 53' ' ' TYR . . . . . 0.418 ' CE1' ' HG2' ' A' ' 18' ' ' LYS . 11.2 t80 -64.15 -42.75 96.66 Favored 'General case' 0 CA--C 1.523 -0.078 0 CA-C-N 118.891 0.769 . . . . 0.0 109.227 177.027 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 24.1 t -68.75 -24.72 64.48 Favored 'General case' 0 N--CA 1.453 -0.323 0 N-CA-C 112.105 0.409 . . . . 0.0 112.105 -176.665 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 73.4 mtm180 -86.18 -31.72 21.62 Favored 'General case' 0 N--CA 1.457 -0.094 0 CA-C-N 118.7 0.682 . . . . 0.0 111.823 179.946 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 47.4 mt -84.86 -43.6 13.98 Favored 'General case' 0 CA--C 1.528 0.118 0 N-CA-C 113.02 0.748 . . . . 0.0 113.02 -179.22 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 16.7 p -60.65 155.26 51.76 Favored Pre-proline 0 CA--C 1.538 0.493 0 N-CA-C 113.705 1.002 . . . . 0.0 113.705 -173.322 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 72.3 Cg_endo -75.67 -177.76 3.82 Favored 'Trans proline' 0 N--CA 1.457 -0.619 0 C-N-CA 124.848 3.698 . . . . 0.0 111.545 177.188 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -55.02 -50.91 67.87 Favored 'General case' 0 CA--C 1.53 0.201 0 N-CA-C 114.908 1.447 . . . . 0.0 114.908 -171.913 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 45.3 m -66.99 -39.34 87.12 Favored 'General case' 0 C--N 1.331 -0.199 0 O-C-N 121.743 -0.598 . . . . 0.0 109.964 -176.609 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 71.2 m80 -75.43 -17.47 60.16 Favored 'General case' 0 N--CA 1.45 -0.437 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.526 177.378 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 10.9 tppt? -66.95 -45.08 78.88 Favored 'General case' 0 N--CA 1.457 -0.086 0 N-CA-C 109.065 -0.716 . . . . 0.0 109.065 174.081 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -63.91 -42.76 97.32 Favored 'General case' 0 N--CA 1.454 -0.267 0 N-CA-C 108.32 -0.993 . . . . 0.0 108.32 177.789 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -66.15 -33.84 86.47 Favored Glycine 0 CA--C 1.53 0.98 0 N-CA-C 111.95 -0.46 . . . . 0.0 111.95 178.331 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 63.2 m -64.74 -42.16 95.39 Favored 'General case' 0 N--CA 1.456 -0.141 0 CA-C-N 117.927 0.864 . . . . 0.0 110.342 177.601 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 80.0 mt -68.71 -27.23 65.76 Favored 'General case' 0 N--CA 1.455 -0.224 0 N-CA-C 110.277 -0.268 . . . . 0.0 110.277 179.421 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 1.0 OUTLIER -68.42 -38.73 81.48 Favored 'General case' 0 N--CA 1.455 -0.203 0 CA-C-N 117.736 0.244 . . . . 0.0 111.413 175.739 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 68' ' ' ILE . . . . . . . . . . . . . 14.7 mt -66.42 -53.64 34.09 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.445 0 N-CA-C 109.178 -0.675 . . . . 0.0 109.178 176.679 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 81.3 mt -50.27 -37.11 13.79 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.19 0 C-N-CA 124.233 1.013 . . . . 0.0 111.678 174.413 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 12.8 t70 -69.05 -46.2 68.47 Favored 'General case' 0 N--CA 1.455 -0.195 0 CA-C-N 118.292 0.496 . . . . 0.0 111.109 179.915 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 30.7 t -64.06 -55.51 21.64 Favored 'General case' 0 N--CA 1.45 -0.464 0 CA-C-N 116.58 -0.282 . . . . 0.0 110.646 -175.968 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -74.36 -32.9 32.25 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.246 0 N-CA-C 110.192 -0.299 . . . . 0.0 110.192 -177.18 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -66.7 -55.26 18.14 Favored Glycine 0 C--N 1.34 0.777 0 N-CA-C 111.589 -0.604 . . . . 0.0 111.589 -174.555 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 33.9 mtm105 -68.7 -37.52 79.58 Favored 'General case' 0 N--CA 1.455 -0.182 0 C-N-CA 120.099 -0.64 . . . . 0.0 110.088 179.158 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -64.7 -29.95 70.96 Favored 'General case' 0 N--CA 1.452 -0.368 0 C-N-CA 120.1 -0.64 . . . . 0.0 110.624 -179.624 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 1.3 m-30 -69.73 -46.0 66.89 Favored 'General case' 0 N--CA 1.454 -0.274 0 CA-C-N 118.401 0.546 . . . . 0.0 110.494 175.832 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -65.01 -49.09 71.57 Favored 'General case' 0 N--CA 1.449 -0.475 0 C-N-CA 118.788 -1.165 . . . . 0.0 108.047 -179.634 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 89.2 m-20 -55.92 -44.34 78.21 Favored 'General case' 0 CA--C 1.53 0.176 0 N-CA-C 112.725 0.639 . . . . 0.0 112.725 -179.689 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 8.3 tm-20 -63.42 -51.85 64.02 Favored 'General case' 0 N--CA 1.45 -0.438 0 CA-C-N 118.548 0.613 . . . . 0.0 111.32 -178.808 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 59.2 p -65.47 -26.24 67.84 Favored 'General case' 0 N--CA 1.454 -0.237 0 CA-C-N 117.83 0.286 . . . . 0.0 110.567 -179.957 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 35.5 ttp180 -75.62 -20.07 58.79 Favored 'General case' 0 N--CA 1.448 -0.542 0 C-N-CA 123.937 0.895 . . . . 0.0 111.051 174.349 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 27.5 m -95.85 -35.46 11.48 Favored 'General case' 0 CA--C 1.53 0.198 0 C-N-CA 122.924 0.49 . . . . 0.0 111.82 179.476 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 4.9 m-80 -145.69 156.11 43.42 Favored 'General case' 0 N--CA 1.456 -0.146 0 C-N-CA 122.946 0.498 . . . . 0.0 110.803 -176.643 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 42.7 t -80.73 139.66 35.98 Favored 'General case' 0 N--CA 1.455 -0.221 0 N-CA-C 109.767 -0.457 . . . . 0.0 109.767 174.03 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 6.4 m120 -87.12 164.01 16.65 Favored 'General case' 0 N--CA 1.454 -0.243 0 CA-C-O 120.673 0.273 . . . . 0.0 110.431 177.484 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 88.1 p -82.58 12.21 4.88 Favored 'General case' 0 CA--C 1.529 0.168 0 C-N-CA 123.364 0.665 . . . . 0.0 111.353 178.306 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 42.1 t -67.39 161.97 24.02 Favored 'General case' 0 N--CA 1.454 -0.275 0 C-N-CA 123.205 0.602 . . . . 0.0 111.186 179.55 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 44.9 t -139.71 13.71 2.51 Favored 'General case' 0 CA--C 1.531 0.24 0 C-N-CA 123.256 0.623 . . . . 0.0 110.597 179.068 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 9.9 m120 -148.28 172.72 13.93 Favored 'General case' 0 N--CA 1.454 -0.254 0 C-N-CA 124.168 0.987 . . . . 0.0 108.879 -178.168 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 90' ' ' LYS . . . . . 0.41 ' N ' ' HD2' ' A' ' 91' ' ' PRO . 81.5 tttt -66.37 -51.35 43.53 Favored Pre-proline 0 N--CA 1.451 -0.38 0 CA-C-O 118.431 -0.795 . . . . 0.0 110.629 177.444 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 91' ' ' PRO . . . . . 0.41 ' HD2' ' N ' ' A' ' 90' ' ' LYS . 67.2 Cg_endo -67.34 154.97 72.39 Favored 'Trans proline' 0 N--CA 1.453 -0.899 0 C-N-CA 122.18 1.92 . . . . 0.0 109.193 172.146 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 85.55 16.25 64.43 Favored Glycine 0 CA--C 1.525 0.674 0 N-CA-C 110.788 -0.925 . . . . 0.0 110.788 -176.272 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -155.8 167.15 31.33 Favored 'General case' 0 N--CA 1.454 -0.255 0 C-N-CA 123.7 0.8 . . . . 0.0 109.333 -179.218 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 94' ' ' CYS . . . . . . . . . . . . . 30.1 p -58.15 -20.01 37.32 Favored 'General case' 0 N--CA 1.453 -0.307 0 C-N-CA 122.703 0.401 . . . . 0.0 110.807 179.087 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -58.53 -60.47 3.74 Favored 'General case' 0 N--CA 1.447 -0.577 0 C-N-CA 122.34 0.256 . . . . 0.0 110.702 -176.514 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 75.3 t60 -74.01 -32.65 63.48 Favored 'General case' 0 N--CA 1.451 -0.407 0 C-N-CA 121.003 -0.279 . . . . 0.0 110.496 -179.86 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -64.46 -53.44 48.15 Favored 'General case' 0 N--CA 1.451 -0.402 0 C-N-CA 122.407 0.283 . . . . 0.0 111.124 -176.26 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 1.7 mp -72.42 -33.12 44.6 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.291 0 N-CA-C 110.056 -0.35 . . . . 0.0 110.056 -178.737 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 1.4 m120 -66.42 -41.25 89.49 Favored 'General case' 0 C--O 1.225 -0.199 0 CA-C-N 118.27 0.486 . . . . 0.0 111.1 177.976 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 96.7 m -73.5 -32.59 64.35 Favored 'General case' 0 N--CA 1.457 -0.122 0 CA-C-N 118.242 0.474 . . . . 0.0 110.894 -177.675 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 60.5 tp -73.2 -39.6 65.44 Favored 'General case' 0 N--CA 1.45 -0.463 0 N-CA-C 111.528 0.196 . . . . 0.0 111.528 -177.268 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -69.31 -16.9 71.74 Favored Glycine 0 CA--C 1.529 0.944 0 CA-C-O 119.713 -0.493 . . . . 0.0 114.031 -173.828 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 6.2 mm-40 -87.76 -32.08 19.31 Favored 'General case' 0 CA--C 1.52 -0.173 0 CA-C-N 118.322 1.061 . . . . 0.0 111.538 178.92 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 81.7 t -93.69 -20.68 6.23 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.09 0 C-N-CA 122.759 0.424 . . . . 0.0 112.119 -177.499 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 105' ' ' ILE . . . . . . . . . . . . . 10.7 tp -60.54 -22.5 25.9 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.224 0 O-C-N 121.571 -0.706 . . . . 0.0 112.099 -175.167 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 26.4 pt20 -67.77 -25.67 65.73 Favored 'General case' 0 CA--C 1.53 0.201 0 O-C-N 121.982 -0.448 . . . . 0.0 110.511 177.236 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 72.2 mt-10 -74.3 -43.04 58.43 Favored 'General case' 0 N--CA 1.454 -0.254 0 N-CA-C 109.474 -0.565 . . . . 0.0 109.474 176.816 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 10.4 mp -67.4 -45.11 77.14 Favored 'General case' 0 N--CA 1.452 -0.364 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.239 -177.847 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 3.0 mp -65.94 -53.33 40.59 Favored 'General case' 0 N--CA 1.451 -0.379 0 CA-C-O 119.146 -0.454 . . . . 0.0 110.584 -178.219 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 15.4 m -54.39 -47.22 72.94 Favored 'General case' 0 C--O 1.233 0.198 0 CA-C-N 118.139 0.427 . . . . 0.0 110.501 -178.262 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 40.5 t0 -62.21 -43.37 98.98 Favored 'General case' 0 N--CA 1.452 -0.365 0 N-CA-C 109.309 -0.626 . . . . 0.0 109.309 178.117 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -67.87 -36.89 81.05 Favored 'General case' 0 N--CA 1.447 -0.619 0 CA-C-O 119.135 -0.46 . . . . 0.0 111.438 -175.148 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 113' ' ' ILE . . . . . 0.487 ' O ' ' HE2' ' A' ' 121' ' ' LYS . 19.9 mm -68.79 -40.85 81.94 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.426 0 C-N-CA 118.805 -1.158 . . . . 0.0 110.1 -179.434 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -75.56 -39.09 58.7 Favored 'General case' 0 N--CA 1.454 -0.237 0 N-CA-C 112.837 0.68 . . . . 0.0 112.837 179.836 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 115' ' ' LYS . . . . . 0.598 ' HE2' ' HA ' ' A' ' 115' ' ' LYS . 0.6 OUTLIER -78.85 -38.41 38.0 Favored 'General case' 0 N--CA 1.456 -0.165 0 N-CA-C 113.342 0.867 . . . . 0.0 113.342 -177.711 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 116' ' ' SER . . . . . 0.446 ' HB2' ' CB ' ' A' ' 120' ' ' HIS . 52.6 p -74.56 157.23 35.82 Favored 'General case' 0 CA--C 1.529 0.146 0 CA-C-N 117.918 0.326 . . . . 0.0 111.744 -172.628 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 56.5 t30 -79.57 166.21 22.15 Favored 'General case' 0 CA--C 1.531 0.23 0 C-N-CA 122.877 0.471 . . . . 0.0 110.61 -178.997 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 118' ' ' GLN . . . . . . . . . . . . . 3.4 pt20 -49.1 -46.27 44.51 Favored 'General case' 0 CA--C 1.532 0.25 0 N-CA-C 112.823 0.675 . . . . 0.0 112.823 -174.34 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 6.8 p30 -65.42 -35.85 82.18 Favored 'General case' 0 N--CA 1.456 -0.149 0 C-N-CA 123.059 0.544 . . . . 0.0 111.358 179.122 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 120' ' ' HIS . . . . . 0.446 ' CB ' ' HB2' ' A' ' 116' ' ' SER . 32.3 m170 -68.12 -43.91 77.3 Favored 'General case' 0 N--CA 1.448 -0.544 0 N-CA-C 110.145 -0.317 . . . . 0.0 110.145 176.666 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 121' ' ' LYS . . . . . 0.487 ' HE2' ' O ' ' A' ' 113' ' ' ILE . 76.0 mttt -57.0 -38.99 73.85 Favored 'General case' 0 C--N 1.342 0.254 0 N-CA-C 109.514 -0.55 . . . . 0.0 109.514 179.896 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 2.8 tm-20 -65.43 -47.61 75.61 Favored 'General case' 0 N--CA 1.456 -0.172 0 C-N-CA 122.402 0.281 . . . . 0.0 110.614 178.905 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 62.4 mttp -65.95 -28.92 69.27 Favored 'General case' 0 N--CA 1.454 -0.233 0 CA-C-O 119.836 -0.126 . . . . 0.0 111.075 -179.558 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 124' ' ' ILE . . . . . . . . . . . . . 59.2 mt -70.73 -42.97 77.7 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.297 0 N-CA-C 109.436 -0.579 . . . . 0.0 109.436 176.071 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 125' ' ' ARG . . . . . 0.415 ' HA ' HH11 ' A' ' 125' ' ' ARG . 7.3 mmm180 -59.27 -46.39 88.67 Favored 'General case' 0 N--CA 1.451 -0.383 0 CA-C-O 118.982 -0.532 . . . . 0.0 111.236 -179.503 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 126' ' ' MET . . . . . . . . . . . . . 27.6 ptm -65.47 -33.47 76.0 Favored 'General case' 0 N--CA 1.451 -0.401 0 C-N-CA 119.278 -0.969 . . . . 0.0 109.66 178.814 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 18.7 tp -69.61 -31.72 70.01 Favored 'General case' 0 CA--C 1.533 0.307 0 CA-C-N 118.025 0.375 . . . . 0.0 111.617 179.654 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 92.9 mt -75.76 -38.06 58.73 Favored 'General case' 0 N--CA 1.456 -0.167 0 O-C-N 121.909 -0.494 . . . . 0.0 110.531 177.378 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 129' ' ' ASP . . . . . 0.427 ' O ' ' HD2' ' A' ' 133' ' ' ARG . 54.7 m-20 -60.29 -38.23 82.97 Favored 'General case' 0 N--CA 1.454 -0.226 0 N-CA-C 109.117 -0.698 . . . . 0.0 109.117 176.031 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 130' ' ' ILE . . . . . 0.455 HG22 ' CG2' ' B' 2062 ' ' ILE . 36.5 mt -63.15 -40.7 90.02 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.359 0 C-N-CA 124.32 1.048 . . . . 0.0 110.816 176.08 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 131' ' ' TRP . . . . . . . . . . . . . 48.7 m0 -68.22 -39.5 82.35 Favored 'General case' 0 N--CA 1.452 -0.349 0 C-N-CA 120.009 -0.677 . . . . 0.0 111.178 176.949 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 50.4 m-20 -64.39 -28.91 70.01 Favored 'General case' 0 CA--C 1.531 0.227 0 CA-C-N 117.97 0.35 . . . . 0.0 110.773 179.451 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 133' ' ' ARG . . . . . 0.427 ' HD2' ' O ' ' A' ' 129' ' ' ASP . 33.2 mtt85 -74.77 -34.67 62.51 Favored 'General case' 0 C--N 1.339 0.145 0 C-N-CA 122.997 0.519 . . . . 0.0 111.087 175.125 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 25.6 p -72.26 -15.35 61.92 Favored 'General case' 0 N--CA 1.452 -0.333 0 N-CA-C 112.813 0.671 . . . . 0.0 112.813 -172.955 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 135' ' ' GLY . . . . . . . . . . . . . . . 83.16 11.24 81.32 Favored Glycine 0 CA--C 1.529 0.944 0 CA-C-O 119.393 -0.67 . . . . 0.0 112.759 179.6 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 136' ' ' LEU . . . . . . . . . . . . . 20.5 mt -60.84 165.37 4.07 Favored 'General case' 0 CA--C 1.531 0.248 0 CA-C-N 118.05 0.925 . . . . 0.0 110.032 175.403 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 137' ' ' PHE . . . . . . . . . . . . . 7.4 t80 -72.9 57.13 0.43 Allowed 'General case' 0 CA--C 1.531 0.23 0 C-N-CA 123.924 0.89 . . . . 0.0 111.123 -179.105 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 138' ' ' GLN . . . . . . . . . . . . . 16.1 mm100 -68.55 168.81 12.16 Favored 'General case' 0 N--CA 1.451 -0.383 0 C-N-CA 124.289 1.036 . . . . 0.0 110.72 178.429 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 139' ' ' LYS . . . . . . . . . . . . . 34.9 mmtp -130.15 162.09 29.64 Favored 'General case' 0 N--CA 1.453 -0.298 0 N-CA-C 108.994 -0.743 . . . . 0.0 108.994 -178.398 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 140' ' ' SER . . . . . . . . . . . . . 44.2 t -63.77 156.69 26.46 Favored 'General case' 0 N--CA 1.452 -0.346 0 CA-C-O 120.815 0.34 . . . . 0.0 110.202 179.48 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 141' ' ' TYR . . . . . . . . . . . . . 10.1 m-30 -76.49 53.91 0.89 Allowed 'General case' 0 CA--C 1.532 0.266 0 C-N-CA 123.219 0.607 . . . . 0.0 110.175 -179.847 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 142' ' ' LEU . . . . . . . . . . . . . 2.5 pt? -62.57 172.54 1.56 Allowed 'General case' 0 CA--C 1.531 0.226 0 N-CA-C 112.19 0.441 . . . . 0.0 112.19 -176.652 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 4.1 m120 -53.0 -23.75 8.04 Favored 'General case' 0 N--CA 1.455 -0.176 0 C-N-CA 124.103 0.961 . . . . 0.0 113.057 -173.545 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . -71.58 -51.77 21.62 Favored 'General case' 0 N--CA 1.452 -0.338 0 CA-C-N 118.435 0.561 . . . . 0.0 109.949 178.729 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 145' ' ' ILE . . . . . . . . . . . . . 26.3 mm -64.76 -31.16 52.61 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.265 0 N-CA-C 110.206 -0.294 . . . . 0.0 110.206 178.134 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 146' ' ' ARG . . . . . . . . . . . . . 30.7 tpt180 -67.94 -37.1 81.2 Favored 'General case' 0 N--CA 1.452 -0.334 0 C-N-CA 122.886 0.474 . . . . 0.0 110.386 179.976 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 147' ' ' SER . . . . . . . . . . . . . 33.2 t 44.34 32.03 0.65 Allowed 'General case' 0 CA--C 1.535 0.397 0 C-N-CA 123.857 0.863 . . . . 0.0 112.767 176.859 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 48.12 -122.59 1.54 Allowed 'General case' 0 CA--C 1.536 0.44 0 C-N-CA 124.577 1.151 . . . . 0.0 112.4 176.893 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 149' ' ' CYS . . . . . . . . . . . . . 49.4 m -58.68 -28.9 66.18 Favored 'General case' 0 N--CA 1.455 -0.219 0 N-CA-C 112.815 0.672 . . . . 0.0 112.815 -173.836 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 150' ' ' PHE . . . . . . . . . . . . . 82.0 m-85 -64.34 -22.04 66.82 Favored 'General case' 0 N--CA 1.453 -0.307 0 CA-C-O 119.252 -0.404 . . . . 0.0 111.332 -177.523 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 151' ' ' ALA . . . . . . . . . . . . . . . -94.34 -28.61 15.46 Favored 'General case' 0 N--CA 1.456 -0.13 0 CA-C-N 118.202 0.455 . . . . 0.0 110.312 171.57 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 152' ' ' MET . . . . . . . . . . . . . 95.2 mtp -64.86 -14.59 59.98 Favored 'General case' 0 N--CA 1.456 -0.175 0 N-CA-C 111.631 0.234 . . . . 0.0 111.631 179.149 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 153' ' ' ASP . . . . . . . . . . . . . 69.7 m-20 -58.7 -16.79 18.07 Favored 'General case' 0 CA--C 1.53 0.191 0 N-CA-C 112.205 0.446 . . . . 0.0 112.205 171.974 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 154' ' ' LEU . . . . . . . . . . . . . 40.0 mt -104.45 13.86 31.12 Favored 'General case' 0 C--N 1.34 0.194 0 C-N-CA 123.062 0.545 . . . . 0.0 110.96 176.937 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 155' ' ' GLU . . . . . . . . . . . . . 57.9 mt-10 -127.51 14.3 7.07 Favored 'General case' 0 CA--C 1.536 0.418 0 C-N-CA 123.095 0.558 . . . . 0.0 112.34 -174.758 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 156' ' ' HIS . . . . . . . . . . . . . 48.0 m170 -65.51 -2.36 3.3 Favored 'General case' 0 N--CA 1.456 -0.165 0 O-C-N 121.787 -0.571 . . . . 0.0 111.498 175.605 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 157' ' ' HIS . . . . . . . . . . . . . 11.7 m80 -80.19 -4.66 53.97 Favored 'General case' 0 C--O 1.236 0.36 0 C-N-CA 124.86 1.264 . . . . 0.0 112.645 -179.485 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 158' ' ' HIS . . . . . . . . . . . . . 63.8 t60 -70.38 159.38 34.26 Favored 'General case' 0 C--O 1.243 0.735 0 C-N-CA 124.437 1.095 . . . . 0.0 110.048 -179.526 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 159' ' ' HIS . . . . . . . . . . . . . 17.8 t-160 . . . . . 0 CA--C 1.569 1.693 0 CA-C-O 115.589 -2.148 . . . . 0.0 112.891 -179.962 . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' B' B 2052 ' ' ASP . . . . . . . . . . . . . 21.0 p-10 . . . . . 0 N--CA 1.476 0.859 0 N-CA-C 110.395 -0.224 . . . . 0.0 110.395 . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' B' B 2053 ' ' ASP . . . . . . . . . . . . . 35.7 m-20 -85.13 158.89 20.27 Favored 'General case' 0 N--CA 1.451 -0.405 0 CA-C-O 120.958 0.409 . . . . 0.0 111.189 178.666 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B 2054 ' ' ASP . . . . . . . . . . . . . 32.2 t0 -158.66 179.76 8.81 Favored 'General case' 0 CA--C 1.53 0.201 0 N-CA-C 108.729 -0.841 . . . . 0.0 108.729 -178.878 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B 2055 ' ' GLU . . . . . . . . . . . . . 76.7 mm-40 -63.31 140.08 58.84 Favored 'General case' 0 N--CA 1.457 -0.115 0 N-CA-C 112.558 0.577 . . . . 0.0 112.558 -179.072 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B 2056 ' ' ASP . . . . . 0.588 ' HA ' ' H ' ' A' ' 26' ' ' GLY . 25.7 m-20 -102.95 30.31 4.87 Favored 'General case' 0 CA--C 1.533 0.302 0 C-N-CA 124.651 1.18 . . . . 0.0 110.412 176.985 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B 2057 ' ' ASP . . . . . . . . . . . . . 50.4 p-10 -74.24 56.1 0.62 Allowed 'General case' 0 CA--C 1.533 0.31 0 C-N-CA 124.705 1.202 . . . . 0.0 113.19 -174.681 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B 2058 ' ' TYR . . . . . . . . . . . . . 85.8 t80 -147.18 139.39 24.54 Favored 'General case' 0 C--N 1.34 0.161 0 O-C-N 121.539 -0.725 . . . . 0.0 110.923 173.467 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B 2059 ' ' THR . . . . . . . . . . . . . 2.9 m -174.55 125.1 0.39 Allowed Pre-proline 0 CA--C 1.531 0.225 0 C-N-CA 125.855 1.662 . . . . 0.0 106.688 170.917 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B 2060 ' ' PRO . . . . . . . . . . . . . 96.8 Cg_endo -73.8 165.68 31.61 Favored 'Trans proline' 0 N--CA 1.452 -0.921 0 C-N-CA 123.303 2.669 . . . . 0.0 110.508 179.293 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B 2061 ' ' SER . . . . . . . . . . . . . 86.0 p -144.77 20.67 1.64 Allowed 'General case' 0 N--CA 1.456 -0.166 0 N-CA-C 112.852 0.686 . . . . 0.0 112.852 -174.913 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B 2062 ' ' ILE . . . . . 0.455 ' CG2' HG22 ' A' ' 130' ' ' ILE . 1.2 tt -75.92 76.87 0.53 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.305 0 CA-C-O 121.847 0.832 . . . . 0.0 109.134 176.418 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B 2063 ' ' SER . . . . . . . . . . . . . 47.6 t . . . . . 0 C--O 1.252 1.205 0 CA-C-O 118.184 -0.913 . . . . 0.0 111.652 179.627 . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 4.0 mpp? . . . . . 0 N--CA 1.473 0.713 0 N-CA-C 110.13 -0.322 . . . . 0.0 110.13 . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 24.4 mp0 -74.5 -162.16 0.15 Allowed 'General case' 0 N--CA 1.45 -0.442 0 C-N-CA 124.004 0.922 . . . . 0.0 109.045 175.661 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 58.8 tt0 -67.79 89.15 0.26 Allowed 'General case' 0 CA--C 1.531 0.246 0 N-CA-C 107.755 -1.202 . . . . 0.0 107.755 171.62 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 79.9 m-20 -73.85 20.34 0.1 Allowed 'General case' 0 C--N 1.338 0.087 0 N-CA-C 115.532 1.679 . . . . 0.0 115.532 -170.986 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 47.8 p30 -83.39 0.63 45.2 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 121.472 0.653 . . . . 0.0 110.636 176.957 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 29.7 p-10 -82.04 -30.93 31.16 Favored 'General case' 0 N--CA 1.451 -0.389 0 N-CA-C 107.786 -1.19 . . . . 0.0 107.786 174.025 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 7' ' ' PHE . . . . . 0.53 ' HB2' ' HZ1' ' A' ' 45' ' ' LYS . 1.3 t80 -59.14 -33.99 71.54 Favored 'General case' 0 N--CA 1.446 -0.67 0 C-N-CA 125.416 1.487 . . . . 0.0 109.981 -179.978 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 51.2 tp60 -49.76 -37.24 28.84 Favored 'General case' 0 N--CA 1.451 -0.395 0 C-N-CA 124.347 1.059 . . . . 0.0 111.609 -179.006 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 25.5 m-80 -73.94 -33.27 63.86 Favored 'General case' 0 N--CA 1.452 -0.356 0 O-C-N 122.202 -0.311 . . . . 0.0 110.397 -179.478 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 10' ' ' PHE . . . . . 0.413 ' CE2' ' HB2' ' A' ' 32' ' ' LEU . 6.5 t80 -71.23 -40.36 71.12 Favored 'General case' 0 N--CA 1.449 -0.515 0 C-N-CA 123.311 0.645 . . . . 0.0 109.499 177.511 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 89.1 t -63.6 -53.46 44.71 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.417 0 N-CA-C 108.407 -0.96 . . . . 0.0 108.407 179.071 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -59.54 -29.34 67.83 Favored 'General case' 0 N--CA 1.455 -0.221 0 C-N-CA 122.748 0.419 . . . . 0.0 111.774 -179.659 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 92.3 m -71.73 -37.12 70.64 Favored 'General case' 0 CA--C 1.531 0.216 0 N-CA-C 108.901 -0.777 . . . . 0.0 108.901 176.206 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . 0.44 ' HA ' ' CD1' ' A' ' 17' ' ' PHE . 5.6 tp -69.03 -41.05 78.22 Favored 'General case' 0 N--CA 1.452 -0.352 0 CA-C-O 120.981 0.42 . . . . 0.0 110.379 178.751 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 64.1 mm-40 -64.88 -30.98 72.0 Favored 'General case' 0 N--CA 1.45 -0.447 0 N-CA-C 108.378 -0.971 . . . . 0.0 108.378 176.668 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 23.1 t -73.48 -20.45 60.68 Favored 'General case' 0 N--CA 1.453 -0.288 0 CA-C-N 115.844 -0.616 . . . . 0.0 109.894 178.375 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 17' ' ' PHE . . . . . 0.44 ' CD1' ' HA ' ' A' ' 14' ' ' LEU . 22.9 m-85 -75.43 -35.66 60.92 Favored 'General case' 0 N--CA 1.455 -0.188 0 C-N-CA 120.181 -0.607 . . . . 0.0 110.512 168.62 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 68.2 mttt -62.0 -28.79 69.82 Favored 'General case' 0 C--N 1.339 0.127 0 CA-C-N 118.37 0.532 . . . . 0.0 109.776 179.066 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 19.7 t0 -64.31 -20.89 66.38 Favored 'General case' 0 CA--C 1.533 0.323 0 CA-C-N 115.706 -0.679 . . . . 0.0 111.885 176.86 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 43.3 mt -70.79 155.17 41.12 Favored 'General case' 0 N--CA 1.457 -0.082 0 O-C-N 121.476 -0.765 . . . . 0.0 111.885 -175.192 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 1.4 mppt? -100.99 -3.72 28.88 Favored 'General case' 0 CA--C 1.528 0.116 0 N-CA-C 109.06 -0.719 . . . . 0.0 109.06 173.168 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 22' ' ' SER . . . . . 0.431 ' HG ' ' CG ' ' B' 2056 ' ' ASP . 82.9 p -121.83 -20.4 6.42 Favored 'General case' 0 CA--C 1.528 0.096 0 C-N-CA 124.507 1.123 . . . . 0.0 111.091 -178.924 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 82.7 -16.8 24.04 Favored Glycine 0 CA--C 1.53 0.995 0 C-N-CA 124.153 0.882 . . . . 0.0 113.499 176.213 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 81.5 mt -101.43 148.5 7.24 Favored 'Isoleucine or valine' 0 CA--C 1.528 0.113 0 CA-C-N 118.452 1.126 . . . . 0.0 110.73 -179.671 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 41.9 t -162.54 85.59 0.56 Allowed 'General case' 0 CA--C 1.519 -0.23 0 N-CA-C 110.04 -0.356 . . . . 0.0 110.04 178.82 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . 0.4 ' O ' ' HE2' ' A' ' 30' ' ' LYS . . . -51.15 -39.72 42.68 Favored Glycine 0 CA--C 1.523 0.551 0 CA-C-O 119.168 -0.795 . . . . 0.0 112.236 -175.635 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 91.4 p -66.0 -48.03 72.54 Favored 'General case' 0 N--CA 1.454 -0.243 0 CA-C-N 118.999 1.399 . . . . 0.0 110.952 -176.807 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 54.5 mtm180 -73.15 -34.57 66.14 Favored 'General case' 0 CA--C 1.527 0.09 0 CA-C-N 118.014 0.37 . . . . 0.0 110.57 -179.351 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 65.1 mt -59.05 -48.45 86.67 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.487 0 N-CA-C 109.057 -0.72 . . . . 0.0 109.057 173.584 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . 0.4 ' HE2' ' O ' ' A' ' 26' ' ' GLY . 49.2 mtmt -68.75 -23.18 64.3 Favored 'General case' 0 N--CA 1.456 -0.173 0 CA-C-O 119.012 -0.518 . . . . 0.0 111.505 -179.564 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . 0.427 ' HA ' ' CE ' ' A' ' 31' ' ' LYS . 4.1 mmpt? -66.35 -57.14 8.1 Favored 'General case' 0 C--N 1.341 0.213 0 CA-C-N 118.693 0.679 . . . . 0.0 110.443 176.255 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . 0.413 ' HB2' ' CE2' ' A' ' 10' ' ' PHE . 2.3 pp -75.43 -18.85 59.79 Favored 'General case' 0 CA--C 1.531 0.247 0 C-N-CA 119.615 -0.834 . . . . 0.0 111.505 -178.105 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 60.1 m -72.88 -38.42 66.99 Favored 'General case' 0 N--CA 1.455 -0.222 0 N-CA-C 109.077 -0.712 . . . . 0.0 109.077 175.678 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 57.9 m -69.08 -35.59 76.67 Favored 'General case' 0 N--CA 1.453 -0.312 0 N-CA-C 110.001 -0.37 . . . . 0.0 110.001 179.918 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 9.1 t80 -62.17 -39.51 92.91 Favored 'General case' 0 C--O 1.231 0.122 0 N-CA-C 109.626 -0.509 . . . . 0.0 109.626 174.446 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -71.61 -36.79 70.92 Favored 'General case' 0 N--CA 1.448 -0.526 0 CA-C-O 119.564 -0.255 . . . . 0.0 111.685 -179.644 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -70.0 -34.07 72.85 Favored 'General case' 0 N--CA 1.456 -0.168 0 CA-C-N 117.915 0.325 . . . . 0.0 111.045 -179.825 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 43.9 t0 -68.91 -23.93 64.24 Favored 'General case' 0 CA--C 1.533 0.325 0 C-N-CA 122.132 0.173 . . . . 0.0 110.633 176.934 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 97.8 m-70 -151.93 104.6 3.01 Favored 'General case' 0 N--CA 1.456 -0.167 0 N-CA-C 112.199 0.444 . . . . 0.0 112.199 -174.517 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 40' ' ' ILE . . . . . 0.531 ' H ' HD13 ' A' ' 40' ' ' ILE . 0.0 OUTLIER -79.0 -12.03 13.25 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.302 0 C-N-CA 122.736 0.414 . . . . 0.0 110.149 174.165 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 16.0 m-20 -59.44 -11.73 4.95 Favored 'General case' 0 CA--C 1.53 0.176 0 C-N-CA 123.418 0.687 . . . . 0.0 112.787 -176.794 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -119.46 18.06 6.58 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.198 0 C-N-CA 124.068 0.947 . . . . 0.0 111.667 177.799 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 3.0 pp20? -53.88 -28.91 39.19 Favored 'General case' 0 CA--C 1.53 0.193 0 O-C-N 121.379 -0.825 . . . . 0.0 111.296 178.092 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 47.1 t -65.21 -44.24 88.94 Favored 'General case' 0 CA--C 1.533 0.289 0 N-CA-C 111.899 0.333 . . . . 0.0 111.899 -177.878 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . 0.53 ' HZ1' ' HB2' ' A' ' 7' ' ' PHE . 15.0 ptpt -74.87 -25.67 59.13 Favored 'General case' 0 CA--C 1.53 0.185 0 CA-C-N 118.385 0.539 . . . . 0.0 109.816 179.012 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 67.2 mt -72.72 -51.68 26.61 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.251 0 C-N-CA 123.076 0.55 . . . . 0.0 110.314 -177.476 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 38.8 mm -67.11 -39.95 84.27 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.112 0 N-CA-C 110.119 -0.326 . . . . 0.0 110.119 -179.768 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 48.0 t -66.72 -33.59 75.98 Favored 'General case' 0 N--CA 1.453 -0.313 0 C-N-CA 120.745 -0.382 . . . . 0.0 111.201 -178.841 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 44.4 tp -78.68 -37.55 41.5 Favored 'General case' 0 N--CA 1.451 -0.397 0 N-CA-C 112.749 0.648 . . . . 0.0 112.749 -177.474 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 3.6 pt -67.4 -44.01 87.3 Favored 'Isoleucine or valine' 0 C--N 1.34 0.162 0 CA-C-N 118.924 0.784 . . . . 0.0 110.172 178.933 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 16.9 pt -65.48 -38.05 81.53 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.203 0 C-N-CA 119.858 -0.737 . . . . 0.0 111.477 178.758 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 47.6 t0 -60.86 -53.63 54.95 Favored 'General case' 0 CA--C 1.528 0.104 0 CA-C-N 118.484 0.584 . . . . 0.0 110.21 177.469 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 3.5 t80 -61.16 -32.49 72.22 Favored 'General case' 0 C--O 1.225 -0.21 0 CA-C-O 118.813 -0.613 . . . . 0.0 109.839 179.173 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 17.2 p -63.46 -35.99 82.26 Favored 'General case' 0 N--CA 1.456 -0.16 0 CA-C-N 118.693 0.679 . . . . 0.0 110.859 -179.89 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 1.9 tpp180 -79.49 -39.69 31.52 Favored 'General case' 0 N--CA 1.455 -0.195 0 C-N-CA 122.146 0.178 . . . . 0.0 111.181 -177.57 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 79.6 mt -77.75 -45.28 25.11 Favored 'General case' 0 N--CA 1.455 -0.215 0 C-N-CA 123.764 0.825 . . . . 0.0 113.196 -176.468 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 13.6 p -64.38 159.64 57.3 Favored Pre-proline 0 CA--C 1.533 0.3 0 N-CA-C 113.882 1.067 . . . . 0.0 113.882 -171.628 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 33.4 Cg_exo -58.03 175.65 0.45 Allowed 'Trans proline' 0 N--CA 1.454 -0.796 0 C-N-CA 125.012 3.808 . . . . 0.0 112.827 173.884 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 35.8 p-10 -63.6 -42.19 98.28 Favored 'General case' 0 CA--C 1.53 0.189 0 C-N-CA 123.916 0.886 . . . . 0.0 112.171 -174.945 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 20.0 m -72.57 -35.48 67.97 Favored 'General case' 0 N--CA 1.452 -0.362 0 C-N-CA 122.702 0.401 . . . . 0.0 110.015 -178.203 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 51.3 m80 -75.17 -23.72 57.78 Favored 'General case' 0 N--CA 1.452 -0.337 0 C-N-CA 122.814 0.446 . . . . 0.0 110.252 177.817 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 22.3 ttmm -71.94 -35.41 69.61 Favored 'General case' 0 N--CA 1.455 -0.184 0 N-CA-C 109.327 -0.619 . . . . 0.0 109.327 174.527 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -62.76 -44.29 96.58 Favored 'General case' 0 CA--C 1.532 0.269 0 N-CA-C 107.155 -1.424 . . . . 0.0 107.155 172.078 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -65.59 -29.69 75.73 Favored Glycine 0 CA--C 1.526 0.736 0 N-CA-C 111.474 -0.65 . . . . 0.0 111.474 179.99 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 35.3 t -65.56 -41.52 92.86 Favored 'General case' 0 N--CA 1.452 -0.351 0 CA-C-N 117.469 0.635 . . . . 0.0 109.449 176.814 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 81.4 mt -67.74 -27.44 66.79 Favored 'General case' 0 N--CA 1.453 -0.276 0 N-CA-C 110.473 -0.195 . . . . 0.0 110.473 178.157 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 67' ' ' TYR . . . . . 0.403 ' CD2' HD13 ' A' ' 127' ' ' LEU . 2.4 m-85 -70.09 -37.99 75.58 Favored 'General case' 0 C--N 1.34 0.153 0 CA-C-N 117.983 0.356 . . . . 0.0 110.731 174.873 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 68' ' ' ILE . . . . . . . . . . . . . 13.9 mt -69.95 -54.2 20.19 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.451 0 N-CA-C 109.259 -0.645 . . . . 0.0 109.259 178.297 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 68.5 mt -48.11 -37.39 6.9 Favored 'Isoleucine or valine' 0 C--N 1.34 0.154 0 C-N-CA 124.141 0.976 . . . . 0.0 111.478 173.834 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 23.9 t70 -69.18 -43.89 73.31 Favored 'General case' 0 CA--C 1.52 -0.196 0 CA-C-N 118.912 0.778 . . . . 0.0 110.909 179.386 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 25.3 m -66.96 -56.01 12.05 Favored 'General case' 0 N--CA 1.449 -0.523 0 O-C-N 123.416 0.448 . . . . 0.0 110.024 -174.506 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -74.68 -32.97 30.26 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.386 0 N-CA-C 109.948 -0.39 . . . . 0.0 109.948 -176.944 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -65.57 -58.46 9.26 Favored Glycine 0 C--N 1.339 0.71 0 N-CA-C 111.388 -0.685 . . . . 0.0 111.388 -175.412 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 46.4 mtm105 -69.26 -36.41 77.1 Favored 'General case' 0 N--CA 1.456 -0.166 0 CA-C-N 117.455 0.628 . . . . 0.0 110.542 -178.972 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -64.23 -29.38 70.48 Favored 'General case' 0 N--CA 1.45 -0.433 0 C-N-CA 119.645 -0.822 . . . . 0.0 110.707 179.658 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 1.6 m-30 -71.27 -45.98 61.94 Favored 'General case' 0 C--N 1.342 0.244 0 CA-C-N 118.594 0.634 . . . . 0.0 110.637 175.399 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -64.58 -45.11 88.39 Favored 'General case' 0 N--CA 1.45 -0.452 0 N-CA-C 108.027 -1.101 . . . . 0.0 108.027 -178.123 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 92.2 m-20 -55.92 -46.85 78.34 Favored 'General case' 0 C--O 1.231 0.082 0 N-CA-C 113.463 0.912 . . . . 0.0 113.463 173.927 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 12.4 tm-20 -64.13 -47.44 79.92 Favored 'General case' 0 N--CA 1.449 -0.48 0 CA-C-N 118.604 0.638 . . . . 0.0 111.054 -178.341 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 75.7 p -69.34 -27.23 65.17 Favored 'General case' 0 N--CA 1.453 -0.304 0 CA-C-O 119.692 -0.194 . . . . 0.0 110.685 -179.409 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 36.4 ttp-105 -70.34 -27.69 64.56 Favored 'General case' 0 N--CA 1.451 -0.395 0 CA-C-N 118.096 0.407 . . . . 0.0 110.189 172.618 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 32.2 m -86.5 -35.94 19.29 Favored 'General case' 0 N--CA 1.453 -0.276 0 N-CA-C 113.025 0.75 . . . . 0.0 113.025 -176.417 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 53.2 m-20 -128.14 12.43 6.61 Favored 'General case' 0 CA--C 1.519 -0.242 0 N-CA-C 114.709 1.374 . . . . 0.0 114.709 -174.72 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 30.0 t 60.57 -21.26 0.03 OUTLIER 'General case' 0 N--CA 1.451 -0.41 0 N-CA-C 116.474 2.027 . . . . 0.0 116.474 173.959 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 1.1 m-80 55.72 -175.66 0.05 OUTLIER 'General case' 0 CA--C 1.533 0.323 0 C-N-CA 124.047 0.939 . . . . 0.0 111.058 -174.402 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 70.3 m -68.05 139.54 56.27 Favored 'General case' 0 N--CA 1.456 -0.13 0 O-C-N 122.016 -0.428 . . . . 0.0 111.133 -178.805 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 88.9 p -87.99 37.55 0.81 Allowed 'General case' 0 CA--C 1.532 0.263 0 C-N-CA 123.647 0.779 . . . . 0.0 111.378 -179.481 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 37.9 t -152.43 164.62 37.16 Favored 'General case' 0 N--CA 1.455 -0.222 0 N-CA-C 109.882 -0.414 . . . . 0.0 109.882 -177.309 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 59.4 m-20 55.96 -163.93 0.14 Allowed 'General case' 0 CA--C 1.53 0.201 0 C-N-CA 123.583 0.753 . . . . 0.0 111.049 -175.536 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 90' ' ' LYS . . . . . 0.64 ' H ' ' HD2' ' A' ' 91' ' ' PRO . 83.0 tttt -144.13 -50.49 0.02 OUTLIER Pre-proline 0 CA--C 1.531 0.24 0 CA-C-O 118.286 -0.864 . . . . 0.0 111.708 177.356 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 91' ' ' PRO . . . . . 0.64 ' HD2' ' H ' ' A' ' 90' ' ' LYS . 56.3 Cg_endo -64.47 149.88 89.23 Favored 'Trans proline' 0 N--CA 1.45 -1.047 0 N-CA-C 108.467 -1.397 . . . . 0.0 108.467 172.269 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 90.23 17.06 54.49 Favored Glycine 0 CA--C 1.524 0.628 0 CA-C-O 119.417 -0.657 . . . . 0.0 112.277 -177.289 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 38.5 p -151.61 172.5 15.95 Favored 'General case' 0 C--N 1.341 0.201 0 CA-C-N 117.946 0.873 . . . . 0.0 110.203 176.739 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 94' ' ' CYS . . . . . . . . . . . . . 26.2 p -59.98 -20.99 60.61 Favored 'General case' 0 N--CA 1.449 -0.493 0 CA-C-N 115.621 -0.718 . . . . 0.0 109.936 175.682 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -60.29 -55.26 35.84 Favored 'General case' 0 N--CA 1.448 -0.53 0 N-CA-C 109.398 -0.593 . . . . 0.0 109.398 -177.261 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 69.3 t60 -75.46 -34.74 60.95 Favored 'General case' 0 N--CA 1.448 -0.546 0 CA-C-N 116.736 -0.211 . . . . 0.0 110.906 179.68 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -66.18 -49.41 67.45 Favored 'General case' 0 N--CA 1.451 -0.413 0 O-C-N 123.09 0.244 . . . . 0.0 111.126 -176.17 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 1.7 mp -72.79 -34.62 47.4 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.251 0 CA-C-O 119.234 -0.413 . . . . 0.0 109.986 179.699 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 1.4 m120 -66.14 -40.23 90.47 Favored 'General case' 0 N--CA 1.453 -0.289 0 CA-C-N 118.612 0.642 . . . . 0.0 111.293 178.715 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 92.6 m -75.19 -34.85 61.56 Favored 'General case' 0 N--CA 1.454 -0.256 0 CA-C-N 118.008 0.367 . . . . 0.0 110.838 -178.471 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 58.8 tp -75.65 -38.77 58.58 Favored 'General case' 0 N--CA 1.451 -0.417 0 C-N-CA 122.886 0.474 . . . . 0.0 111.013 -178.589 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -67.18 -23.58 73.15 Favored Glycine 0 CA--C 1.528 0.856 0 CA-C-O 119.542 -0.588 . . . . 0.0 113.441 -173.479 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 16.3 mm-40 -74.63 -35.77 62.91 Favored 'General case' 0 CA--C 1.52 -0.188 0 CA-C-N 118.158 0.979 . . . . 0.0 111.179 179.41 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 25.9 m -101.77 -13.43 8.41 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.138 0 N-CA-C 113.379 0.881 . . . . 0.0 113.379 -176.114 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 105' ' ' ILE . . . . . . . . . . . . . 11.0 tp -61.84 -27.24 41.89 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.161 0 CA-C-N 119.18 0.9 . . . . 0.0 111.564 -175.282 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 19.8 pt20 -67.0 -29.86 69.8 Favored 'General case' 0 N--CA 1.453 -0.277 0 N-CA-C 109.994 -0.373 . . . . 0.0 109.994 176.704 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 86.1 mt-10 -75.75 -41.31 53.63 Favored 'General case' 0 N--CA 1.454 -0.265 0 N-CA-C 109.918 -0.401 . . . . 0.0 109.918 175.806 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 9.9 mp -64.66 -41.97 95.72 Favored 'General case' 0 C--N 1.34 0.164 0 N-CA-C 110.361 -0.237 . . . . 0.0 110.361 -178.472 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 72.3 mt -66.85 -50.78 61.44 Favored 'General case' 0 N--CA 1.453 -0.284 0 N-CA-C 109.833 -0.432 . . . . 0.0 109.833 178.952 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 16.8 m -59.51 -45.79 90.71 Favored 'General case' 0 C--O 1.232 0.155 0 CA-C-N 117.724 0.238 . . . . 0.0 111.022 -178.744 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 44.7 t0 -62.83 -38.44 90.77 Favored 'General case' 0 N--CA 1.454 -0.234 0 N-CA-C 108.932 -0.766 . . . . 0.0 108.932 179.258 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -68.03 -31.65 71.47 Favored 'General case' 0 N--CA 1.446 -0.645 0 CA-C-O 119.352 -0.356 . . . . 0.0 111.611 -176.531 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 113' ' ' ILE . . . . . . . . . . . . . 31.2 mm -70.38 -44.1 77.68 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.269 0 C-N-CA 118.856 -1.137 . . . . 0.0 109.362 178.011 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -72.91 -33.92 66.29 Favored 'General case' 0 N--CA 1.452 -0.334 0 N-CA-C 113.033 0.753 . . . . 0.0 113.033 -178.483 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 115' ' ' LYS . . . . . 0.448 ' HZ2' ' CA ' ' A' ' 115' ' ' LYS . 0.0 OUTLIER -79.45 -37.01 37.94 Favored 'General case' 0 C--N 1.34 0.174 0 CA-C-N 118.293 0.497 . . . . 0.0 111.805 -179.186 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 116' ' ' SER . . . . . 0.489 ' HB2' ' CB ' ' A' ' 120' ' ' HIS . 21.0 p -85.45 164.6 17.78 Favored 'General case' 0 N--CA 1.449 -0.488 0 CA-C-O 120.93 0.395 . . . . 0.0 112.019 -171.431 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 20.4 m-80 -78.43 -100.19 0.02 OUTLIER 'General case' 0 N--CA 1.455 -0.204 0 N-CA-C 113.557 0.947 . . . . 0.0 113.557 -171.095 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 118' ' ' GLN . . . . . 0.474 ' HA ' ' HE2' ' A' ' 121' ' ' LYS . 14.8 mm100 -136.84 -49.84 0.64 Allowed 'General case' 0 CA--C 1.52 -0.174 0 CA-C-O 120.862 0.363 . . . . 0.0 110.355 -179.005 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 119' ' ' ASP . . . . . 0.407 ' N ' ' OD1' ' A' ' 119' ' ' ASP . 10.3 p-10 -62.9 -39.17 93.72 Favored 'General case' 0 N--CA 1.453 -0.3 0 N-CA-C 108.471 -0.937 . . . . 0.0 108.471 175.206 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 120' ' ' HIS . . . . . 0.489 ' CB ' ' HB2' ' A' ' 116' ' ' SER . 39.9 m170 -66.04 -40.91 91.36 Favored 'General case' 0 N--CA 1.45 -0.457 0 CA-C-N 115.687 -0.688 . . . . 0.0 110.881 176.477 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 121' ' ' LYS . . . . . 0.474 ' HE2' ' HA ' ' A' ' 118' ' ' GLN . 38.2 mtmt -63.67 -34.85 78.77 Favored 'General case' 0 N--CA 1.455 -0.213 0 N-CA-C 109.795 -0.446 . . . . 0.0 109.795 179.443 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 4.8 tm-20 -64.41 -48.66 74.55 Favored 'General case' 0 N--CA 1.456 -0.131 0 CA-C-N 117.705 0.23 . . . . 0.0 110.418 178.239 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 69.7 mmtt -59.8 -30.82 69.16 Favored 'General case' 0 N--CA 1.455 -0.214 0 CA-C-N 116.786 -0.188 . . . . 0.0 111.459 179.222 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 124' ' ' ILE . . . . . . . . . . . . . 51.3 mt -74.75 -34.34 33.7 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.293 0 O-C-N 121.882 -0.511 . . . . 0.0 110.183 178.681 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 125' ' ' ARG . . . . . 0.426 ' HE ' ' CE1' ' A' ' 159' ' ' HIS . 24.1 mmt180 -68.46 -35.83 78.12 Favored 'General case' 0 N--CA 1.455 -0.189 0 CA-C-O 119.361 -0.352 . . . . 0.0 111.244 178.394 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 126' ' ' MET . . . . . . . . . . . . . 27.8 ptm -71.91 -33.48 68.32 Favored 'General case' 0 C--N 1.34 0.154 0 C-N-CA 119.333 -0.947 . . . . 0.0 109.514 177.659 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 127' ' ' LEU . . . . . 0.403 HD13 ' CD2' ' A' ' 67' ' ' TYR . 65.2 mt -70.7 -25.7 63.08 Favored 'General case' 0 C--N 1.341 0.2 0 CA-C-N 118.109 0.413 . . . . 0.0 110.167 175.882 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 55.3 tp -68.99 -42.97 75.82 Favored 'General case' 0 N--CA 1.452 -0.327 0 N-CA-C 109.793 -0.447 . . . . 0.0 109.793 177.875 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 12.9 t70 -61.46 -46.2 91.04 Favored 'General case' 0 N--CA 1.456 -0.133 0 N-CA-C 109.576 -0.528 . . . . 0.0 109.576 175.641 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 72.9 mt -59.86 -40.42 82.7 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.392 0 CA-C-N 116.362 -0.381 . . . . 0.0 110.991 -177.42 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 131' ' ' TRP . . . . . . . . . . . . . 46.1 m0 -76.73 -25.11 53.15 Favored 'General case' 0 N--CA 1.453 -0.306 0 N-CA-C 112.754 0.65 . . . . 0.0 112.754 178.535 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 31.7 t0 -74.66 -28.78 61.0 Favored 'General case' 0 N--CA 1.456 -0.16 0 CA-C-N 118.282 0.492 . . . . 0.0 110.185 178.607 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 133' ' ' ARG . . . . . 0.474 HH21 ' C ' ' B' 2063 ' ' SER . 18.4 mtp180 -75.22 -41.69 57.06 Favored 'General case' 0 N--CA 1.456 -0.158 0 C-N-CA 124.243 1.017 . . . . 0.0 109.875 175.555 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 37.1 t -75.28 -10.45 59.47 Favored 'General case' 0 N--CA 1.454 -0.263 0 C-N-CA 123.19 0.596 . . . . 0.0 111.798 -179.238 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 135' ' ' GLY . . . . . . . . . . . . . . . 74.49 1.7 61.8 Favored Glycine 0 CA--C 1.527 0.832 0 CA-C-O 119.373 -0.682 . . . . 0.0 112.222 179.786 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 136' ' ' LEU . . . . . . . . . . . . . 13.4 mt -76.86 -17.42 58.98 Favored 'General case' 0 CA--C 1.529 0.151 0 CA-C-N 118.103 0.952 . . . . 0.0 111.057 178.294 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 137' ' ' PHE . . . . . . . . . . . . . 54.2 t80 -93.16 140.58 29.36 Favored 'General case' 0 N--CA 1.452 -0.371 0 N-CA-C 109.131 -0.692 . . . . 0.0 109.131 173.078 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 138' ' ' GLN . . . . . 0.433 ' C ' ' H ' ' A' ' 140' ' ' SER . 20.8 pt20 -67.63 123.61 20.94 Favored 'General case' 0 N--CA 1.453 -0.321 0 N-CA-C 108.953 -0.758 . . . . 0.0 108.953 178.099 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 139' ' ' LYS . . . . . . . . . . . . . 26.2 mtpp -76.43 22.74 0.16 Allowed 'General case' 0 CA--C 1.53 0.182 0 C-N-CA 122.542 0.337 . . . . 0.0 111.407 -178.258 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 140' ' ' SER . . . . . 0.433 ' H ' ' C ' ' A' ' 138' ' ' GLN . 79.4 p -82.31 -16.69 48.43 Favored 'General case' 0 N--CA 1.456 -0.175 0 C-N-CA 123.878 0.871 . . . . 0.0 110.344 176.719 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 141' ' ' TYR . . . . . . . . . . . . . 74.2 m-85 48.17 55.3 8.95 Favored 'General case' 0 C--N 1.342 0.246 0 C-N-CA 124.052 0.941 . . . . 0.0 112.468 177.098 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 142' ' ' LEU . . . . . . . . . . . . . 64.2 mt -63.41 156.12 26.96 Favored 'General case' 0 C--O 1.233 0.187 0 CA-C-O 121.164 0.507 . . . . 0.0 112.141 -176.407 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 24.9 p-10 -71.31 -21.68 62.04 Favored 'General case' 0 N--CA 1.456 -0.137 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.89 -179.981 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . -62.18 -41.45 98.35 Favored 'General case' 0 N--CA 1.452 -0.343 0 N-CA-C 109.939 -0.393 . . . . 0.0 109.939 179.363 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 145' ' ' ILE . . . . . . . . . . . . . 18.2 mm -63.15 -29.1 46.41 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.317 0 C-N-CA 122.22 0.208 . . . . 0.0 110.913 177.275 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 146' ' ' ARG . . . . . 0.468 HH11 ' HG2' ' A' ' 146' ' ' ARG . 5.5 mmt-85 -73.21 -27.54 61.67 Favored 'General case' 0 C--N 1.339 0.134 0 N-CA-C 109.527 -0.546 . . . . 0.0 109.527 178.451 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 147' ' ' SER . . . . . . . . . . . . . 48.2 t 55.09 43.2 29.99 Favored 'General case' 0 N--CA 1.456 -0.129 0 C-N-CA 123.502 0.721 . . . . 0.0 111.849 177.836 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 148' ' ' LYS . . . . . 0.511 ' HA ' ' CE ' ' A' ' 148' ' ' LYS . 6.2 mmpt? -58.58 -18.52 30.62 Favored 'General case' 0 N--CA 1.453 -0.296 0 N-CA-C 113.347 0.869 . . . . 0.0 113.347 -175.534 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 149' ' ' CYS . . . . . . . . . . . . . 23.6 p -69.2 -50.69 45.14 Favored 'General case' 0 N--CA 1.452 -0.359 0 CA-C-N 118.795 0.725 . . . . 0.0 109.441 177.301 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 150' ' ' PHE . . . . . . . . . . . . . 36.5 t80 -71.55 -18.61 62.24 Favored 'General case' 0 N--CA 1.454 -0.26 0 N-CA-C 109.963 -0.384 . . . . 0.0 109.963 179.76 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 151' ' ' ALA . . . . . . . . . . . . . . . -74.84 -39.35 61.66 Favored 'General case' 0 N--CA 1.45 -0.427 0 N-CA-C 110.243 -0.28 . . . . 0.0 110.243 176.106 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 152' ' ' MET . . . . . . . . . . . . . 97.3 mtp -75.88 -18.61 59.35 Favored 'General case' 0 N--CA 1.456 -0.141 0 C-N-CA 122.378 0.271 . . . . 0.0 111.142 177.508 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 153' ' ' ASP . . . . . . . . . . . . . 67.3 m-20 -69.55 -5.57 25.21 Favored 'General case' 0 CA--C 1.53 0.211 0 C-N-CA 122.504 0.321 . . . . 0.0 111.033 171.21 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 154' ' ' LEU . . . . . . . . . . . . . 80.9 mt -124.54 151.91 44.12 Favored 'General case' 0 N--CA 1.454 -0.247 0 C-N-CA 123.511 0.724 . . . . 0.0 110.028 179.191 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 155' ' ' GLU . . . . . . . . . . . . . 43.2 mp0 -67.51 -13.44 62.05 Favored 'General case' 0 N--CA 1.455 -0.199 0 C-N-CA 122.689 0.396 . . . . 0.0 111.057 -178.822 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 156' ' ' HIS . . . . . . . . . . . . . 26.6 m80 -78.07 -15.99 58.42 Favored 'General case' 0 N--CA 1.454 -0.23 0 C-N-CA 122.913 0.485 . . . . 0.0 111.978 -179.892 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 157' ' ' HIS . . . . . . . . . . . . . 95.2 m-70 55.69 10.25 0.51 Allowed 'General case' 0 CA--C 1.533 0.302 0 C-N-CA 123.835 0.854 . . . . 0.0 112.931 -176.552 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 158' ' ' HIS . . . . . . . . . . . . . 99.3 m-70 -148.72 172.11 15.13 Favored 'General case' 0 N--CA 1.454 -0.246 0 C-N-CA 124.539 1.136 . . . . 0.0 109.419 -179.242 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 159' ' ' HIS . . . . . 0.426 ' CE1' ' HE ' ' A' ' 125' ' ' ARG . 17.9 p-80 . . . . . 0 C--O 1.252 1.215 0 CA-C-O 116.413 -1.756 . . . . 0.0 110.117 178.325 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B 2052 ' ' ASP . . . . . . . . . . . . . 2.9 m-20 . . . . . 0 N--CA 1.474 0.754 0 N-CA-C 110.598 -0.149 . . . . 0.0 110.598 . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' B' B 2053 ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -123.03 165.66 16.41 Favored 'General case' 0 CA--C 1.535 0.394 0 C-N-CA 124.067 0.947 . . . . 0.0 109.179 -177.434 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B 2054 ' ' ASP . . . . . 0.527 ' CG ' ' H ' ' B' 2055 ' ' GLU . 11.6 p-10 -155.81 -114.36 0.03 OUTLIER 'General case' 0 CA--C 1.538 0.509 0 CA-C-N 118.54 0.609 . . . . 0.0 112.286 -170.946 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B 2055 ' ' GLU . . . . . 0.527 ' H ' ' CG ' ' B' 2054 ' ' ASP . 67.9 tt0 -72.19 61.99 0.47 Allowed 'General case' 0 CA--C 1.532 0.265 0 C-N-CA 125.645 1.578 . . . . 0.0 109.461 178.438 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B 2056 ' ' ASP . . . . . 0.431 ' CG ' ' HG ' ' A' ' 22' ' ' SER . 10.4 m-20 -68.13 15.64 0.05 OUTLIER 'General case' 0 N--CA 1.455 -0.199 0 N-CA-C 113.899 1.074 . . . . 0.0 113.899 -176.866 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B 2057 ' ' ASP . . . . . . . . . . . . . 40.3 t0 -154.61 62.06 0.67 Allowed 'General case' 0 N--CA 1.454 -0.226 0 CA-C-N 118.371 0.532 . . . . 0.0 110.486 175.097 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B 2058 ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -50.48 129.98 23.01 Favored 'General case' 0 N--CA 1.454 -0.265 0 N-CA-C 109.499 -0.556 . . . . 0.0 109.499 175.49 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B 2059 ' ' THR . . . . . . . . . . . . . 72.3 p -91.2 111.47 48.8 Favored Pre-proline 0 C--O 1.233 0.192 0 N-CA-C 109.562 -0.533 . . . . 0.0 109.562 179.923 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B 2060 ' ' PRO . . . . . . . . . . . . . 98.1 Cg_endo -73.85 128.06 12.08 Favored 'Trans proline' 0 N--CA 1.45 -1.041 0 C-N-CA 123.219 2.613 . . . . 0.0 111.245 -178.856 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B 2061 ' ' SER . . . . . . . . . . . . . 74.0 p -81.09 132.32 35.35 Favored 'General case' 0 N--CA 1.453 -0.295 0 N-CA-C 107.988 -1.115 . . . . 0.0 107.988 172.935 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B 2062 ' ' ILE . . . . . . . . . . . . . 3.8 tp -153.21 129.42 1.81 Allowed 'Isoleucine or valine' 0 C--N 1.341 0.196 0 N-CA-C 112.515 0.561 . . . . 0.0 112.515 -174.367 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B 2063 ' ' SER . . . . . 0.474 ' C ' HH21 ' A' ' 133' ' ' ARG . 39.7 m . . . . . 0 C--O 1.251 1.137 0 CA-C-O 117.674 -1.155 . . . . 0.0 109.748 174.701 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 93.5 mmm . . . . . 0 N--CA 1.471 0.617 0 N-CA-C 110.386 -0.227 . . . . 0.0 110.386 . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 6.7 tt0 -149.9 14.09 0.81 Allowed 'General case' 0 N--CA 1.455 -0.201 0 CA-C-O 120.715 0.293 . . . . 0.0 111.211 177.045 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 17.9 pm0 -76.79 52.16 0.82 Allowed 'General case' 0 CA--C 1.53 0.201 0 C-N-CA 123.552 0.741 . . . . 0.0 109.209 175.847 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 70.5 m-20 61.07 15.99 6.7 Favored 'General case' 0 N--CA 1.456 -0.127 0 C-N-CA 124.999 1.32 . . . . 0.0 113.612 -174.777 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 45.1 p-10 -97.03 1.69 50.49 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.513 0.673 . . . . 0.0 110.504 173.633 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 24.1 p-10 -91.55 -32.61 15.48 Favored 'General case' 0 N--CA 1.451 -0.385 0 N-CA-C 106.98 -1.489 . . . . 0.0 106.98 171.851 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 7' ' ' PHE . . . . . 0.626 ' HB2' ' HZ3' ' A' ' 45' ' ' LYS . 1.2 t80 -56.51 -34.37 66.92 Favored 'General case' 0 N--CA 1.449 -0.509 0 C-N-CA 125.144 1.378 . . . . 0.0 109.248 176.49 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 51.7 tp60 -49.77 -37.49 30.04 Favored 'General case' 0 N--CA 1.453 -0.308 0 C-N-CA 124.452 1.101 . . . . 0.0 111.861 -178.606 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 23.9 m-80 -73.02 -34.54 66.43 Favored 'General case' 0 N--CA 1.454 -0.232 0 CA-C-O 120.871 0.367 . . . . 0.0 110.23 -179.487 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 10' ' ' PHE . . . . . 0.45 ' CD2' ' HB2' ' A' ' 32' ' ' LEU . 9.1 t80 -70.05 -39.18 75.87 Favored 'General case' 0 N--CA 1.449 -0.498 0 C-N-CA 123.442 0.697 . . . . 0.0 109.454 176.777 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 98.7 t -64.56 -51.44 67.65 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.299 0 N-CA-C 108.757 -0.831 . . . . 0.0 108.757 178.978 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -59.21 -31.41 69.01 Favored 'General case' 0 N--CA 1.455 -0.175 0 CA-C-N 117.639 0.2 . . . . 0.0 111.529 179.737 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 46.8 m -71.17 -41.51 70.25 Favored 'General case' 0 N--CA 1.457 -0.111 0 N-CA-C 109.075 -0.713 . . . . 0.0 109.075 176.56 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -62.47 -41.61 98.9 Favored 'General case' 0 N--CA 1.451 -0.421 0 N-CA-C 109.482 -0.562 . . . . 0.0 109.482 177.929 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 61.4 mm-40 -66.38 -27.81 68.16 Favored 'General case' 0 N--CA 1.453 -0.314 0 C-N-CA 123.491 0.716 . . . . 0.0 110.137 179.312 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 16.0 p -70.9 -30.65 67.05 Favored 'General case' 0 N--CA 1.455 -0.19 0 N-CA-C 110.08 -0.341 . . . . 0.0 110.08 177.068 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 24.4 m-85 -71.45 -32.03 67.86 Favored 'General case' 0 N--CA 1.457 -0.123 0 C-N-CA 120.675 -0.41 . . . . 0.0 110.764 173.672 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 76.4 mttt -67.21 -28.1 67.79 Favored 'General case' 0 C--O 1.232 0.171 0 CA-C-O 121.276 0.56 . . . . 0.0 109.939 172.1 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 41.0 t0 -76.09 -38.97 56.33 Favored 'General case' 0 CA--C 1.531 0.217 0 CA-C-N 115.861 -0.609 . . . . 0.0 110.676 -179.252 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 74.5 mt -74.89 128.74 36.29 Favored 'General case' 0 N--CA 1.454 -0.245 0 N-CA-C 109.187 -0.671 . . . . 0.0 109.187 175.05 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . 0.511 ' HA ' ' HE3' ' A' ' 21' ' ' LYS . 0.4 OUTLIER -73.8 -12.48 60.71 Favored 'General case' 0 CA--C 1.53 0.177 0 O-C-N 121.857 -0.527 . . . . 0.0 110.485 176.946 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 80.7 p -88.04 -23.88 23.64 Favored 'General case' 0 N--CA 1.457 -0.105 0 C-N-CA 123.176 0.59 . . . . 0.0 110.388 174.395 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 70.63 -12.31 2.04 Favored Glycine 0 CA--C 1.531 1.051 0 C-N-CA 124.698 1.142 . . . . 0.0 113.582 177.763 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 74.4 mt -106.22 148.91 10.1 Favored 'Isoleucine or valine' 0 C--N 1.334 -0.092 0 CA-C-N 118.073 0.936 . . . . 0.0 110.858 -179.47 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 31.2 t -166.91 100.48 0.55 Allowed 'General case' 0 CA--C 1.519 -0.24 0 N-CA-C 108.755 -0.831 . . . . 0.0 108.755 174.979 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -50.38 -41.44 40.44 Favored Glycine 0 CA--C 1.523 0.586 0 CA-C-O 119.375 -0.681 . . . . 0.0 111.431 -176.85 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 27' ' ' SER . . . . . 0.567 ' HB3' ' HA ' ' B' 2052 ' ' ASP . 29.5 t -62.89 -52.17 64.13 Favored 'General case' 0 N--CA 1.454 -0.268 0 CA-C-N 118.484 1.142 . . . . 0.0 110.895 -178.084 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 72.3 mtt180 -70.8 -35.65 72.62 Favored 'General case' 0 CA--C 1.522 -0.122 0 C-N-CA 122.82 0.448 . . . . 0.0 110.499 -176.719 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 61.3 mt -58.09 -46.73 88.13 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.575 0 N-CA-C 108.114 -1.069 . . . . 0.0 108.114 174.719 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 63.9 mttt -65.6 -28.12 68.9 Favored 'General case' 0 C--N 1.341 0.211 0 CA-C-O 118.692 -0.671 . . . . 0.0 111.858 178.433 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.3 -57.33 10.74 Favored 'General case' 0 C--N 1.342 0.264 0 CA-C-N 118.935 0.789 . . . . 0.0 109.783 179.694 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . 0.45 ' HB2' ' CD2' ' A' ' 10' ' ' PHE . 1.6 pp -75.63 -19.09 59.44 Favored 'General case' 0 N--CA 1.453 -0.279 0 C-N-CA 119.427 -0.909 . . . . 0.0 111.911 -177.356 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 52.2 m -72.46 -36.44 68.5 Favored 'General case' 0 N--CA 1.454 -0.24 0 N-CA-C 108.455 -0.942 . . . . 0.0 108.455 176.925 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 96.0 m -72.5 -36.41 68.38 Favored 'General case' 0 N--CA 1.451 -0.387 0 CA-C-N 116.613 -0.267 . . . . 0.0 110.432 -179.942 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 12.2 t80 -61.21 -40.2 93.08 Favored 'General case' 0 N--CA 1.456 -0.16 0 N-CA-C 109.608 -0.516 . . . . 0.0 109.608 174.779 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -70.1 -34.67 73.41 Favored 'General case' 0 N--CA 1.448 -0.555 0 CA-C-N 116.072 -0.513 . . . . 0.0 111.135 -179.475 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 22.1 mt -71.1 -39.97 71.8 Favored 'General case' 0 N--CA 1.453 -0.313 0 C-N-CA 122.315 0.246 . . . . 0.0 111.22 179.776 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 44.4 t0 -64.69 -24.46 67.58 Favored 'General case' 0 N--CA 1.453 -0.285 0 C-N-CA 122.447 0.299 . . . . 0.0 110.784 176.864 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 97.9 m-70 -149.82 102.06 3.11 Favored 'General case' 0 N--CA 1.454 -0.267 0 C-N-CA 122.499 0.319 . . . . 0.0 111.716 -176.082 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 40' ' ' ILE . . . . . 0.493 ' H ' HD11 ' A' ' 40' ' ' ILE . 0.0 OUTLIER -81.0 -15.49 12.58 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.279 0 C-N-CA 123.038 0.535 . . . . 0.0 110.872 177.009 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 2.9 m-20 -58.9 -20.12 48.55 Favored 'General case' 0 N--CA 1.454 -0.263 0 N-CA-C 112.546 0.572 . . . . 0.0 112.546 -177.128 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -104.35 17.65 5.14 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.258 0 C-N-CA 123.277 0.631 . . . . 0.0 111.792 176.497 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 3.0 pp20? -54.57 -27.99 42.72 Favored 'General case' 0 CA--C 1.529 0.16 0 O-C-N 121.75 -0.594 . . . . 0.0 111.281 178.299 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 32.8 t -63.93 -48.32 77.01 Favored 'General case' 0 N--CA 1.454 -0.234 0 N-CA-C 111.788 0.292 . . . . 0.0 111.788 -178.708 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . 0.626 ' HZ3' ' HB2' ' A' ' 7' ' ' PHE . 18.2 ptpt -73.77 -23.18 59.68 Favored 'General case' 0 C--N 1.339 0.152 0 CA-C-N 118.541 0.609 . . . . 0.0 110.121 179.765 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 59.2 mt -72.85 -52.51 22.31 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.343 0 C-N-CA 122.698 0.399 . . . . 0.0 110.603 -178.999 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 39.2 mm -66.52 -36.39 77.19 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.245 0 N-CA-C 109.745 -0.465 . . . . 0.0 109.745 179.546 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 31.9 m -68.66 -40.35 80.21 Favored 'General case' 0 N--CA 1.454 -0.225 0 C-N-CA 121.114 -0.234 . . . . 0.0 111.162 -178.797 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 37.2 tp -75.97 -31.65 59.12 Favored 'General case' 0 N--CA 1.45 -0.463 0 N-CA-C 112.743 0.646 . . . . 0.0 112.743 -175.971 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 3.3 pt -71.49 -43.87 71.69 Favored 'Isoleucine or valine' 0 C--N 1.34 0.163 0 CA-C-N 118.923 0.783 . . . . 0.0 110.596 177.165 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 25.1 pt -66.09 -38.14 81.34 Favored 'Isoleucine or valine' 0 C--N 1.339 0.136 0 C-N-CA 119.469 -0.892 . . . . 0.0 110.598 176.941 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 94.9 m-20 -68.87 -31.35 70.23 Favored 'General case' 0 N--CA 1.454 -0.232 0 CA-C-N 118.248 0.476 . . . . 0.0 111.34 177.471 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 7.8 t80 -60.0 -48.76 80.39 Favored 'General case' 0 N--CA 1.451 -0.376 0 N-CA-C 107.684 -1.228 . . . . 0.0 107.684 173.832 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 46.3 t -67.24 -27.76 67.49 Favored 'General case' 0 C--N 1.34 0.174 0 CA-C-N 117.82 0.282 . . . . 0.0 111.73 -179.404 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 55.2 ttp85 -75.16 -29.67 60.53 Favored 'General case' 0 N--CA 1.453 -0.309 0 N-CA-C 112.161 0.43 . . . . 0.0 112.161 -177.222 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 36.3 mt -99.37 -43.07 6.71 Favored 'General case' 0 N--CA 1.457 -0.101 0 N-CA-C 112.378 0.51 . . . . 0.0 112.378 -179.078 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 57' ' ' CYS . . . . . 0.474 ' HB2' ' HD2' ' A' ' 58' ' ' PRO . 9.0 p -67.75 161.36 67.11 Favored Pre-proline 0 CA--C 1.534 0.351 0 N-CA-C 113.226 0.824 . . . . 0.0 113.226 -173.084 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 58' ' ' PRO . . . . . 0.474 ' HD2' ' HB2' ' A' ' 57' ' ' CYS . 66.6 Cg_endo -78.5 178.47 7.53 Favored 'Trans proline' 0 N--CA 1.453 -0.871 0 C-N-CA 124.859 3.706 . . . . 0.0 111.743 178.119 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -44.49 -55.53 5.01 Favored 'General case' 0 CA--C 1.531 0.229 0 C-N-CA 126.016 1.726 . . . . 0.0 114.557 -171.182 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 47.8 m -68.93 -30.18 68.59 Favored 'General case' 0 N--CA 1.455 -0.213 0 O-C-N 122.126 -0.359 . . . . 0.0 110.827 -173.441 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 67.6 m170 -75.69 -28.5 58.68 Favored 'General case' 0 N--CA 1.451 -0.42 0 CA-C-O 119.554 -0.26 . . . . 0.0 110.412 176.795 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 61.3 mttm -65.57 -34.29 77.91 Favored 'General case' 0 C--N 1.34 0.177 0 N-CA-C 108.975 -0.75 . . . . 0.0 108.975 173.205 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . 0.48 HD13 ' HE3' ' A' ' 123' ' ' LYS . 0.2 OUTLIER -62.97 -47.54 82.73 Favored 'General case' 0 C--N 1.34 0.173 0 N-CA-C 109.088 -0.708 . . . . 0.0 109.088 175.609 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -66.42 -34.43 87.8 Favored Glycine 0 CA--C 1.524 0.6 0 CA-C-O 119.752 -0.471 . . . . 0.0 111.946 -178.287 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 27.3 t -61.3 -45.13 95.75 Favored 'General case' 0 N--CA 1.453 -0.31 0 CA-C-N 117.582 0.691 . . . . 0.0 109.543 177.452 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 80.8 mt -66.96 -27.17 67.24 Favored 'General case' 0 N--CA 1.455 -0.201 0 O-C-N 123.04 0.213 . . . . 0.0 110.517 179.363 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -71.5 -37.58 71.24 Favored 'General case' 0 C--O 1.234 0.249 0 CA-C-O 120.638 0.256 . . . . 0.0 110.964 178.198 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 68' ' ' ILE . . . . . . . . . . . . . 10.1 mt -71.5 -50.08 42.48 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.403 0 N-CA-C 109.286 -0.635 . . . . 0.0 109.286 174.498 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 52.4 mt -48.8 -41.29 12.64 Favored 'Isoleucine or valine' 0 C--O 1.227 -0.113 0 C-N-CA 123.635 0.774 . . . . 0.0 110.78 174.977 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 10.0 t70 -67.07 -44.89 78.95 Favored 'General case' 0 N--CA 1.455 -0.218 0 CA-C-O 120.698 0.285 . . . . 0.0 110.684 179.044 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 19.6 m -69.21 -49.84 52.8 Favored 'General case' 0 N--CA 1.449 -0.483 0 CA-C-N 116.374 -0.375 . . . . 0.0 111.388 -173.762 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -75.53 -31.06 22.78 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.269 0 N-CA-C 109.678 -0.49 . . . . 0.0 109.678 -179.863 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -66.0 -49.61 57.32 Favored Glycine 0 CA--C 1.526 0.737 0 N-CA-C 111.143 -0.783 . . . . 0.0 111.143 -177.14 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 37.9 mtm105 -66.83 -43.86 82.64 Favored 'General case' 0 N--CA 1.453 -0.309 0 N-CA-C 109.585 -0.524 . . . . 0.0 109.585 177.413 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -61.77 -33.35 73.93 Favored 'General case' 0 N--CA 1.45 -0.443 0 CA-C-O 119.513 -0.28 . . . . 0.0 111.112 -176.902 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 1.5 m-30 -70.93 -46.66 62.08 Favored 'General case' 0 N--CA 1.453 -0.302 0 CA-C-N 118.162 0.437 . . . . 0.0 111.114 177.966 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -68.56 -38.49 80.79 Favored 'General case' 0 N--CA 1.45 -0.434 0 C-N-CA 117.584 -1.647 . . . . 0.0 108.057 -178.807 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 78' ' ' ASP . . . . . 0.407 ' HA ' ' HE ' ' A' ' 81' ' ' ARG . 93.8 m-20 -59.71 -48.31 82.17 Favored 'General case' 0 C--N 1.34 0.159 0 N-CA-C 112.147 0.425 . . . . 0.0 112.147 178.161 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 13.0 tm-20 -65.06 -46.74 79.95 Favored 'General case' 0 N--CA 1.446 -0.649 0 CA-C-N 117.91 0.323 . . . . 0.0 111.043 -177.425 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 70.5 p -68.65 -33.17 73.54 Favored 'General case' 0 N--CA 1.454 -0.241 0 CA-C-O 119.167 -0.444 . . . . 0.0 111.933 -178.257 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 81' ' ' ARG . . . . . 0.407 ' HE ' ' HA ' ' A' ' 78' ' ' ASP . 21.7 ptt180 -78.93 -23.91 44.38 Favored 'General case' 0 C--N 1.34 0.155 0 CA-C-N 118.771 0.714 . . . . 0.0 111.899 176.88 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 31.2 t -79.47 -35.3 40.52 Favored 'General case' 0 N--CA 1.454 -0.234 0 C-N-CA 123.061 0.545 . . . . 0.0 112.209 179.191 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 25.2 m-20 -125.91 137.3 53.71 Favored 'General case' 0 N--CA 1.452 -0.33 0 N-CA-C 112.092 0.404 . . . . 0.0 112.092 -169.996 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 47.1 t -79.5 48.76 0.94 Allowed 'General case' 0 CA--C 1.532 0.255 0 C-N-CA 124.146 0.978 . . . . 0.0 111.572 -178.442 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 57.3 m-20 -63.64 153.85 34.75 Favored 'General case' 0 N--CA 1.455 -0.199 0 CA-C-O 120.798 0.332 . . . . 0.0 111.114 -178.818 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 43.0 t -69.21 141.46 54.47 Favored 'General case' 0 N--CA 1.454 -0.272 0 CA-C-O 120.856 0.36 . . . . 0.0 110.071 178.841 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 78.9 p -76.52 95.54 3.91 Favored 'General case' 0 N--CA 1.453 -0.314 0 N-CA-C 109.916 -0.401 . . . . 0.0 109.916 -179.532 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 41.2 t -73.48 74.74 1.43 Allowed 'General case' 0 N--CA 1.454 -0.242 0 N-CA-C 109.02 -0.733 . . . . 0.0 109.02 175.008 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 11.5 m-80 61.15 177.2 0.11 Allowed 'General case' 0 CA--C 1.533 0.303 0 C-N-CA 124.266 1.026 . . . . 0.0 111.212 -175.913 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 60.0 tttm -67.91 -58.3 8.2 Favored Pre-proline 0 C--N 1.341 0.228 0 N-CA-C 108.706 -0.85 . . . . 0.0 108.706 174.828 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 63.7 Cg_endo -67.91 129.09 18.92 Favored 'Trans proline' 0 N--CA 1.451 -0.996 0 N-CA-C 107.51 -1.765 . . . . 0.0 107.51 169.594 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 114.64 16.82 7.31 Favored Glycine 0 CA--C 1.525 0.696 0 CA-C-O 119.468 -0.629 . . . . 0.0 112.457 -172.978 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 26.9 p -151.59 170.58 19.33 Favored 'General case' 0 N--CA 1.456 -0.17 0 C-N-CA 123.825 0.85 . . . . 0.0 110.34 177.35 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 94' ' ' CYS . . . . . 0.422 ' HB2' HD11 ' A' ' 98' ' ' ILE . 23.0 p -58.93 -23.86 61.83 Favored 'General case' 0 N--CA 1.451 -0.407 0 CA-C-N 115.891 -0.595 . . . . 0.0 109.469 175.582 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -60.13 -57.68 11.77 Favored 'General case' 0 N--CA 1.447 -0.606 0 N-CA-C 109.293 -0.632 . . . . 0.0 109.293 -177.178 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 52.4 t60 -75.55 -27.02 58.49 Favored 'General case' 0 N--CA 1.451 -0.419 0 C-N-CA 121.069 -0.252 . . . . 0.0 111.565 -179.893 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -69.51 -48.3 61.0 Favored 'General case' 0 N--CA 1.453 -0.307 0 CA-C-N 117.801 0.273 . . . . 0.0 110.693 -178.652 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 98' ' ' ILE . . . . . 0.422 HD11 ' HB2' ' A' ' 94' ' ' CYS . 2.0 mp -70.57 -30.94 44.62 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.226 0 N-CA-C 109.882 -0.414 . . . . 0.0 109.882 177.815 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 4.6 m120 -63.63 -49.79 71.91 Favored 'General case' 0 N--CA 1.454 -0.266 0 CA-C-N 118.337 0.517 . . . . 0.0 110.89 175.216 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 49.7 m -70.42 -24.47 62.92 Favored 'General case' 0 N--CA 1.457 -0.11 0 O-C-N 123.131 0.269 . . . . 0.0 111.085 -175.289 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 57.2 tp -83.28 -50.24 8.6 Favored 'General case' 0 N--CA 1.45 -0.467 0 C-N-CA 122.436 0.294 . . . . 0.0 110.696 179.685 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -69.53 -18.02 73.28 Favored Glycine 0 C--N 1.338 0.658 0 CA-C-O 119.507 -0.607 . . . . 0.0 112.786 -174.237 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 26.6 pt-20 -81.8 -7.44 59.6 Favored 'General case' 0 CA--C 1.533 0.29 0 CA-C-N 118.264 1.032 . . . . 0.0 112.373 -178.832 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 17.5 m -140.61 0.02 0.51 Allowed 'Isoleucine or valine' 0 N--CA 1.463 0.213 0 N-CA-C 113.315 0.858 . . . . 0.0 113.315 176.9 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 105' ' ' ILE . . . . . . . . . . . . . 9.3 tp -60.3 -28.22 41.39 Favored 'Isoleucine or valine' 0 CA--C 1.527 0.074 0 CA-C-N 119.197 0.908 . . . . 0.0 111.953 -174.521 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 10.6 pt20 -67.15 -26.89 66.89 Favored 'General case' 0 N--CA 1.453 -0.291 0 CA-C-N 118.002 0.365 . . . . 0.0 110.319 179.261 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 59.8 mm-40 -75.51 -42.02 53.76 Favored 'General case' 0 N--CA 1.456 -0.168 0 N-CA-C 110.117 -0.327 . . . . 0.0 110.117 179.897 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -72.53 -35.26 68.03 Favored 'General case' 0 N--CA 1.454 -0.265 0 N-CA-C 109.637 -0.505 . . . . 0.0 109.637 179.708 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 68.2 mt -67.01 -53.26 32.97 Favored 'General case' 0 N--CA 1.454 -0.273 0 N-CA-C 109.974 -0.38 . . . . 0.0 109.974 176.137 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 35.9 t -53.32 -42.64 66.9 Favored 'General case' 0 C--O 1.232 0.138 0 C-N-CA 122.533 0.333 . . . . 0.0 111.86 -177.247 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 47.4 t0 -66.0 -43.11 88.68 Favored 'General case' 0 N--CA 1.451 -0.378 0 N-CA-C 109.439 -0.578 . . . . 0.0 109.439 177.113 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -67.27 -35.52 79.66 Favored 'General case' 0 N--CA 1.449 -0.504 0 CA-C-O 119.557 -0.258 . . . . 0.0 111.164 -176.387 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 113' ' ' ILE . . . . . . . . . . . . . 22.0 mm -68.55 -37.29 77.49 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.326 0 CA-C-N 118.682 0.673 . . . . 0.0 109.242 178.455 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -73.64 -38.58 64.95 Favored 'General case' 0 N--CA 1.45 -0.443 0 N-CA-C 112.094 0.405 . . . . 0.0 112.094 178.553 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 115' ' ' LYS . . . . . 0.422 ' HZ3' ' HB2' ' A' ' 115' ' ' LYS . 0.0 OUTLIER -81.23 -38.68 26.55 Favored 'General case' 0 C--N 1.339 0.115 0 N-CA-C 113.075 0.769 . . . . 0.0 113.075 -175.754 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 116' ' ' SER . . . . . 0.491 ' HB2' ' CB ' ' A' ' 120' ' ' HIS . 52.5 p -81.49 158.41 24.52 Favored 'General case' 0 N--CA 1.454 -0.27 0 N-CA-C 113.314 0.857 . . . . 0.0 113.314 -169.473 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 38.9 t30 -78.92 167.92 20.44 Favored 'General case' 0 CA--C 1.531 0.224 0 C-N-CA 123.241 0.617 . . . . 0.0 110.481 -178.851 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 118' ' ' GLN . . . . . . . . . . . . . 27.8 mt-30 -56.33 -36.08 68.33 Favored 'General case' 0 CA--C 1.529 0.171 0 N-CA-C 113.054 0.761 . . . . 0.0 113.054 -171.608 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 13.3 p-10 -69.35 -37.65 77.75 Favored 'General case' 0 N--CA 1.456 -0.133 0 CA-C-O 121.176 0.512 . . . . 0.0 109.849 178.528 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 120' ' ' HIS . . . . . 0.491 ' CB ' ' HB2' ' A' ' 116' ' ' SER . 32.7 m170 -67.22 -41.14 86.22 Favored 'General case' 0 N--CA 1.45 -0.454 0 CA-C-N 115.843 -0.617 . . . . 0.0 110.112 176.63 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 50.4 mttm -58.46 -40.33 82.36 Favored 'General case' 0 C--N 1.342 0.263 0 N-CA-C 109.001 -0.741 . . . . 0.0 109.001 178.226 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 45.9 tp10 -69.91 -38.21 76.19 Favored 'General case' 0 N--CA 1.453 -0.292 0 C-N-CA 122.166 0.186 . . . . 0.0 111.202 -176.8 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 123' ' ' LYS . . . . . 0.48 ' HE3' HD13 ' A' ' 63' ' ' LEU . 50.3 mtmt -69.0 -28.21 66.39 Favored 'General case' 0 N--CA 1.453 -0.301 0 O-C-N 121.803 -0.561 . . . . 0.0 110.182 177.801 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 124' ' ' ILE . . . . . . . . . . . . . 61.5 mt -73.39 -37.68 51.65 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.297 0 N-CA-C 109.041 -0.725 . . . . 0.0 109.041 174.318 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 125' ' ' ARG . . . . . 0.429 HH11 ' HA ' ' A' ' 125' ' ' ARG . 5.7 mmm180 -60.53 -46.57 89.65 Favored 'General case' 0 N--CA 1.452 -0.331 0 CA-C-O 118.95 -0.547 . . . . 0.0 110.866 178.174 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 126' ' ' MET . . . . . . . . . . . . . 28.3 ptm -62.83 -35.75 80.95 Favored 'General case' 0 N--CA 1.452 -0.339 0 C-N-CA 118.593 -1.243 . . . . 0.0 108.736 178.12 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 2.8 mp -61.48 -35.64 78.22 Favored 'General case' 0 CA--C 1.534 0.335 0 CA-C-N 118.927 0.785 . . . . 0.0 112.033 178.59 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 128' ' ' LEU . . . . . 0.46 HD12 ' H ' ' A' ' 140' ' ' SER . 3.7 mm? -70.9 -41.76 70.83 Favored 'General case' 0 CA--C 1.527 0.092 0 CA-C-N 118.858 0.754 . . . . 0.0 109.718 178.46 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 19.4 m-20 -68.05 -30.64 69.9 Favored 'General case' 0 N--CA 1.453 -0.286 0 N-CA-C 109.704 -0.48 . . . . 0.0 109.704 179.119 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 130' ' ' ILE . . . . . 0.557 ' HA ' ' HD3' ' A' ' 133' ' ' ARG . 42.2 mt -64.24 -39.79 86.76 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.302 0 C-N-CA 122.745 0.418 . . . . 0.0 109.893 174.942 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 131' ' ' TRP . . . . . . . . . . . . . 47.4 m0 -69.8 -25.34 63.73 Favored 'General case' 0 N--CA 1.45 -0.455 0 C-N-CA 119.783 -0.767 . . . . 0.0 111.744 177.669 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 39.8 t0 -73.1 -45.78 55.13 Favored 'General case' 0 N--CA 1.454 -0.253 0 N-CA-C 110.129 -0.323 . . . . 0.0 110.129 174.855 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 133' ' ' ARG . . . . . 0.557 ' HD3' ' HA ' ' A' ' 130' ' ' ILE . 23.6 mtp85 -66.38 -38.01 86.56 Favored 'General case' 0 CA--C 1.522 -0.132 0 C-N-CA 123.353 0.661 . . . . 0.0 110.785 -178.772 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 33.6 t -75.48 -8.33 56.45 Favored 'General case' 0 N--CA 1.454 -0.246 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.697 -178.562 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 135' ' ' GLY . . . . . . . . . . . . . . . 79.02 14.54 81.84 Favored Glycine 0 CA--C 1.527 0.809 0 CA-C-O 119.549 -0.584 . . . . 0.0 113.525 175.489 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 136' ' ' LEU . . . . . . . . . . . . . 11.2 mp -71.76 -26.66 62.53 Favored 'General case' 0 CA--C 1.527 0.086 0 CA-C-N 118.493 1.147 . . . . 0.0 109.755 176.781 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 137' ' ' PHE . . . . . . . . . . . . . 20.8 m-85 54.94 12.26 0.58 Allowed 'General case' 0 CA--C 1.532 0.262 0 C-N-CA 124.815 1.246 . . . . 0.0 113.561 -179.59 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 138' ' ' GLN . . . . . . . . . . . . . 85.7 mm-40 -77.87 10.6 2.68 Favored 'General case' 0 CA--C 1.53 0.194 0 C-N-CA 122.693 0.397 . . . . 0.0 110.303 174.988 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 139' ' ' LYS . . . . . . . . . . . . . 61.2 pttt -65.42 158.65 26.14 Favored 'General case' 0 N--CA 1.452 -0.368 0 C-N-CA 123.889 0.876 . . . . 0.0 110.725 -179.34 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 140' ' ' SER . . . . . 0.46 ' H ' HD12 ' A' ' 128' ' ' LEU . 40.5 t -155.22 143.45 20.23 Favored 'General case' 0 N--CA 1.45 -0.465 0 N-CA-C 109.539 -0.541 . . . . 0.0 109.539 176.869 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 141' ' ' TYR . . . . . . . . . . . . . 70.3 m-85 -140.39 19.49 2.39 Favored 'General case' 0 N--CA 1.454 -0.272 0 C-N-CA 123.344 0.658 . . . . 0.0 110.229 -179.726 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 142' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -67.71 163.79 20.77 Favored 'General case' 0 N--CA 1.454 -0.226 0 C-N-CA 123.231 0.612 . . . . 0.0 109.41 178.335 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 17.9 p30 -63.21 -14.25 46.94 Favored 'General case' 0 N--CA 1.453 -0.276 0 N-CA-C 112.293 0.479 . . . . 0.0 112.293 -175.784 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . -67.85 -46.24 72.33 Favored 'General case' 0 N--CA 1.452 -0.344 0 N-CA-C 109.268 -0.641 . . . . 0.0 109.268 175.295 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 145' ' ' ILE . . . . . . . . . . . . . 39.8 mm -63.75 -35.93 74.78 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.212 0 C-N-CA 122.725 0.41 . . . . 0.0 110.291 177.182 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 146' ' ' ARG . . . . . . . . . . . . . 64.4 mtt180 -71.77 -23.33 61.57 Favored 'General case' 0 C--N 1.338 0.083 0 C-N-CA 122.272 0.229 . . . . 0.0 111.103 -178.162 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 147' ' ' SER . . . . . . . . . . . . . 84.3 p 46.82 51.33 12.62 Favored 'General case' 0 N--CA 1.457 -0.119 0 C-N-CA 123.766 0.826 . . . . 0.0 110.096 175.573 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 148' ' ' LYS . . . . . 0.578 ' HD3' ' H ' ' A' ' 148' ' ' LYS . 0.0 OUTLIER -46.88 -32.94 4.11 Favored 'General case' 0 CA--C 1.529 0.145 0 C-N-CA 124.88 1.272 . . . . 0.0 113.707 -172.62 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 149' ' ' CYS . . . . . . . . . . . . . 52.5 t -68.44 -57.15 6.29 Favored 'General case' 0 N--CA 1.453 -0.286 0 CA-C-N 119.062 0.846 . . . . 0.0 109.469 179.953 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 150' ' ' PHE . . . . . . . . . . . . . 45.0 m-85 -69.28 -15.62 63.39 Favored 'General case' 0 N--CA 1.453 -0.322 0 CA-C-N 116.634 -0.257 . . . . 0.0 111.304 -177.673 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 151' ' ' ALA . . . . . . . . . . . . . . . -74.85 -39.02 61.82 Favored 'General case' 0 N--CA 1.45 -0.444 0 N-CA-C 109.939 -0.393 . . . . 0.0 109.939 173.994 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 152' ' ' MET . . . . . . . . . . . . . 93.6 mtp -77.84 -21.79 50.92 Favored 'General case' 0 CA--C 1.528 0.123 0 C-N-CA 122.256 0.223 . . . . 0.0 111.585 177.11 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 153' ' ' ASP . . . . . . . . . . . . . 70.3 m-20 -72.47 -14.14 61.6 Favored 'General case' 0 CA--C 1.529 0.153 0 C-N-CA 122.628 0.371 . . . . 0.0 111.851 177.892 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 154' ' ' LEU . . . . . . . . . . . . . 88.9 mt -98.09 144.72 27.28 Favored 'General case' 0 N--CA 1.453 -0.292 0 C-N-CA 122.896 0.478 . . . . 0.0 110.016 177.335 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 155' ' ' GLU . . . . . . . . . . . . . 60.6 mt-10 -81.61 160.45 23.79 Favored 'General case' 0 N--CA 1.454 -0.266 0 CA-C-O 121.067 0.46 . . . . 0.0 111.079 179.741 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 156' ' ' HIS . . . . . . . . . . . . . 42.6 p-80 -78.39 39.27 0.32 Allowed 'General case' 0 CA--C 1.533 0.289 0 C-N-CA 124.417 1.087 . . . . 0.0 112.094 -177.594 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 157' ' ' HIS . . . . . . . . . . . . . 45.9 m170 -64.69 157.96 25.92 Favored 'General case' 0 CA--C 1.53 0.18 0 CA-C-O 120.938 0.399 . . . . 0.0 110.958 -179.754 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 158' ' ' HIS . . . . . . . . . . . . . 38.3 m80 -86.98 14.53 7.22 Favored 'General case' 0 CA--C 1.528 0.119 0 C-N-CA 123.337 0.655 . . . . 0.0 112.286 -179.97 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 159' ' ' HIS . . . . . . . . . . . . . 44.2 m80 . . . . . 0 C--O 1.251 1.137 0 CA-C-O 116.918 -1.515 . . . . 0.0 110.79 -175.83 . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' B' B 2052 ' ' ASP . . . . . 0.567 ' HA ' ' HB3' ' A' ' 27' ' ' SER . 15.1 m-20 . . . . . 0 N--CA 1.476 0.84 0 N-CA-C 111.881 0.326 . . . . 0.0 111.881 . . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B 2053 ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -69.71 18.16 0.05 OUTLIER 'General case' 0 CA--C 1.533 0.304 0 C-N-CA 124.306 1.042 . . . . 0.0 111.863 178.709 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B 2054 ' ' ASP . . . . . 0.529 ' H ' ' C ' ' B' 2052 ' ' ASP . 19.7 p30 -129.42 -0.74 5.02 Favored 'General case' 0 N--CA 1.451 -0.379 0 C-N-CA 125.314 1.446 . . . . 0.0 110.691 -179.079 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B 2055 ' ' GLU . . . . . . . . . . . . . 36.8 mt-10 -104.96 21.71 16.56 Favored 'General case' 0 CA--C 1.529 0.136 0 C-N-CA 122.679 0.392 . . . . 0.0 110.944 177.576 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B 2056 ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -59.94 152.36 23.79 Favored 'General case' 0 N--CA 1.456 -0.132 0 N-CA-C 109.625 -0.509 . . . . 0.0 109.625 177.178 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B 2057 ' ' ASP . . . . . . . . . . . . . 59.0 m-20 49.51 41.28 20.9 Favored 'General case' 0 CA--C 1.53 0.192 0 C-N-CA 122.635 0.374 . . . . 0.0 111.156 -172.715 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B 2058 ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -51.9 144.11 12.19 Favored 'General case' 0 CA--C 1.53 0.21 0 CA-C-N 117.581 0.173 . . . . 0.0 110.977 -176.639 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B 2059 ' ' THR . . . . . . . . . . . . . 64.8 p -81.93 122.27 79.82 Favored Pre-proline 0 CA--C 1.529 0.163 0 C-N-CA 122.14 0.176 . . . . 0.0 110.785 -178.312 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B 2060 ' ' PRO . . . . . . . . . . . . . 81.4 Cg_endo -71.2 -4.84 15.73 Favored 'Trans proline' 0 N--CA 1.455 -0.749 0 C-N-CA 124.08 3.187 . . . . 0.0 111.579 -178.971 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B 2061 ' ' SER . . . . . . . . . . . . . 19.3 m 60.64 -4.23 0.13 Allowed 'General case' 0 CA--C 1.53 0.19 0 C-N-CA 125.579 1.552 . . . . 0.0 114.525 177.168 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B 2062 ' ' ILE . . . . . 0.416 ' CG2' HG12 ' A' ' 130' ' ' ILE . 8.6 tt -82.02 -15.88 12.02 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.176 0 CA-C-N 118.568 0.622 . . . . 0.0 109.851 173.883 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B 2063 ' ' SER . . . . . . . . . . . . . 44.5 t . . . . . 0 C--O 1.251 1.135 0 CA-C-O 117.157 -1.402 . . . . 0.0 109.573 179.441 . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.6 tmt? . . . . . 0 N--CA 1.475 0.789 0 N-CA-C 110.124 -0.324 . . . . 0.0 110.124 . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 2.4 pm0 -65.44 -27.66 68.68 Favored 'General case' 0 N--CA 1.451 -0.375 0 N-CA-C 108.852 -0.796 . . . . 0.0 108.852 173.09 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 39.9 tp60 -157.79 141.9 15.98 Favored 'General case' 0 N--CA 1.452 -0.333 0 C-N-CA 124.146 0.978 . . . . 0.0 108.6 170.081 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -165.51 132.91 2.92 Favored 'General case' 0 N--CA 1.446 -0.625 0 N-CA-C 105.522 -2.029 . . . . 0.0 105.522 175.312 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 10.6 m-20 -77.74 7.99 5.06 Favored 'General case' 0 N--CA 1.457 -0.122 0 C-N-CA 120.291 -0.564 . . . . 0.0 112.115 -175.622 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 41.8 t0 -84.32 -19.7 33.29 Favored 'General case' 0 N--CA 1.45 -0.468 0 N-CA-C 107.873 -1.158 . . . . 0.0 107.873 172.302 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 7' ' ' PHE . . . . . 0.544 ' CD1' ' HD3' ' A' ' 45' ' ' LYS . 1.5 t80 -55.35 -35.3 65.08 Favored 'General case' 0 N--CA 1.451 -0.404 0 N-CA-C 108.525 -0.917 . . . . 0.0 108.525 175.996 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 51.8 tp60 -51.7 -34.0 36.79 Favored 'General case' 0 N--CA 1.452 -0.326 0 C-N-CA 124.937 1.295 . . . . 0.0 111.969 -178.778 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 79.9 m-20 -74.6 -36.14 62.98 Favored 'General case' 0 N--CA 1.453 -0.282 0 N-CA-C 109.906 -0.405 . . . . 0.0 109.906 -179.932 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 10' ' ' PHE . . . . . 0.477 ' CZ ' HG12 ' A' ' 46' ' ' ILE . 2.0 t80 -68.32 -36.43 79.28 Favored 'General case' 0 N--CA 1.449 -0.503 0 C-N-CA 123.086 0.554 . . . . 0.0 109.638 174.673 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 96.0 t -69.1 -52.79 30.24 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.234 0 N-CA-C 109.606 -0.516 . . . . 0.0 109.606 178.385 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -58.9 -28.47 66.21 Favored 'General case' 0 N--CA 1.454 -0.232 0 CA-C-N 117.747 0.248 . . . . 0.0 111.478 -179.154 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 86.7 m -72.64 -39.01 67.51 Favored 'General case' 0 N--CA 1.454 -0.242 0 N-CA-C 109.099 -0.704 . . . . 0.0 109.099 175.602 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -64.39 -43.26 95.02 Favored 'General case' 0 N--CA 1.451 -0.422 0 N-CA-C 109.018 -0.734 . . . . 0.0 109.018 177.773 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 67.6 mm-40 -65.42 -26.49 68.0 Favored 'General case' 0 N--CA 1.455 -0.22 0 C-N-CA 123.85 0.86 . . . . 0.0 110.011 178.425 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 68.1 m -70.53 -30.17 66.84 Favored 'General case' 0 N--CA 1.455 -0.183 0 N-CA-C 110.015 -0.365 . . . . 0.0 110.015 176.901 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 17' ' ' PHE . . . . . 0.419 ' CD1' HD12 ' A' ' 68' ' ' ILE . 35.9 m-85 -71.98 -32.8 67.6 Favored 'General case' 0 C--N 1.338 0.088 0 C-N-CA 119.943 -0.703 . . . . 0.0 110.76 172.41 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 72.9 mttt -66.76 -25.36 66.46 Favored 'General case' 0 CA--C 1.531 0.235 0 N-CA-C 110.037 -0.357 . . . . 0.0 110.037 174.541 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 42.6 t0 -76.56 -48.74 18.32 Favored 'General case' 0 CA--C 1.529 0.15 0 N-CA-C 110.306 -0.257 . . . . 0.0 110.306 175.439 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 16.2 mt -56.23 125.26 21.01 Favored 'General case' 0 N--CA 1.457 -0.098 0 CA-C-O 120.714 0.293 . . . . 0.0 110.467 -177.64 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . 0.474 ' H ' ' HE2' ' A' ' 21' ' ' LYS . 1.0 OUTLIER -70.74 -22.57 62.4 Favored 'General case' 0 N--CA 1.456 -0.138 0 N-CA-C 109.819 -0.437 . . . . 0.0 109.819 -179.84 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 22' ' ' SER . . . . . 0.415 ' C ' ' H ' ' A' ' 24' ' ' ILE . 61.8 m -90.69 -13.34 34.37 Favored 'General case' 0 N--CA 1.457 -0.09 0 C-N-CA 122.901 0.48 . . . . 0.0 111.059 176.299 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 70.55 -16.83 0.92 Allowed Glycine 0 CA--C 1.529 0.923 0 C-N-CA 124.135 0.874 . . . . 0.0 112.983 -179.677 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . 0.415 ' H ' ' C ' ' A' ' 22' ' ' SER . 93.6 mt -100.41 147.67 7.53 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.135 0 CA-C-N 117.773 0.786 . . . . 0.0 111.121 -179.961 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 24.3 t -161.12 104.68 1.31 Allowed 'General case' 0 CA--C 1.517 -0.294 0 N-CA-C 108.273 -1.01 . . . . 0.0 108.273 170.808 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -59.93 -28.47 66.12 Favored Glycine 0 CA--C 1.525 0.657 0 C-N-CA 119.914 -1.136 . . . . 0.0 110.829 -176.697 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 86.3 p -72.75 -49.34 31.53 Favored 'General case' 0 N--CA 1.453 -0.303 0 CA-C-N 117.854 0.827 . . . . 0.0 110.683 -179.634 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 40.5 mtt-85 -72.55 -37.35 68.27 Favored 'General case' 0 N--CA 1.453 -0.311 0 CA-C-N 117.577 0.171 . . . . 0.0 110.632 -178.534 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 63.0 mt -60.03 -46.24 94.47 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.668 0 N-CA-C 108.704 -0.85 . . . . 0.0 108.704 175.838 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 28.8 mtmm -64.89 -29.03 69.96 Favored 'General case' 0 C--N 1.338 0.091 0 CA-C-O 119.168 -0.444 . . . . 0.0 111.284 178.747 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . 0.466 ' CE ' ' HA ' ' A' ' 31' ' ' LYS . 3.5 mmpt? -66.2 -59.21 3.97 Favored 'General case' 0 N--CA 1.456 -0.155 0 CA-C-N 118.739 0.699 . . . . 0.0 111.454 -179.15 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . 0.429 HD22 ' CE1' ' A' ' 10' ' ' PHE . 0.8 OUTLIER -75.33 -16.76 60.38 Favored 'General case' 0 CA--C 1.531 0.212 0 C-N-CA 118.747 -1.181 . . . . 0.0 111.568 -179.249 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 40.5 m -71.04 -44.37 65.96 Favored 'General case' 0 N--CA 1.455 -0.194 0 N-CA-C 108.19 -1.041 . . . . 0.0 108.19 174.41 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 95.3 m -65.29 -42.74 92.79 Favored 'General case' 0 N--CA 1.453 -0.316 0 N-CA-C 109.601 -0.518 . . . . 0.0 109.601 -179.731 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 38.4 t80 -61.44 -34.31 75.2 Favored 'General case' 0 N--CA 1.453 -0.323 0 CA-C-O 120.731 0.3 . . . . 0.0 110.268 179.18 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -75.3 -25.51 57.96 Favored 'General case' 0 N--CA 1.45 -0.445 0 CA-C-O 119.378 -0.344 . . . . 0.0 111.767 177.977 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 2.2 mm? -82.93 -33.46 26.8 Favored 'General case' 0 N--CA 1.456 -0.149 0 N-CA-C 108.595 -0.891 . . . . 0.0 108.595 -178.127 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 82.7 m-20 -64.52 -28.42 69.64 Favored 'General case' 0 N--CA 1.444 -0.77 0 C-N-CA 123.595 0.758 . . . . 0.0 110.532 174.677 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 73.3 m80 -151.39 106.99 3.36 Favored 'General case' 0 N--CA 1.453 -0.286 0 C-N-CA 122.826 0.45 . . . . 0.0 111.902 -179.841 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 40' ' ' ILE . . . . . 0.563 ' H ' HD12 ' A' ' 40' ' ' ILE . 0.0 OUTLIER -78.61 -10.8 13.0 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.284 0 N-CA-C 109.593 -0.521 . . . . 0.0 109.593 172.699 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -54.85 -28.28 48.72 Favored 'General case' 0 N--CA 1.453 -0.301 0 C-N-CA 123.798 0.839 . . . . 0.0 111.75 -177.006 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -104.88 16.39 6.1 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.318 0 C-N-CA 123.47 0.708 . . . . 0.0 112.375 -179.94 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 3.1 pp20? -53.89 -31.44 49.93 Favored 'General case' 0 C--O 1.225 -0.235 0 O-C-N 121.51 -0.744 . . . . 0.0 110.375 179.66 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 37.6 t -59.42 -48.04 83.18 Favored 'General case' 0 CA--C 1.532 0.287 0 CA-C-O 119.703 -0.189 . . . . 0.0 111.32 -176.913 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . 0.544 ' HD3' ' CD1' ' A' ' 7' ' ' PHE . 18.7 ptpt -75.4 -25.48 57.62 Favored 'General case' 0 CA--C 1.531 0.23 0 CA-C-N 118.267 0.485 . . . . 0.0 110.49 179.541 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 46' ' ' ILE . . . . . 0.477 HG12 ' CZ ' ' A' ' 10' ' ' PHE . 94.5 mt -71.96 -46.45 59.88 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.254 0 N-CA-C 109.667 -0.494 . . . . 0.0 109.667 -179.339 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 39.6 mm -65.22 -34.0 67.52 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.531 0 N-CA-C 108.965 -0.754 . . . . 0.0 108.965 177.311 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 53.8 m -64.75 -35.1 79.96 Favored 'General case' 0 N--CA 1.453 -0.299 0 CA-C-O 119.649 -0.215 . . . . 0.0 111.117 178.068 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 16.1 mt -73.62 -40.58 63.7 Favored 'General case' 0 N--CA 1.452 -0.328 0 CA-C-O 118.753 -0.642 . . . . 0.0 112.528 179.516 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 9.0 pt -68.44 -40.25 81.94 Favored 'Isoleucine or valine' 0 C--N 1.339 0.124 0 CA-C-N 119.474 1.034 . . . . 0.0 111.051 -177.962 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 16.6 pt -68.99 -39.23 79.48 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.185 0 C-N-CA 120.136 -0.626 . . . . 0.0 110.709 179.333 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 50.7 t0 -64.81 -51.66 60.93 Favored 'General case' 0 N--CA 1.455 -0.194 0 N-CA-C 109.648 -0.501 . . . . 0.0 109.648 177.924 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 25.9 t80 -59.57 -53.29 59.81 Favored 'General case' 0 N--CA 1.45 -0.46 0 N-CA-C 109.543 -0.54 . . . . 0.0 109.543 -179.298 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 18.7 t -61.48 -29.53 70.03 Favored 'General case' 0 N--CA 1.452 -0.337 0 N-CA-C 111.974 0.361 . . . . 0.0 111.974 -174.344 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 5.1 tpm_? -75.5 -60.43 2.31 Favored 'General case' 0 CA--C 1.532 0.283 0 C-N-CA 122.5 0.32 . . . . 0.0 111.326 -179.5 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 9.1 mp -75.66 -28.66 58.82 Favored 'General case' 0 C--O 1.231 0.093 0 N-CA-C 114.14 1.163 . . . . 0.0 114.14 -174.966 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 57' ' ' CYS . . . . . 0.428 ' O ' ' HE2' ' A' ' 62' ' ' LYS . 13.2 p -68.28 156.74 89.47 Favored Pre-proline 0 CA--C 1.536 0.428 0 N-CA-C 112.471 0.545 . . . . 0.0 112.471 -174.713 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 58' ' ' PRO . . . . . 0.419 ' HD2' ' HB2' ' A' ' 57' ' ' CYS . 94.0 Cg_endo -74.05 175.97 10.15 Favored 'Trans proline' 0 N--CA 1.454 -0.832 0 C-N-CA 125.046 3.83 . . . . 0.0 111.593 179.203 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 32.4 p-10 -52.66 -47.2 67.29 Favored 'General case' 0 CA--C 1.529 0.145 0 C-N-CA 124.533 1.133 . . . . 0.0 113.737 -170.847 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 40.2 t -65.23 -37.63 87.87 Favored 'General case' 0 N--CA 1.456 -0.145 0 CA-C-O 121.121 0.486 . . . . 0.0 110.462 -178.758 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 66.1 m170 -75.3 -26.36 58.64 Favored 'General case' 0 N--CA 1.452 -0.375 0 CA-C-N 116.521 -0.309 . . . . 0.0 110.232 179.836 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . 0.428 ' HE2' ' O ' ' A' ' 57' ' ' CYS . 68.7 mttm -65.93 -39.43 90.5 Favored 'General case' 0 C--N 1.342 0.249 0 N-CA-C 109.29 -0.633 . . . . 0.0 109.29 174.334 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -61.15 -48.38 81.86 Favored 'General case' 0 N--CA 1.454 -0.233 0 N-CA-C 108.313 -0.995 . . . . 0.0 108.313 176.541 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -63.99 -31.89 82.36 Favored Glycine 0 CA--C 1.524 0.642 0 N-CA-C 111.668 -0.573 . . . . 0.0 111.668 -179.21 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 37.4 p -65.85 -38.53 89.1 Favored 'General case' 0 N--CA 1.454 -0.271 0 CA-C-N 117.699 0.749 . . . . 0.0 109.887 179.011 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 82.3 mt -72.61 -25.54 61.35 Favored 'General case' 0 N--CA 1.451 -0.396 0 N-CA-C 110.026 -0.361 . . . . 0.0 110.026 178.914 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -72.45 -38.59 68.24 Favored 'General case' 0 N--CA 1.454 -0.268 0 N-CA-C 110.374 -0.232 . . . . 0.0 110.374 176.335 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 68' ' ' ILE . . . . . 0.419 HD12 ' CD1' ' A' ' 17' ' ' PHE . 18.2 mt -69.19 -46.82 77.06 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.237 0 N-CA-C 109.673 -0.491 . . . . 0.0 109.673 176.0 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 70.7 mt -56.55 -32.46 36.91 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.161 0 C-N-CA 123.031 0.532 . . . . 0.0 110.814 176.252 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 6.9 t70 -69.76 -50.08 46.83 Favored 'General case' 0 N--CA 1.452 -0.354 0 CA-C-O 119.383 -0.341 . . . . 0.0 111.132 179.38 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 99.2 p -67.5 -49.89 61.41 Favored 'General case' 0 N--CA 1.455 -0.219 0 C-N-CA 120.505 -0.478 . . . . 0.0 110.663 -175.757 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -74.89 -32.44 27.72 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.182 0 N-CA-C 109.931 -0.396 . . . . 0.0 109.931 -176.508 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -69.75 -58.53 6.27 Favored Glycine 0 C--N 1.336 0.566 0 N-CA-C 111.116 -0.794 . . . . 0.0 111.116 -176.975 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 28.7 mtp-105 -61.51 -40.95 96.46 Favored 'General case' 0 N--CA 1.45 -0.426 0 N-CA-C 109.808 -0.441 . . . . 0.0 109.808 -177.799 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -67.81 -28.23 67.41 Favored 'General case' 0 N--CA 1.451 -0.411 0 C-N-CA 120.771 -0.372 . . . . 0.0 111.331 179.993 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 1.3 m-30 -69.63 -46.23 66.68 Favored 'General case' 0 N--CA 1.455 -0.221 0 CA-C-N 118.648 0.658 . . . . 0.0 111.192 178.529 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 44.2 tp -73.51 -35.83 65.65 Favored 'General case' 0 N--CA 1.449 -0.477 0 C-N-CA 117.471 -1.691 . . . . 0.0 110.219 -179.995 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 89.0 m-20 -62.52 -46.22 89.39 Favored 'General case' 0 C--O 1.231 0.122 0 N-CA-C 112.393 0.516 . . . . 0.0 112.393 178.641 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 15.1 tm-20 -65.35 -47.75 75.39 Favored 'General case' 0 N--CA 1.444 -0.759 0 CA-C-N 118.017 0.371 . . . . 0.0 110.873 -179.026 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 76.7 p -68.23 -25.04 65.0 Favored 'General case' 0 N--CA 1.452 -0.328 0 CA-C-O 119.674 -0.203 . . . . 0.0 111.49 -179.172 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 35.4 ttp-105 -75.51 -34.05 60.79 Favored 'General case' 0 N--CA 1.457 -0.093 0 C-N-CA 122.711 0.404 . . . . 0.0 111.234 172.915 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 34.6 t -87.81 -7.6 57.06 Favored 'General case' 0 N--CA 1.456 -0.157 0 C-N-CA 123.839 0.856 . . . . 0.0 113.249 -177.876 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 40.5 t-20 -138.84 172.66 12.54 Favored 'General case' 0 N--CA 1.454 -0.253 0 C-N-CA 122.712 0.405 . . . . 0.0 110.989 -172.619 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 43.6 t -66.1 161.7 21.22 Favored 'General case' 0 N--CA 1.454 -0.263 0 C-N-CA 123.18 0.592 . . . . 0.0 110.393 179.082 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 5.8 m120 -119.35 163.58 16.98 Favored 'General case' 0 N--CA 1.453 -0.276 0 N-CA-C 109.65 -0.5 . . . . 0.0 109.65 179.9 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 60.0 p -76.36 37.99 0.17 Allowed 'General case' 0 CA--C 1.528 0.119 0 C-N-CA 123.625 0.77 . . . . 0.0 112.312 -176.731 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 21.5 t 55.08 -157.48 0.22 Allowed 'General case' 0 CA--C 1.534 0.362 0 C-N-CA 123.121 0.568 . . . . 0.0 111.024 -177.559 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 80.8 p -64.67 101.35 0.46 Allowed 'General case' 0 N--CA 1.455 -0.186 0 C-N-CA 122.961 0.504 . . . . 0.0 109.794 -179.595 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 29.6 t30 -161.09 170.1 21.11 Favored 'General case' 0 N--CA 1.453 -0.293 0 C-N-CA 123.721 0.808 . . . . 0.0 108.917 -177.349 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 31.9 mmmt -129.09 -67.19 0.02 OUTLIER Pre-proline 0 CA--C 1.532 0.25 0 CA-C-O 118.141 -0.933 . . . . 0.0 111.062 177.848 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 71.6 Cg_endo -69.53 150.22 69.32 Favored 'Trans proline' 0 N--CA 1.455 -0.787 0 C-N-CA 121.949 1.766 . . . . 0.0 110.246 -178.861 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 84.9 19.13 60.02 Favored Glycine 0 CA--C 1.523 0.567 0 CA-C-O 119.483 -0.62 . . . . 0.0 112.344 179.303 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 25.1 p -153.76 172.82 16.71 Favored 'General case' 0 N--CA 1.455 -0.195 0 C-N-CA 123.533 0.733 . . . . 0.0 110.716 178.702 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 94' ' ' CYS . . . . . . . . . . . . . 30.6 p -59.93 -21.73 61.51 Favored 'General case' 0 N--CA 1.449 -0.522 0 CA-C-N 115.467 -0.788 . . . . 0.0 110.234 175.064 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -60.22 -56.8 17.14 Favored 'General case' 0 N--CA 1.447 -0.578 0 N-CA-C 109.722 -0.473 . . . . 0.0 109.722 -176.088 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 73.7 t60 -75.17 -37.12 61.4 Favored 'General case' 0 N--CA 1.45 -0.435 0 O-C-N 122.924 0.14 . . . . 0.0 111.014 179.191 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -62.58 -50.83 69.75 Favored 'General case' 0 N--CA 1.451 -0.379 0 N-CA-C 111.821 0.304 . . . . 0.0 111.821 -177.585 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 1.8 mp -73.03 -33.14 41.98 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.165 0 CA-C-N 118.233 0.469 . . . . 0.0 110.068 -179.164 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 2.1 m120 -65.0 -40.65 95.26 Favored 'General case' 0 N--CA 1.452 -0.326 0 CA-C-N 118.547 0.612 . . . . 0.0 111.465 177.129 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 96.7 m -67.2 -42.7 83.71 Favored 'General case' 0 N--CA 1.452 -0.339 0 CA-C-O 120.514 0.197 . . . . 0.0 110.532 -178.011 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 75.7 mt -74.3 -28.49 61.2 Favored 'General case' 0 N--CA 1.45 -0.439 0 C-N-CA 120.805 -0.358 . . . . 0.0 110.871 179.997 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -59.19 -25.11 59.6 Favored Glycine 0 CA--C 1.527 0.803 0 N-CA-C 111.683 -0.567 . . . . 0.0 111.683 -177.868 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 17.4 mm-40 -84.49 -41.74 16.27 Favored 'General case' 0 N--CA 1.454 -0.272 0 CA-C-N 117.965 0.882 . . . . 0.0 112.309 179.588 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 16.5 m -104.5 -4.17 9.63 Favored 'Isoleucine or valine' 0 N--CA 1.461 0.095 0 N-CA-C 114.164 1.172 . . . . 0.0 114.164 -171.501 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 105' ' ' ILE . . . . . . . . . . . . . 11.1 tp -63.69 -33.42 61.63 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.244 0 CA-C-N 119.463 1.029 . . . . 0.0 110.913 -177.421 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 23.8 pt20 -67.15 -30.22 70.15 Favored 'General case' 0 CA--C 1.531 0.237 0 C-N-CA 122.948 0.499 . . . . 0.0 110.03 178.523 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 5.8 mm-40 -74.12 -46.67 41.22 Favored 'General case' 0 N--CA 1.454 -0.245 0 C-N-CA 123.135 0.574 . . . . 0.0 110.425 177.708 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 81.6 mt -68.66 -33.58 74.24 Favored 'General case' 0 N--CA 1.455 -0.217 0 N-CA-C 110.045 -0.354 . . . . 0.0 110.045 -178.77 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 36.4 mt -65.25 -62.13 1.72 Allowed 'General case' 0 N--CA 1.449 -0.49 0 N-CA-C 109.332 -0.618 . . . . 0.0 109.332 175.171 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 25.7 t -58.13 -35.55 71.65 Favored 'General case' 0 C--N 1.338 0.107 0 N-CA-C 112.005 0.372 . . . . 0.0 112.005 -173.463 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 62.1 t0 -61.85 -44.02 97.66 Favored 'General case' 0 N--CA 1.45 -0.47 0 N-CA-C 108.979 -0.748 . . . . 0.0 108.979 176.643 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -71.47 -37.67 71.3 Favored 'General case' 0 N--CA 1.446 -0.646 0 CA-C-N 116.434 -0.348 . . . . 0.0 110.802 -178.861 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 113' ' ' ILE . . . . . 0.481 ' O ' ' HE3' ' A' ' 121' ' ' LYS . 32.9 mm -61.25 -43.59 96.78 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.259 0 N-CA-C 109.356 -0.609 . . . . 0.0 109.356 -179.403 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -74.56 -38.83 62.6 Favored 'General case' 0 N--CA 1.451 -0.422 0 N-CA-C 112.039 0.385 . . . . 0.0 112.039 -176.701 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 115' ' ' LYS . . . . . 0.608 ' HB2' ' HZ2' ' A' ' 115' ' ' LYS . 0.0 OUTLIER -77.42 -34.44 54.7 Favored 'General case' 0 C--N 1.338 0.099 0 N-CA-C 112.106 0.41 . . . . 0.0 112.106 -177.585 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 116' ' ' SER . . . . . 0.501 ' HB2' ' CB ' ' A' ' 120' ' ' HIS . 29.3 p -87.72 157.55 19.03 Favored 'General case' 0 N--CA 1.454 -0.257 0 N-CA-C 113.084 0.772 . . . . 0.0 113.084 -169.43 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 53.2 t30 -75.48 167.8 21.22 Favored 'General case' 0 C--O 1.224 -0.268 0 C-N-CA 123.874 0.869 . . . . 0.0 111.052 -178.293 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 118' ' ' GLN . . . . . . . . . . . . . 19.6 mm100 -57.6 -32.51 67.26 Favored 'General case' 0 CA--C 1.527 0.085 0 C-N-CA 123.17 0.588 . . . . 0.0 111.405 -176.062 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 36.6 t0 -65.51 -45.37 83.81 Favored 'General case' 0 N--CA 1.454 -0.24 0 CA-C-O 121.701 0.762 . . . . 0.0 108.967 175.639 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 120' ' ' HIS . . . . . 0.501 ' CB ' ' HB2' ' A' ' 116' ' ' SER . 33.5 m170 -68.14 -37.31 80.92 Favored 'General case' 0 N--CA 1.449 -0.477 0 N-CA-C 109.731 -0.47 . . . . 0.0 109.731 179.852 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 121' ' ' LYS . . . . . 0.481 ' HE3' ' O ' ' A' ' 113' ' ' ILE . 61.6 mttp -60.21 -36.96 78.86 Favored 'General case' 0 CA--C 1.521 -0.17 0 N-CA-C 108.675 -0.861 . . . . 0.0 108.675 176.394 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 28.1 tt0 -65.43 -44.41 87.43 Favored 'General case' 0 N--CA 1.452 -0.359 0 C-N-CA 122.379 0.272 . . . . 0.0 110.791 -178.03 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 14.4 mptt -67.34 -36.4 81.33 Favored 'General case' 0 C--O 1.226 -0.149 0 C-N-CA 120.63 -0.428 . . . . 0.0 110.115 -179.209 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 124' ' ' ILE . . . . . . . . . . . . . 54.4 mt -68.67 -32.88 56.86 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.329 0 N-CA-C 109.07 -0.715 . . . . 0.0 109.07 176.474 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 125' ' ' ARG . . . . . 0.457 ' HA ' ' HD2' ' A' ' 125' ' ' ARG . 17.4 tpt85 -69.64 -35.49 75.26 Favored 'General case' 0 N--CA 1.447 -0.599 0 CA-C-O 119.214 -0.422 . . . . 0.0 111.889 -174.806 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 126' ' ' MET . . . . . . . . . . . . . 26.8 ptm -73.88 -38.69 64.32 Favored 'General case' 0 N--CA 1.453 -0.284 0 N-CA-C 109.19 -0.67 . . . . 0.0 109.19 175.656 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 6.4 mp -61.26 -36.33 79.7 Favored 'General case' 0 CA--C 1.53 0.175 0 N-CA-C 109.434 -0.58 . . . . 0.0 109.434 174.811 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 43.6 tp -65.73 -44.33 86.33 Favored 'General case' 0 N--CA 1.454 -0.273 0 O-C-N 122.108 -0.37 . . . . 0.0 110.941 -179.128 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 89.2 m-20 -68.0 -36.4 79.93 Favored 'General case' 0 N--CA 1.456 -0.158 0 N-CA-C 110.366 -0.235 . . . . 0.0 110.366 176.245 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 54.4 mt -63.13 -38.4 81.96 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.436 0 N-CA-C 109.316 -0.624 . . . . 0.0 109.316 177.733 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 131' ' ' TRP . . . . . . . . . . . . . 41.0 m0 -75.49 -30.77 59.97 Favored 'General case' 0 N--CA 1.454 -0.269 0 CA-C-O 119.481 -0.295 . . . . 0.0 111.481 179.403 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 51.5 t0 -65.12 -36.18 83.47 Favored 'General case' 0 N--CA 1.452 -0.351 0 N-CA-C 109.377 -0.601 . . . . 0.0 109.377 178.393 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 133' ' ' ARG . . . . . 0.461 HH21 ' C ' ' B' 2063 ' ' SER . 9.5 mtp180 -75.26 -34.62 61.4 Favored 'General case' 0 C--N 1.34 0.165 0 C-N-CA 124.028 0.931 . . . . 0.0 110.696 175.525 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 30.1 m -75.44 -25.89 57.86 Favored 'General case' 0 C--N 1.339 0.15 0 N-CA-C 111.702 0.26 . . . . 0.0 111.702 -178.044 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 135' ' ' GLY . . . . . . . . . . . . . . . 78.34 4.58 87.06 Favored Glycine 0 CA--C 1.53 1.029 0 CA-C-O 118.935 -0.925 . . . . 0.0 114.251 176.536 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 136' ' ' LEU . . . . . . . . . . . . . 7.7 mp -68.33 -20.78 64.76 Favored 'General case' 0 C--N 1.337 0.062 0 CA-C-N 119.059 1.429 . . . . 0.0 111.357 179.682 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 137' ' ' PHE . . . . . . . . . . . . . 34.3 m-85 -143.68 179.92 6.84 Favored 'General case' 0 N--CA 1.457 -0.11 0 CA-C-O 121.048 0.452 . . . . 0.0 111.291 -171.714 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 138' ' ' GLN . . . . . . . . . . . . . 28.1 mp0 -62.35 166.85 4.63 Favored 'General case' 0 N--CA 1.452 -0.343 0 C-N-CA 123.706 0.802 . . . . 0.0 111.392 -179.393 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 139' ' ' LYS . . . . . 0.544 ' HE2' ' HA ' ' A' ' 139' ' ' LYS . 10.6 mmpt? -66.25 154.73 39.11 Favored 'General case' 0 N--CA 1.455 -0.175 0 C-N-CA 123.233 0.613 . . . . 0.0 111.125 -177.263 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 140' ' ' SER . . . . . . . . . . . . . 63.9 p -70.38 20.55 0.04 OUTLIER 'General case' 0 CA--C 1.531 0.234 0 C-N-CA 125.135 1.374 . . . . 0.0 113.955 -174.826 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 141' ' ' TYR . . . . . . . . . . . . . 31.8 p90 -146.59 18.76 1.32 Allowed 'General case' 0 N--CA 1.455 -0.19 0 CA-C-N 118.708 0.685 . . . . 0.0 112.275 -177.137 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 142' ' ' LEU . . . . . 0.525 ' HG ' ' H ' ' A' ' 144' ' ' ALA . 61.4 tp -66.67 145.25 55.77 Favored 'General case' 0 N--CA 1.455 -0.22 0 CA-C-N 117.972 0.351 . . . . 0.0 110.465 -179.616 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 76.5 m-20 -63.83 -18.78 64.47 Favored 'General case' 0 N--CA 1.457 -0.098 0 N-CA-C 112.484 0.549 . . . . 0.0 112.484 -177.532 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 144' ' ' ALA . . . . . 0.525 ' H ' ' HG ' ' A' ' 142' ' ' LEU . . . -73.25 -23.16 60.3 Favored 'General case' 0 N--CA 1.45 -0.444 0 N-CA-C 112.184 0.438 . . . . 0.0 112.184 -177.759 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 145' ' ' ILE . . . . . . . . . . . . . 25.7 mm -75.1 -32.4 26.62 Favored 'Isoleucine or valine' 0 CA--C 1.524 -0.038 0 N-CA-C 109.917 -0.401 . . . . 0.0 109.917 -177.78 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 146' ' ' ARG . . . . . . . . . . . . . 14.4 ptt-85 -85.13 -61.44 1.77 Allowed 'General case' 0 N--CA 1.453 -0.279 0 N-CA-C 109.206 -0.665 . . . . 0.0 109.206 172.695 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 147' ' ' SER . . . . . . . . . . . . . 28.8 t 43.07 23.01 0.03 OUTLIER 'General case' 0 CA--C 1.533 0.301 0 C-N-CA 125.661 1.584 . . . . 0.0 114.895 176.078 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 37.5 mtmt 48.38 26.72 1.19 Allowed 'General case' 0 CA--C 1.535 0.401 0 CA-C-N 118.373 0.533 . . . . 0.0 112.063 -175.13 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 149' ' ' CYS . . . . . . . . . . . . . 42.6 t -59.12 -23.91 62.53 Favored 'General case' 0 N--CA 1.454 -0.238 0 O-C-N 122.039 -0.413 . . . . 0.0 111.578 -175.326 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 150' ' ' PHE . . . . . . . . . . . . . 91.4 t80 -67.17 -31.02 71.15 Favored 'General case' 0 N--CA 1.454 -0.258 0 O-C-N 121.867 -0.521 . . . . 0.0 110.304 177.244 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 151' ' ' ALA . . . . . . . . . . . . . . . -78.81 -26.32 44.28 Favored 'General case' 0 N--CA 1.452 -0.349 0 N-CA-C 109.988 -0.375 . . . . 0.0 109.988 175.56 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 152' ' ' MET . . . . . . . . . . . . . 86.6 mtp -75.41 -23.32 57.01 Favored 'General case' 0 CA--C 1.529 0.17 0 CA-C-O 119.61 -0.233 . . . . 0.0 111.591 176.466 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 153' ' ' ASP . . . . . 0.433 ' CG ' ' HZ1' ' A' ' 115' ' ' LYS . 93.2 m-20 -74.81 -14.25 60.67 Favored 'General case' 0 N--CA 1.457 -0.119 0 N-CA-C 112.812 0.671 . . . . 0.0 112.812 179.53 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 154' ' ' LEU . . . . . . . . . . . . . 4.6 pp -119.42 156.25 30.51 Favored 'General case' 0 N--CA 1.451 -0.398 0 CA-C-O 121.224 0.535 . . . . 0.0 111.456 -178.67 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 155' ' ' GLU . . . . . . . . . . . . . 78.7 mm-40 -73.83 165.01 25.88 Favored 'General case' 0 CA--C 1.527 0.086 0 C-N-CA 123.461 0.704 . . . . 0.0 112.849 -174.965 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 156' ' ' HIS . . . . . . . . . . . . . 80.0 m-70 60.82 13.11 4.19 Favored 'General case' 0 CA--C 1.529 0.138 0 N-CA-C 114.641 1.349 . . . . 0.0 114.641 177.63 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 157' ' ' HIS . . . . . . . . . . . . . 96.8 m-70 -146.38 168.0 22.2 Favored 'General case' 0 N--CA 1.456 -0.16 0 C-N-CA 123.123 0.569 . . . . 0.0 110.46 178.541 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 158' ' ' HIS . . . . . . . . . . . . . 48.9 p-80 -157.97 177.18 11.62 Favored 'General case' 0 N--CA 1.453 -0.303 0 C-N-CA 123.505 0.722 . . . . 0.0 109.1 -178.314 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 159' ' ' HIS . . . . . . . . . . . . . 31.9 p-80 . . . . . 0 C--O 1.247 0.942 0 CA-C-O 117.78 -1.105 . . . . 0.0 110.873 179.441 . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' B' B 2052 ' ' ASP . . . . . . . . . . . . . 2.9 m-20 . . . . . 0 N--CA 1.471 0.598 0 N-CA-C 110.854 -0.054 . . . . 0.0 110.854 . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' B' B 2053 ' ' ASP . . . . . . . . . . . . . 9.1 m-20 -119.48 169.35 10.12 Favored 'General case' 0 N--CA 1.456 -0.155 0 C-N-CA 123.832 0.853 . . . . 0.0 109.852 -177.741 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B 2054 ' ' ASP . . . . . . . . . . . . . 19.8 p-10 -99.14 -20.28 16.73 Favored 'General case' 0 N--CA 1.454 -0.268 0 C-N-CA 122.484 0.314 . . . . 0.0 111.408 178.633 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B 2055 ' ' GLU . . . . . . . . . . . . . 83.4 tt0 -79.45 78.4 5.98 Favored 'General case' 0 N--CA 1.454 -0.246 0 N-CA-C 109.221 -0.659 . . . . 0.0 109.221 175.758 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B 2056 ' ' ASP . . . . . . . . . . . . . 49.2 p-10 -79.82 7.2 9.15 Favored 'General case' 0 CA--C 1.533 0.323 0 N-CA-C 112.942 0.719 . . . . 0.0 112.942 -174.92 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B 2057 ' ' ASP . . . . . . . . . . . . . 41.0 t0 -151.66 161.15 43.15 Favored 'General case' 0 N--CA 1.455 -0.218 0 C-N-CA 122.79 0.436 . . . . 0.0 109.828 178.645 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B 2058 ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -123.45 -5.67 8.21 Favored 'General case' 0 CA--C 1.531 0.237 0 N-CA-C 109.27 -0.641 . . . . 0.0 109.27 175.561 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B 2059 ' ' THR . . . . . . . . . . . . . 7.5 m 48.12 74.33 0.83 Allowed Pre-proline 0 C--N 1.341 0.23 0 C-N-CA 126.092 1.757 . . . . 0.0 112.982 171.928 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B 2060 ' ' PRO . . . . . . . . . . . . . 61.3 Cg_endo -67.99 158.08 58.97 Favored 'Trans proline' 0 N--CA 1.454 -0.823 0 C-N-CA 123.206 2.604 . . . . 0.0 110.289 177.34 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B 2061 ' ' SER . . . . . . . . . . . . . 46.5 t -151.34 157.48 42.53 Favored 'General case' 0 C--O 1.233 0.228 0 C-N-CA 123.054 0.542 . . . . 0.0 110.246 -179.349 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B 2062 ' ' ILE . . . . . . . . . . . . . 19.2 tt -167.07 157.56 1.07 Allowed 'Isoleucine or valine' 0 N--CA 1.454 -0.24 0 C-N-CA 123.173 0.589 . . . . 0.0 110.532 -177.757 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B 2063 ' ' SER . . . . . 0.461 ' C ' HH21 ' A' ' 133' ' ' ARG . 82.9 p . . . . . 0 C--O 1.249 1.059 0 CA-C-O 117.156 -1.402 . . . . 0.0 110.325 175.266 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 85.6 mtp . . . . . 0 N--CA 1.472 0.657 0 CA-C-O 119.374 -0.346 . . . . 0.0 111.526 . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 80.9 mt-30 -143.74 -3.76 0.88 Allowed 'General case' 0 CA--C 1.531 0.223 0 N-CA-C 112.546 0.573 . . . . 0.0 112.546 -177.816 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 17.8 pt20 -151.66 14.4 0.65 Allowed 'General case' 0 C--O 1.232 0.142 0 N-CA-C 107.928 -1.138 . . . . 0.0 107.928 178.134 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 1.3 p30 -161.58 172.57 16.13 Favored 'General case' 0 N--CA 1.446 -0.668 0 C-N-CA 125.368 1.467 . . . . 0.0 108.951 -167.511 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 4.2 m-20 57.33 18.05 4.1 Favored 'General case' 0 N--CA 1.456 -0.17 0 C-N-CA 124.254 1.022 . . . . 0.0 113.111 -177.518 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 24.9 p-10 -73.85 -34.1 64.37 Favored 'General case' 0 N--CA 1.455 -0.21 0 N-CA-C 109.429 -0.582 . . . . 0.0 109.429 -177.688 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 7' ' ' PHE . . . . . 0.533 ' HB2' ' HZ2' ' A' ' 45' ' ' LYS . 1.5 t80 -58.07 -36.48 72.88 Favored 'General case' 0 N--CA 1.446 -0.672 0 C-N-CA 123.173 0.589 . . . . 0.0 111.403 -176.972 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 51.7 tp60 -57.92 -32.17 67.5 Favored 'General case' 0 N--CA 1.453 -0.312 0 C-N-CA 122.689 0.395 . . . . 0.0 111.473 -176.959 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 49.6 t30 -69.44 -33.97 73.74 Favored 'General case' 0 N--CA 1.454 -0.264 0 N-CA-C 109.663 -0.495 . . . . 0.0 109.663 177.826 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 10' ' ' PHE . . . . . 0.502 ' CE2' ' HB2' ' A' ' 32' ' ' LEU . 12.0 t80 -70.33 -40.89 73.87 Favored 'General case' 0 N--CA 1.45 -0.446 0 N-CA-C 109.479 -0.563 . . . . 0.0 109.479 177.427 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 91.3 t -63.0 -55.63 22.4 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.372 0 N-CA-C 108.394 -0.965 . . . . 0.0 108.394 179.544 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -57.79 -29.44 64.87 Favored 'General case' 0 N--CA 1.451 -0.384 0 C-N-CA 122.847 0.459 . . . . 0.0 112.072 179.737 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 95.2 m -72.33 -41.05 66.95 Favored 'General case' 0 CA--C 1.529 0.162 0 CA-C-N 118.864 0.756 . . . . 0.0 109.297 177.208 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . 0.515 ' HA ' ' CD1' ' A' ' 17' ' ' PHE . 10.8 tp -65.84 -42.65 90.22 Favored 'General case' 0 N--CA 1.454 -0.244 0 CA-C-O 121.053 0.454 . . . . 0.0 109.847 178.743 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 77.3 mm-40 -63.65 -32.8 74.39 Favored 'General case' 0 N--CA 1.452 -0.364 0 C-N-CA 123.947 0.899 . . . . 0.0 109.488 177.02 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 70.7 m -69.36 -22.43 63.74 Favored 'General case' 0 N--CA 1.451 -0.421 0 CA-C-O 119.011 -0.518 . . . . 0.0 110.422 177.149 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 17' ' ' PHE . . . . . 0.515 ' CD1' ' HA ' ' A' ' 14' ' ' LEU . 17.0 m-85 -74.49 -38.14 62.95 Favored 'General case' 0 C--N 1.343 0.324 0 CA-C-N 118.572 0.624 . . . . 0.0 110.83 170.303 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . 0.429 ' HG2' ' CE1' ' A' ' 53' ' ' TYR . 61.5 mttt -63.72 -23.51 67.39 Favored 'General case' 0 C--N 1.34 0.194 0 CA-C-O 120.786 0.327 . . . . 0.0 110.443 178.924 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 32.0 t0 -75.74 -9.47 58.62 Favored 'General case' 0 CA--C 1.538 0.488 0 C-N-CA 123.397 0.679 . . . . 0.0 112.711 176.315 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . 0.495 ' CD1' ' HB2' ' A' ' 25' ' ' SER . 66.9 mt -88.87 171.65 9.76 Favored 'General case' 0 N--CA 1.455 -0.188 0 O-C-N 121.556 -0.715 . . . . 0.0 112.865 -176.443 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 2.1 mppt? -77.79 -25.77 49.21 Favored 'General case' 0 N--CA 1.453 -0.295 0 CA-C-N 115.661 -0.7 . . . . 0.0 110.694 178.725 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 9.4 t -147.58 9.51 0.92 Allowed 'General case' 0 CA--C 1.522 -0.105 0 N-CA-C 113.166 0.802 . . . . 0.0 113.166 -175.879 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 70.23 -13.94 1.37 Allowed Glycine 0 CA--C 1.528 0.856 0 C-N-CA 123.819 0.723 . . . . 0.0 113.234 176.374 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 83.8 mt -65.95 129.31 30.16 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.196 0 N-CA-C 107.282 -1.377 . . . . 0.0 107.282 175.546 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 25' ' ' SER . . . . . 0.495 ' HB2' ' CD1' ' A' ' 20' ' ' LEU . 3.0 t -159.61 73.56 0.57 Allowed 'General case' 0 CA--C 1.518 -0.261 0 N-CA-C 110.198 -0.297 . . . . 0.0 110.198 -171.357 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -44.6 -51.14 8.09 Favored Glycine 0 CA--C 1.527 0.789 0 CA-C-O 118.838 -0.979 . . . . 0.0 114.126 -170.305 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 27' ' ' SER . . . . . 0.432 ' HA ' ' HE3' ' A' ' 30' ' ' LYS . 37.1 p -70.34 -39.03 74.94 Favored 'General case' 0 N--CA 1.455 -0.184 0 CA-C-N 119.615 1.707 . . . . 0.0 111.072 -173.913 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 87.5 mtt180 -74.18 -39.83 62.94 Favored 'General case' 0 N--CA 1.454 -0.259 0 CA-C-N 117.812 0.278 . . . . 0.0 110.715 -179.36 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 61.7 mt -56.63 -46.09 82.67 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.634 0 N-CA-C 108.782 -0.822 . . . . 0.0 108.782 173.753 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . 0.432 ' HE3' ' HA ' ' A' ' 27' ' ' SER . 51.4 mtmt -66.75 -29.08 68.97 Favored 'General case' 0 C--N 1.34 0.168 0 CA-C-O 118.984 -0.532 . . . . 0.0 111.332 179.261 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . 0.459 ' HA ' ' CE ' ' A' ' 31' ' ' LYS . 3.3 mmpt? -66.13 -55.64 15.41 Favored 'General case' 0 N--CA 1.458 -0.073 0 CA-C-N 118.795 0.725 . . . . 0.0 111.014 -179.075 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . 0.502 ' HB2' ' CE2' ' A' ' 10' ' ' PHE . 1.6 pp -76.12 -18.88 58.96 Favored 'General case' 0 CA--C 1.532 0.264 0 C-N-CA 119.427 -0.909 . . . . 0.0 111.702 -179.71 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 33.2 m -71.13 -40.69 71.24 Favored 'General case' 0 N--CA 1.456 -0.156 0 N-CA-C 108.746 -0.835 . . . . 0.0 108.746 174.834 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 97.9 m -66.75 -41.2 88.17 Favored 'General case' 0 N--CA 1.45 -0.444 0 N-CA-C 109.776 -0.453 . . . . 0.0 109.776 179.388 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 22.1 t80 -60.62 -34.97 75.03 Favored 'General case' 0 C--O 1.226 -0.145 0 N-CA-C 109.938 -0.393 . . . . 0.0 109.938 177.337 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -73.46 -28.45 61.95 Favored 'General case' 0 N--CA 1.449 -0.49 0 CA-C-O 119.25 -0.405 . . . . 0.0 111.522 178.817 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 2.6 mm? -82.38 -34.26 28.43 Favored 'General case' 0 CA--C 1.52 -0.193 0 N-CA-C 109.259 -0.645 . . . . 0.0 109.259 -177.564 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 83.0 m-20 -64.93 -26.74 68.44 Favored 'General case' 0 N--CA 1.442 -0.85 0 C-N-CA 123.829 0.852 . . . . 0.0 110.675 174.463 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 75.7 m80 -151.59 105.64 3.17 Favored 'General case' 0 N--CA 1.452 -0.329 0 C-N-CA 122.985 0.514 . . . . 0.0 111.264 -177.959 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 40' ' ' ILE . . . . . 0.533 ' H ' HD13 ' A' ' 40' ' ' ILE . 0.0 OUTLIER -81.22 -14.59 12.59 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.378 0 C-N-CA 123.323 0.649 . . . . 0.0 110.7 175.481 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 94.5 m-20 -61.35 -11.65 10.89 Favored 'General case' 0 CA--C 1.528 0.103 0 N-CA-C 112.924 0.713 . . . . 0.0 112.924 -178.366 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -111.12 16.15 8.08 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.163 0 C-N-CA 123.23 0.612 . . . . 0.0 111.33 176.17 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 3.0 pp20? -52.77 -32.56 44.23 Favored 'General case' 0 CA--C 1.531 0.228 0 O-C-N 121.649 -0.657 . . . . 0.0 110.668 177.236 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 40.7 t -58.71 -48.35 81.43 Favored 'General case' 0 C--O 1.234 0.267 0 N-CA-C 112.519 0.562 . . . . 0.0 112.519 -179.362 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . 0.533 ' HZ2' ' HB2' ' A' ' 7' ' ' PHE . 18.7 ptpt -72.33 -25.9 61.72 Favored 'General case' 0 CA--C 1.53 0.187 0 CA-C-N 118.35 0.523 . . . . 0.0 110.193 179.69 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 70.4 mt -72.39 -48.8 46.2 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.257 0 N-CA-C 109.969 -0.382 . . . . 0.0 109.969 -178.236 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 39.6 mm -64.34 -35.67 74.89 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.232 0 N-CA-C 109.296 -0.631 . . . . 0.0 109.296 178.766 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 49.0 m -63.73 -38.93 92.95 Favored 'General case' 0 N--CA 1.453 -0.289 0 CA-C-N 116.836 -0.166 . . . . 0.0 111.1 179.993 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 35.7 mt -76.25 -32.81 59.08 Favored 'General case' 0 N--CA 1.45 -0.467 0 N-CA-C 113.545 0.943 . . . . 0.0 113.545 -178.917 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 15.5 pt -69.81 -40.62 79.23 Favored 'Isoleucine or valine' 0 CA--C 1.523 -0.089 0 CA-C-N 119.647 1.112 . . . . 0.0 110.298 179.294 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 25.8 pt -69.05 -38.53 78.45 Favored 'Isoleucine or valine' 0 CA--C 1.527 0.095 0 C-N-CA 120.068 -0.653 . . . . 0.0 110.528 178.838 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 95.9 m-20 -70.26 -39.36 75.02 Favored 'General case' 0 N--CA 1.456 -0.172 0 CA-C-O 119.281 -0.39 . . . . 0.0 112.007 177.848 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 53' ' ' TYR . . . . . 0.429 ' CE1' ' HG2' ' A' ' 18' ' ' LYS . 13.9 t80 -65.55 -46.61 78.86 Favored 'General case' 0 N--CA 1.453 -0.3 0 N-CA-C 108.707 -0.849 . . . . 0.0 108.707 177.384 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 23.1 m -61.71 -31.9 72.08 Favored 'General case' 0 N--CA 1.455 -0.218 0 O-C-N 123.096 0.248 . . . . 0.0 110.869 -178.327 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 56.2 ttp85 -75.43 -53.34 8.85 Favored 'General case' 0 N--CA 1.451 -0.381 0 C-N-CA 123.494 0.718 . . . . 0.0 112.023 -177.181 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 38.0 mt -76.1 -41.53 50.05 Favored 'General case' 0 N--CA 1.456 -0.158 0 N-CA-C 113.025 0.75 . . . . 0.0 113.025 -173.666 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 8.5 p -64.76 157.1 76.32 Favored Pre-proline 0 CA--C 1.535 0.37 0 N-CA-C 112.842 0.682 . . . . 0.0 112.842 -172.717 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 93.7 Cg_endo -74.66 175.85 10.56 Favored 'Trans proline' 0 N--CA 1.457 -0.664 0 C-N-CA 124.777 3.652 . . . . 0.0 111.131 178.945 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 23.1 p-10 -51.65 -50.06 61.09 Favored 'General case' 0 N--CA 1.456 -0.159 0 C-N-CA 124.31 1.044 . . . . 0.0 113.606 -172.061 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 81.9 p -64.92 -35.71 82.04 Favored 'General case' 0 N--CA 1.452 -0.351 0 C-N-CA 120.066 -0.654 . . . . 0.0 110.148 -177.299 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 48.3 m170 -74.04 -24.77 59.59 Favored 'General case' 0 N--CA 1.455 -0.18 0 CA-C-O 119.033 -0.508 . . . . 0.0 110.263 178.499 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 64.8 mttm -65.96 -34.74 78.8 Favored 'General case' 0 C--N 1.339 0.144 0 CA-C-N 118.791 0.723 . . . . 0.0 109.484 173.984 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -63.65 -48.68 76.27 Favored 'General case' 0 CA--C 1.531 0.248 0 N-CA-C 108.339 -0.985 . . . . 0.0 108.339 174.385 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -66.45 -26.88 72.82 Favored Glycine 0 CA--C 1.525 0.717 0 N-CA-C 111.732 -0.547 . . . . 0.0 111.732 -178.979 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 48.9 m -68.3 -40.35 81.77 Favored 'General case' 0 N--CA 1.452 -0.369 0 CA-C-N 117.654 0.727 . . . . 0.0 109.226 177.297 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 78.0 mt -70.05 -23.84 63.16 Favored 'General case' 0 N--CA 1.449 -0.51 0 CA-C-N 116.633 -0.258 . . . . 0.0 110.502 178.417 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 2.3 m-85 -69.54 -40.77 76.66 Favored 'General case' 0 N--CA 1.456 -0.149 0 CA-C-N 117.703 0.229 . . . . 0.0 111.23 173.041 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 68' ' ' ILE . . . . . 0.44 HD12 ' CD1' ' A' ' 17' ' ' PHE . 8.3 mt -67.43 -43.96 87.2 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.236 0 N-CA-C 109.123 -0.695 . . . . 0.0 109.123 178.772 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 88.9 mt -60.22 -30.69 46.54 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.251 0 C-N-CA 122.717 0.407 . . . . 0.0 111.059 175.887 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 19.4 t70 -70.09 -45.03 67.84 Favored 'General case' 0 N--CA 1.454 -0.262 0 CA-C-N 118.276 0.489 . . . . 0.0 111.603 179.346 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 95.0 p -70.88 -50.08 39.03 Favored 'General case' 0 N--CA 1.45 -0.444 0 C-N-CA 120.857 -0.337 . . . . 0.0 110.381 -176.404 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -75.72 -35.25 30.49 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.218 0 N-CA-C 110.234 -0.284 . . . . 0.0 110.234 -178.108 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -65.32 -51.78 46.21 Favored Glycine 0 C--N 1.335 0.476 0 N-CA-C 111.461 -0.656 . . . . 0.0 111.461 -175.132 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 36.8 mtm105 -71.26 -42.97 68.1 Favored 'General case' 0 N--CA 1.452 -0.351 0 C-N-CA 120.218 -0.593 . . . . 0.0 110.253 179.674 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -60.54 -28.26 68.29 Favored 'General case' 0 N--CA 1.45 -0.443 0 C-N-CA 120.024 -0.67 . . . . 0.0 110.193 -178.692 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 1.8 m-30 -70.36 -55.31 9.43 Favored 'General case' 0 N--CA 1.453 -0.275 0 CA-C-N 118.242 0.473 . . . . 0.0 110.865 174.993 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 6.9 tt -65.94 -43.67 87.33 Favored 'General case' 0 N--CA 1.451 -0.423 0 C-N-CA 117.661 -1.616 . . . . 0.0 109.331 -175.955 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 56.5 m-20 -55.82 -51.45 67.45 Favored 'General case' 0 CA--C 1.528 0.116 0 C-N-CA 122.471 0.308 . . . . 0.0 111.438 -179.028 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 15.2 tm-20 -66.23 -46.1 78.35 Favored 'General case' 0 N--CA 1.446 -0.666 0 N-CA-C 111.618 0.229 . . . . 0.0 111.618 -178.246 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 81.4 p -70.51 -21.51 62.74 Favored 'General case' 0 N--CA 1.451 -0.38 0 CA-C-O 119.711 -0.185 . . . . 0.0 111.341 -178.263 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -75.92 -33.21 59.86 Favored 'General case' 0 N--CA 1.453 -0.309 0 CA-C-N 117.858 0.299 . . . . 0.0 110.198 172.363 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 46.1 t -77.49 -23.47 50.31 Favored 'General case' 0 N--CA 1.457 -0.118 0 N-CA-C 112.68 0.622 . . . . 0.0 112.68 -178.945 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 72.4 m-20 -132.04 177.4 7.58 Favored 'General case' 0 CA--C 1.529 0.151 0 CA-C-O 120.986 0.422 . . . . 0.0 111.391 -172.35 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 25.0 m -68.71 -1.41 6.91 Favored 'General case' 0 CA--C 1.53 0.196 0 N-CA-C 112.718 0.636 . . . . 0.0 112.718 -179.19 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 77.0 m-20 -75.16 13.05 0.76 Allowed 'General case' 0 CA--C 1.534 0.361 0 C-N-CA 123.236 0.614 . . . . 0.0 112.123 -179.884 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 98.8 p -62.62 -26.56 68.68 Favored 'General case' 0 CA--C 1.528 0.107 0 C-N-CA 123.427 0.691 . . . . 0.0 112.249 -177.496 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 47.1 t -163.47 161.82 24.39 Favored 'General case' 0 N--CA 1.454 -0.232 0 CA-C-N 118.339 0.518 . . . . 0.0 110.72 -179.787 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 87.7 p -157.84 159.49 36.72 Favored 'General case' 0 N--CA 1.449 -0.496 0 N-CA-C 109.062 -0.718 . . . . 0.0 109.062 177.515 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 5.6 m120 -74.77 21.66 0.11 Allowed 'General case' 0 CA--C 1.533 0.307 0 C-N-CA 123.416 0.686 . . . . 0.0 112.632 -178.186 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 22.3 pttm -155.83 164.87 19.86 Favored Pre-proline 0 N--CA 1.455 -0.225 0 CA-C-N 118.079 0.399 . . . . 0.0 110.417 -176.077 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 44.5 Cg_endo -63.56 118.37 5.3 Favored 'Trans proline' 0 N--CA 1.45 -1.031 0 N-CA-C 106.35 -2.212 . . . . 0.0 106.35 167.141 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 92' ' ' GLY . . . . . 0.407 ' HA2' ' O ' ' A' ' 40' ' ' ILE . . . 156.9 19.51 0.04 OUTLIER Glycine 0 CA--C 1.529 0.932 0 CA-C-O 118.896 -0.947 . . . . 0.0 114.019 -170.803 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 1.3 p -155.2 165.49 36.51 Favored 'General case' 0 C--O 1.231 0.129 0 CA-C-N 118.617 1.209 . . . . 0.0 109.607 179.46 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 94' ' ' CYS . . . . . . . . . . . . . 2.3 t -51.46 -28.91 14.48 Favored 'General case' 0 N--CA 1.454 -0.233 0 C-N-CA 123.462 0.705 . . . . 0.0 110.722 175.372 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -54.56 -62.54 1.59 Allowed 'General case' 0 N--CA 1.451 -0.403 0 CA-C-N 117.821 0.282 . . . . 0.0 110.357 -179.001 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 66.2 t60 -71.54 -32.6 68.33 Favored 'General case' 0 N--CA 1.451 -0.38 0 O-C-N 122.29 -0.256 . . . . 0.0 110.65 -177.585 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -68.39 -51.74 40.69 Favored 'General case' 0 N--CA 1.451 -0.398 0 N-CA-C 111.579 0.214 . . . . 0.0 111.579 -175.528 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 1.7 mp -69.43 -34.86 64.2 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.234 0 CA-C-O 119.35 -0.357 . . . . 0.0 110.116 -178.231 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 29.5 m-80 -70.89 -40.0 72.49 Favored 'General case' 0 N--CA 1.456 -0.131 0 C-N-CA 119.995 -0.682 . . . . 0.0 112.018 178.896 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 85.3 m -74.2 -25.02 59.45 Favored 'General case' 0 N--CA 1.457 -0.104 0 CA-C-N 118.348 0.522 . . . . 0.0 111.178 -177.151 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 64.6 tp -87.57 -40.73 13.99 Favored 'General case' 0 N--CA 1.451 -0.409 0 O-C-N 122.256 -0.278 . . . . 0.0 110.506 177.582 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -69.86 -20.29 75.91 Favored Glycine 0 CA--C 1.527 0.84 0 CA-C-O 119.579 -0.567 . . . . 0.0 112.52 -175.592 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 22.9 pt-20 -79.35 -4.66 51.96 Favored 'General case' 0 N--CA 1.453 -0.295 0 CA-C-N 118.168 0.984 . . . . 0.0 111.595 179.285 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 21.9 m -139.89 3.93 0.57 Allowed 'Isoleucine or valine' 0 N--CA 1.464 0.259 0 N-CA-C 112.538 0.57 . . . . 0.0 112.538 176.834 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 105' ' ' ILE . . . . . . . . . . . . . 10.9 tp -64.43 -31.04 51.9 Favored 'Isoleucine or valine' 0 C--O 1.227 -0.104 0 CA-C-N 118.912 0.778 . . . . 0.0 111.118 -175.352 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 11.7 pt20 -67.8 -28.69 67.81 Favored 'General case' 0 N--CA 1.454 -0.23 0 O-C-N 122.017 -0.427 . . . . 0.0 110.107 179.453 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 61.6 mm-40 -75.68 -42.22 51.71 Favored 'General case' 0 N--CA 1.454 -0.243 0 N-CA-C 109.791 -0.448 . . . . 0.0 109.791 -179.35 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 88.7 mt -71.37 -34.59 70.58 Favored 'General case' 0 N--CA 1.454 -0.226 0 CA-C-N 116.67 -0.241 . . . . 0.0 110.793 -178.993 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 77.2 mt -67.04 -49.44 65.19 Favored 'General case' 0 N--CA 1.452 -0.329 0 N-CA-C 109.682 -0.488 . . . . 0.0 109.682 174.967 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 47.8 m -53.67 -39.8 65.41 Favored 'General case' 0 C--O 1.232 0.173 0 C-N-CA 122.528 0.331 . . . . 0.0 110.98 -179.575 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 29.4 t0 -67.18 -41.39 86.01 Favored 'General case' 0 N--CA 1.451 -0.421 0 CA-C-O 120.916 0.389 . . . . 0.0 110.199 177.715 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -70.87 -36.96 73.04 Favored 'General case' 0 N--CA 1.449 -0.51 0 CA-C-N 116.287 -0.415 . . . . 0.0 111.316 -176.324 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 113' ' ' ILE . . . . . 0.439 ' O ' ' HE3' ' A' ' 121' ' ' LYS . 18.3 mm -68.99 -40.98 81.59 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.185 0 N-CA-C 109.441 -0.577 . . . . 0.0 109.441 179.898 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -69.63 -27.64 65.23 Favored 'General case' 0 N--CA 1.453 -0.282 0 N-CA-C 112.048 0.388 . . . . 0.0 112.048 -179.903 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 115' ' ' LYS . . . . . 0.597 ' HB2' ' HZ1' ' A' ' 115' ' ' LYS . 0.0 OUTLIER -90.09 -38.17 13.73 Favored 'General case' 0 CA--C 1.529 0.139 0 N-CA-C 112.434 0.531 . . . . 0.0 112.434 -179.472 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 116' ' ' SER . . . . . 0.414 ' HB3' ' CB ' ' A' ' 120' ' ' HIS . 2.7 m -86.51 154.33 21.18 Favored 'General case' 0 CA--C 1.528 0.125 0 N-CA-C 112.227 0.454 . . . . 0.0 112.227 -170.307 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 49.1 t30 -77.72 170.56 16.38 Favored 'General case' 0 CA--C 1.531 0.229 0 C-N-CA 123.117 0.567 . . . . 0.0 111.302 -175.954 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 118' ' ' GLN . . . . . . . . . . . . . 20.8 mm100 -57.84 -34.05 69.3 Favored 'General case' 0 N--CA 1.457 -0.079 0 C-N-CA 123.237 0.615 . . . . 0.0 112.239 -173.631 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 9.5 p30 -70.39 -40.7 73.78 Favored 'General case' 0 N--CA 1.453 -0.29 0 N-CA-C 109.377 -0.601 . . . . 0.0 109.377 176.935 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 120' ' ' HIS . . . . . 0.414 ' CB ' ' HB3' ' A' ' 116' ' ' SER . 29.0 m170 -64.41 -39.47 93.91 Favored 'General case' 0 N--CA 1.45 -0.445 0 N-CA-C 109.746 -0.464 . . . . 0.0 109.746 176.486 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 121' ' ' LYS . . . . . 0.439 ' HE3' ' O ' ' A' ' 113' ' ' ILE . 64.5 mttp -59.73 -36.39 76.5 Favored 'General case' 0 C--N 1.342 0.257 0 N-CA-C 109.725 -0.472 . . . . 0.0 109.725 176.841 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 26.8 tt0 -65.74 -43.74 88.07 Favored 'General case' 0 N--CA 1.452 -0.341 0 C-N-CA 122.625 0.37 . . . . 0.0 110.651 -178.765 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 14.3 mptt -68.28 -30.02 68.94 Favored 'General case' 0 N--CA 1.457 -0.118 0 C-N-CA 120.486 -0.486 . . . . 0.0 110.221 -179.481 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 124' ' ' ILE . . . . . . . . . . . . . 67.6 mt -73.13 -39.64 57.12 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.365 0 N-CA-C 109.385 -0.598 . . . . 0.0 109.385 177.862 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 8.1 mmm180 -61.54 -43.72 98.34 Favored 'General case' 0 N--CA 1.451 -0.416 0 CA-C-O 118.544 -0.741 . . . . 0.0 111.593 179.051 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 126' ' ' MET . . . . . . . . . . . . . 28.2 ptm -64.68 -38.93 92.67 Favored 'General case' 0 N--CA 1.454 -0.274 0 C-N-CA 118.77 -1.172 . . . . 0.0 108.897 177.816 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 4.2 mp -61.81 -44.08 97.57 Favored 'General case' 0 N--CA 1.455 -0.223 0 CA-C-N 118.076 0.398 . . . . 0.0 111.09 178.216 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 83.9 mt -65.36 -32.66 74.42 Favored 'General case' 0 N--CA 1.456 -0.145 0 CA-C-N 118.506 0.593 . . . . 0.0 111.465 -177.832 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 45.5 m-20 -75.63 -35.51 60.45 Favored 'General case' 0 N--CA 1.453 -0.31 0 CA-C-N 118.329 0.513 . . . . 0.0 109.863 177.011 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 130' ' ' ILE . . . . . 0.437 ' HA ' ' HD3' ' A' ' 133' ' ' ARG . 66.9 mt -62.98 -33.3 59.84 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.25 0 N-CA-C 109.39 -0.596 . . . . 0.0 109.39 174.784 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 131' ' ' TRP . . . . . . . . . . . . . 43.0 m0 -71.31 -40.69 70.65 Favored 'General case' 0 N--CA 1.452 -0.339 0 N-CA-C 112.164 0.431 . . . . 0.0 112.164 179.129 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 25.5 m-20 -63.32 -31.83 73.08 Favored 'General case' 0 N--CA 1.455 -0.189 0 CA-C-N 118.516 0.598 . . . . 0.0 110.331 178.18 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 133' ' ' ARG . . . . . 0.437 ' HD3' ' HA ' ' A' ' 130' ' ' ILE . 18.0 mtp180 -73.03 -29.17 62.8 Favored 'General case' 0 CA--C 1.529 0.137 0 C-N-CA 122.89 0.476 . . . . 0.0 111.126 178.232 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 15.2 t -74.17 -14.91 61.02 Favored 'General case' 0 CA--C 1.532 0.258 0 CA-C-N 117.855 0.298 . . . . 0.0 110.839 173.856 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 135' ' ' GLY . . . . . . . . . . . . . . . 93.37 8.63 61.06 Favored Glycine 0 CA--C 1.527 0.827 0 CA-C-O 119.554 -0.581 . . . . 0.0 112.257 179.768 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 136' ' ' LEU . . . . . . . . . . . . . 61.6 mt -64.95 162.3 16.8 Favored 'General case' 0 N--CA 1.454 -0.258 0 CA-C-N 117.74 0.77 . . . . 0.0 109.624 175.789 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 137' ' ' PHE . . . . . . . . . . . . . 12.1 m-30 -60.6 119.25 7.73 Favored 'General case' 0 N--CA 1.454 -0.237 0 N-CA-C 108.237 -1.023 . . . . 0.0 108.237 177.998 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 138' ' ' GLN . . . . . . . . . . . . . 27.9 mt-30 -70.47 152.01 44.49 Favored 'General case' 0 N--CA 1.451 -0.381 0 CA-C-O 120.935 0.398 . . . . 0.0 111.314 -174.865 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 139' ' ' LYS . . . . . 0.492 ' CD ' ' H ' ' A' ' 139' ' ' LYS . 0.0 OUTLIER -64.82 149.48 49.33 Favored 'General case' 0 N--CA 1.455 -0.224 0 N-CA-C 108.663 -0.865 . . . . 0.0 108.663 173.311 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 140' ' ' SER . . . . . 0.482 ' C ' ' H ' ' A' ' 142' ' ' LEU . 38.8 t -146.76 172.1 14.14 Favored 'General case' 0 N--CA 1.454 -0.26 0 C-N-CA 122.151 0.18 . . . . 0.0 111.076 -173.782 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 141' ' ' TYR . . . . . 0.422 ' C ' ' H ' ' A' ' 143' ' ' ASN . 44.0 m-85 62.68 -35.13 0.12 Allowed 'General case' 0 CA--C 1.53 0.184 0 C-N-CA 126.742 2.017 . . . . 0.0 113.33 -174.434 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 142' ' ' LEU . . . . . 0.482 ' H ' ' C ' ' A' ' 140' ' ' SER . 57.3 mt 59.41 -26.2 0.03 OUTLIER 'General case' 0 CA--C 1.533 0.299 0 C-N-CA 127.513 2.325 . . . . 0.0 114.709 177.627 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 143' ' ' ASN . . . . . 0.422 ' H ' ' C ' ' A' ' 141' ' ' TYR . 21.4 t-20 -68.94 -35.76 77.15 Favored 'General case' 0 N--CA 1.454 -0.227 0 CA-C-N 119.149 0.886 . . . . 0.0 110.353 -179.718 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . -70.75 -51.25 28.38 Favored 'General case' 0 N--CA 1.45 -0.464 0 N-CA-C 109.199 -0.667 . . . . 0.0 109.199 177.258 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 145' ' ' ILE . . . . . . . . . . . . . 41.1 mm -57.16 -39.17 65.23 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.234 0 C-N-CA 122.917 0.487 . . . . 0.0 110.586 178.977 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 146' ' ' ARG . . . . . . . . . . . . . 52.1 tpt85 -73.43 -24.47 60.25 Favored 'General case' 0 N--CA 1.456 -0.152 0 O-C-N 122.171 -0.331 . . . . 0.0 110.462 177.92 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 147' ' ' SER . . . . . . . . . . . . . 32.4 t 48.98 63.55 2.08 Favored 'General case' 0 N--CA 1.455 -0.209 0 C-N-CA 123.557 0.743 . . . . 0.0 110.725 178.961 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -53.77 -14.67 0.99 Allowed 'General case' 0 CA--C 1.529 0.15 0 C-N-CA 123.643 0.777 . . . . 0.0 112.522 179.729 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 149' ' ' CYS . . . . . . . . . . . . . 48.7 t -62.87 -28.06 69.77 Favored 'General case' 0 N--CA 1.451 -0.41 0 N-CA-C 109.478 -0.564 . . . . 0.0 109.478 177.377 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 150' ' ' PHE . . . . . . . . . . . . . 53.4 t80 -62.67 -28.43 69.92 Favored 'General case' 0 N--CA 1.454 -0.257 0 N-CA-C 110.247 -0.279 . . . . 0.0 110.247 179.455 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 151' ' ' ALA . . . . . . . . . . . . . . . -83.08 -30.71 27.77 Favored 'General case' 0 N--CA 1.452 -0.33 0 C-N-CA 122.353 0.261 . . . . 0.0 110.311 175.449 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 152' ' ' MET . . . . . . . . . . . . . 90.3 mtp -74.21 -21.47 59.79 Favored 'General case' 0 C--N 1.337 0.059 0 C-N-CA 122.288 0.235 . . . . 0.0 111.246 177.765 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 153' ' ' ASP . . . . . . . . . . . . . 67.5 m-20 -74.47 -12.28 60.45 Favored 'General case' 0 CA--C 1.53 0.175 0 C-N-CA 123.532 0.733 . . . . 0.0 111.775 176.192 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 154' ' ' LEU . . . . . . . . . . . . . 78.9 mt -74.3 143.73 44.85 Favored 'General case' 0 N--CA 1.454 -0.237 0 O-C-N 122.196 -0.315 . . . . 0.0 110.899 -178.892 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 155' ' ' GLU . . . . . . . . . . . . . 23.0 pt-20 -156.01 169.62 24.04 Favored 'General case' 0 N--CA 1.454 -0.269 0 C-N-CA 123.277 0.631 . . . . 0.0 109.607 179.556 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 156' ' ' HIS . . . . . . . . . . . . . 86.2 t60 -70.06 154.18 42.26 Favored 'General case' 0 N--CA 1.456 -0.169 0 N-CA-C 110.167 -0.309 . . . . 0.0 110.167 178.428 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 157' ' ' HIS . . . . . . . . . . . . . 48.5 m170 -68.37 144.5 54.74 Favored 'General case' 0 N--CA 1.456 -0.153 0 CA-C-O 120.921 0.391 . . . . 0.0 110.986 -177.341 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 158' ' ' HIS . . . . . . . . . . . . . 26.0 p80 -153.28 2.7 0.29 Allowed 'General case' 0 CA--C 1.529 0.167 0 C-N-CA 123.159 0.584 . . . . 0.0 111.464 179.157 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 159' ' ' HIS . . . . . . . . . . . . . 21.9 t-160 . . . . . 0 C--O 1.249 1.058 0 CA-C-O 116.808 -1.568 . . . . 0.0 108.852 -178.036 . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' B' B 2052 ' ' ASP . . . . . . . . . . . . . 36.4 p-10 . . . . . 0 N--CA 1.473 0.677 0 N-CA-C 109.476 -0.565 . . . . 0.0 109.476 . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' B' B 2053 ' ' ASP . . . . . . . . . . . . . 45.5 m-20 -124.22 156.74 36.29 Favored 'General case' 0 CA--C 1.53 0.202 0 C-N-CA 123.622 0.769 . . . . 0.0 111.056 -178.412 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B 2054 ' ' ASP . . . . . 0.447 ' CG ' ' H ' ' B' 2055 ' ' GLU . 53.8 t0 -157.65 -164.03 1.47 Allowed 'General case' 0 CA--C 1.536 0.429 0 C-N-CA 125.05 1.34 . . . . 0.0 107.539 178.632 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B 2055 ' ' GLU . . . . . 0.464 ' C ' ' H ' ' B' 2057 ' ' ASP . 92.2 mt-10 -67.81 63.28 0.08 Allowed 'General case' 0 CA--C 1.533 0.315 0 C-N-CA 123.767 0.827 . . . . 0.0 109.61 169.592 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B 2056 ' ' ASP . . . . . . . . . . . . . 12.4 m-20 -67.69 25.65 0.02 OUTLIER 'General case' 0 CA--C 1.532 0.283 0 C-N-CA 124.854 1.261 . . . . 0.0 112.881 -178.617 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B 2057 ' ' ASP . . . . . 0.464 ' H ' ' C ' ' B' 2055 ' ' GLU . 38.2 t0 -136.74 29.72 2.87 Favored 'General case' 0 CA--C 1.531 0.237 0 C-N-CA 123.534 0.733 . . . . 0.0 110.776 -176.609 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B 2058 ' ' TYR . . . . . . . . . . . . . 8.4 t80 -50.31 132.51 24.43 Favored 'General case' 0 N--CA 1.456 -0.141 0 N-CA-C 109.524 -0.547 . . . . 0.0 109.524 177.415 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B 2059 ' ' THR . . . . . . . . . . . . . 58.5 m -140.93 109.39 6.47 Favored Pre-proline 0 N--CA 1.454 -0.256 0 N-CA-C 109.163 -0.68 . . . . 0.0 109.163 -177.272 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B 2060 ' ' PRO . . . . . . . . . . . . . 93.0 Cg_endo -76.96 167.69 24.73 Favored 'Trans proline' 0 N--CA 1.451 -0.999 0 C-N-CA 123.563 2.842 . . . . 0.0 111.194 179.982 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B 2061 ' ' SER . . . . . . . . . . . . . 91.2 p -151.62 149.61 29.34 Favored 'General case' 0 N--CA 1.453 -0.309 0 N-CA-C 108.875 -0.787 . . . . 0.0 108.875 176.807 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B 2062 ' ' ILE . . . . . . . . . . . . . 19.3 tt -165.79 160.96 0.88 Allowed 'Isoleucine or valine' 0 N--CA 1.454 -0.226 0 N-CA-C 109.922 -0.399 . . . . 0.0 109.922 -175.87 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B 2063 ' ' SER . . . . . . . . . . . . . 87.9 p . . . . . 0 C--O 1.248 0.978 0 CA-C-O 116.892 -1.528 . . . . 0.0 109.95 175.317 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 30.6 p-10 . . . . . 0 N--CA 1.453 -0.289 0 N-CA-C 108.762 -0.829 . . . . 0.0 108.762 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 7' ' ' PHE . . . . . 0.515 ' CD1' ' HD3' ' A' ' 45' ' ' LYS . 1.2 t80 -53.0 -36.37 60.38 Favored 'General case' 0 N--CA 1.447 -0.594 0 C-N-CA 124.982 1.313 . . . . 0.0 110.833 -178.263 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 51.5 tp60 -51.89 -35.27 44.67 Favored 'General case' 0 N--CA 1.454 -0.246 0 C-N-CA 123.978 0.911 . . . . 0.0 112.063 -176.947 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 31.1 m-80 -73.74 -33.48 64.34 Favored 'General case' 0 N--CA 1.453 -0.308 0 N-CA-C 110.076 -0.342 . . . . 0.0 110.076 -179.106 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 10' ' ' PHE . . . . . 0.426 ' CZ ' HG12 ' A' ' 46' ' ' ILE . 2.2 t80 -72.24 -36.45 69.1 Favored 'General case' 0 N--CA 1.452 -0.362 0 N-CA-C 108.896 -0.779 . . . . 0.0 108.896 177.298 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 95.7 t -68.0 -54.64 20.96 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.251 0 N-CA-C 108.81 -0.811 . . . . 0.0 108.81 178.157 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -58.67 -28.87 66.14 Favored 'General case' 0 N--CA 1.452 -0.329 0 N-CA-C 112.196 0.443 . . . . 0.0 112.196 -178.961 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 96.1 m -72.29 -41.99 66.02 Favored 'General case' 0 CA--C 1.532 0.268 0 N-CA-C 109.445 -0.576 . . . . 0.0 109.445 176.188 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.487 ' HA ' ' CD1' ' A' ' 17' ' ' PHE . 12.6 tp -62.98 -44.82 94.99 Favored 'General case' 0 N--CA 1.452 -0.329 0 N-CA-C 109.811 -0.44 . . . . 0.0 109.811 178.035 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 76.0 mm-40 -62.37 -32.1 72.84 Favored 'General case' 0 N--CA 1.45 -0.431 0 C-N-CA 124.588 1.155 . . . . 0.0 109.969 178.446 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 70.2 m -67.03 -29.58 69.43 Favored 'General case' 0 N--CA 1.453 -0.276 0 N-CA-C 109.726 -0.472 . . . . 0.0 109.726 177.473 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 17' ' ' PHE . . . . . 0.487 ' CD1' ' HA ' ' A' ' 14' ' ' LEU . 14.0 m-85 -69.11 -42.31 76.25 Favored 'General case' 0 N--CA 1.457 -0.109 0 C-N-CA 120.126 -0.629 . . . . 0.0 110.492 172.31 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 71.3 mttt -61.16 -27.6 68.52 Favored 'General case' 0 C--N 1.339 0.146 0 CA-C-O 120.583 0.23 . . . . 0.0 110.654 -177.389 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 42.3 t0 -73.56 -23.69 60.0 Favored 'General case' 0 CA--C 1.531 0.23 0 CA-C-N 115.866 -0.606 . . . . 0.0 112.245 -178.722 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 20' ' ' LEU . . . . . 0.404 ' C ' ' HE3' ' A' ' 21' ' ' LYS . 94.8 mt -79.16 159.86 27.23 Favored 'General case' 0 CA--C 1.528 0.126 0 O-C-N 121.836 -0.54 . . . . 0.0 110.858 -178.789 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 21' ' ' LYS . . . . . 0.45 ' HE3' ' CA ' ' A' ' 21' ' ' LYS . 0.0 OUTLIER -84.47 -34.95 23.3 Favored 'General case' 0 C--N 1.34 0.163 0 N-CA-C 109.415 -0.587 . . . . 0.0 109.415 176.027 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 83.9 p -82.02 -22.17 36.62 Favored 'General case' 0 C--N 1.34 0.187 0 C-N-CA 122.788 0.435 . . . . 0.0 111.017 177.937 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 71.59 -8.54 5.54 Favored Glycine 0 CA--C 1.529 0.921 0 C-N-CA 123.804 0.716 . . . . 0.0 112.889 179.282 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 44.9 mt -93.22 148.42 4.78 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.177 0 CA-C-N 117.751 0.776 . . . . 0.0 110.36 176.641 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 8.6 t -162.22 83.03 0.56 Allowed 'General case' 0 C--N 1.339 0.131 0 N-CA-C 109.543 -0.54 . . . . 0.0 109.543 -179.004 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -50.79 -44.9 49.13 Favored Glycine 0 CA--C 1.524 0.645 0 CA-C-O 118.725 -1.041 . . . . 0.0 115.067 -169.466 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 31.7 t -71.35 -42.05 68.98 Favored 'General case' 0 N--CA 1.455 -0.211 0 CA-C-N 119.945 1.872 . . . . 0.0 110.529 -177.469 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 80.4 mtt85 -66.68 -39.87 88.33 Favored 'General case' 0 N--CA 1.455 -0.208 0 N-CA-C 110.203 -0.295 . . . . 0.0 110.203 179.496 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 40.8 mt -55.98 -47.13 80.54 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.505 0 N-CA-C 108.254 -1.017 . . . . 0.0 108.254 174.815 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 78.8 mttt -65.7 -24.86 67.09 Favored 'General case' 0 C--N 1.34 0.172 0 CA-C-O 118.474 -0.774 . . . . 0.0 112.584 177.055 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 31' ' ' LYS . . . . . 0.528 ' HA ' ' HE3' ' A' ' 31' ' ' LYS . 0.0 OUTLIER -67.7 -56.1 10.61 Favored 'General case' 0 C--N 1.343 0.298 0 CA-C-N 119.704 1.138 . . . . 0.0 110.015 -179.915 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.454 HD12 ' N ' ' A' ' 33' ' ' THR . 2.4 pp -74.69 -19.18 60.36 Favored 'General case' 0 N--CA 1.455 -0.208 0 C-N-CA 119.201 -0.999 . . . . 0.0 111.101 -178.233 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 33' ' ' THR . . . . . 0.454 ' N ' HD12 ' A' ' 32' ' ' LEU . 46.2 m -72.74 -37.38 67.74 Favored 'General case' 0 N--CA 1.456 -0.163 0 N-CA-C 109.239 -0.652 . . . . 0.0 109.239 176.404 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 96.0 m -74.69 -37.8 62.55 Favored 'General case' 0 N--CA 1.452 -0.344 0 CA-C-N 116.784 -0.189 . . . . 0.0 110.53 -178.398 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 57.7 t80 -69.93 -30.93 68.44 Favored 'General case' 0 N--CA 1.456 -0.162 0 C-N-CA 120.458 -0.497 . . . . 0.0 109.886 177.927 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -69.67 -33.26 72.32 Favored 'General case' 0 N--CA 1.45 -0.434 0 N-CA-C 110.097 -0.334 . . . . 0.0 110.097 176.293 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 20.6 mt -73.55 -40.77 63.7 Favored 'General case' 0 CA--C 1.52 -0.19 0 C-N-CA 122.743 0.417 . . . . 0.0 110.657 177.685 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 42.4 t0 -63.08 -24.54 67.95 Favored 'General case' 0 N--CA 1.455 -0.202 0 C-N-CA 122.814 0.446 . . . . 0.0 110.64 176.825 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 39' ' ' HIS . . . . . 0.408 ' HB2' HD11 ' A' ' 42' ' ' ILE . 94.8 m-70 -149.75 95.63 2.35 Favored 'General case' 0 N--CA 1.454 -0.239 0 C-N-CA 122.896 0.479 . . . . 0.0 111.622 -177.52 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 40' ' ' ILE . . . . . 0.63 ' H ' HD13 ' A' ' 40' ' ' ILE . 0.0 OUTLIER -72.21 -13.44 16.62 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.345 0 N-CA-C 109.958 -0.386 . . . . 0.0 109.958 174.25 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 18.6 m-20 -58.45 -19.94 40.93 Favored 'General case' 0 CA--C 1.529 0.172 0 C-N-CA 123.24 0.616 . . . . 0.0 112.409 -176.316 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 42' ' ' ILE . . . . . 0.408 HD11 ' HB2' ' A' ' 39' ' ' HIS . 0.0 OUTLIER -107.57 15.07 7.8 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.186 0 N-CA-C 112.109 0.411 . . . . 0.0 112.109 176.78 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 3.0 pp20? -51.46 -33.38 30.79 Favored 'General case' 0 C--O 1.224 -0.241 0 CA-C-N 118.864 0.757 . . . . 0.0 110.69 178.479 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 29.8 t -58.11 -50.28 74.02 Favored 'General case' 0 CA--C 1.534 0.357 0 O-C-N 122.366 -0.209 . . . . 0.0 111.257 -177.245 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 45' ' ' LYS . . . . . 0.515 ' HD3' ' CD1' ' A' ' 7' ' ' PHE . 18.6 ptpt -73.81 -27.87 61.34 Favored 'General case' 0 C--N 1.34 0.161 0 O-C-N 122.034 -0.416 . . . . 0.0 110.658 -179.906 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 46' ' ' ILE . . . . . 0.426 HG12 ' CZ ' ' A' ' 10' ' ' PHE . 86.5 mt -69.55 -48.13 67.82 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.377 0 C-N-CA 122.48 0.312 . . . . 0.0 110.181 -178.85 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 40.6 mm -64.14 -34.69 70.41 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.385 0 N-CA-C 108.95 -0.759 . . . . 0.0 108.95 179.18 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 28.4 t -63.73 -36.65 84.56 Favored 'General case' 0 N--CA 1.451 -0.401 0 C-N-CA 120.397 -0.521 . . . . 0.0 111.085 177.98 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 16.0 mt -73.4 -36.1 65.98 Favored 'General case' 0 N--CA 1.451 -0.387 0 N-CA-C 113.11 0.781 . . . . 0.0 113.11 -179.416 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 50' ' ' ILE . . . . . 0.432 HD12 HG12 ' A' ' 69' ' ' ILE . 7.7 pt -71.0 -41.25 76.87 Favored 'Isoleucine or valine' 0 C--O 1.226 -0.152 0 CA-C-N 119.311 0.96 . . . . 0.0 110.68 -178.244 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 20.0 pt -68.71 -38.67 79.21 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.191 0 C-N-CA 120.155 -0.618 . . . . 0.0 110.374 179.403 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 92.0 m-20 -72.26 -39.14 68.63 Favored 'General case' 0 N--CA 1.454 -0.245 0 O-C-N 121.944 -0.472 . . . . 0.0 111.586 178.893 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 29.0 t80 -65.32 -51.18 62.34 Favored 'General case' 0 N--CA 1.454 -0.253 0 N-CA-C 108.844 -0.798 . . . . 0.0 108.844 176.533 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 24.0 t -62.29 -31.92 72.57 Favored 'General case' 0 N--CA 1.455 -0.214 0 C-N-CA 122.427 0.291 . . . . 0.0 111.731 -173.988 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 74.3 mtm180 -79.93 -43.56 21.92 Favored 'General case' 0 N--CA 1.453 -0.297 0 O-C-N 121.92 -0.488 . . . . 0.0 112.197 -178.703 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 56.4 mt -81.93 -42.77 19.01 Favored 'General case' 0 N--CA 1.461 0.08 0 N-CA-C 113.163 0.801 . . . . 0.0 113.163 -175.159 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 57' ' ' CYS . . . . . 0.459 ' O ' ' HE2' ' A' ' 62' ' ' LYS . 14.0 p -60.48 159.19 25.32 Favored Pre-proline 0 CA--C 1.534 0.358 0 N-CA-C 114.064 1.135 . . . . 0.0 114.064 -172.529 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 31.3 Cg_exo -59.7 172.77 1.94 Allowed 'Trans proline' 0 N--CA 1.456 -0.709 1 C-N-CA 125.56 4.174 . . . . 0.0 113.198 175.751 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 27.6 p-10 -60.85 -42.37 97.67 Favored 'General case' 0 C--N 1.329 -0.305 0 C-N-CA 124.068 0.947 . . . . 0.0 112.535 -173.039 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 95.1 p -70.06 -36.44 74.99 Favored 'General case' 0 N--CA 1.455 -0.22 0 N-CA-C 109.541 -0.54 . . . . 0.0 109.541 179.345 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 71.4 m80 -69.98 -28.03 65.2 Favored 'General case' 0 N--CA 1.451 -0.413 0 N-CA-C 110.114 -0.328 . . . . 0.0 110.114 177.707 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 62' ' ' LYS . . . . . 0.459 ' HE2' ' O ' ' A' ' 57' ' ' CYS . 64.6 mttm -64.39 -41.51 96.62 Favored 'General case' 0 C--N 1.339 0.142 0 N-CA-C 109.151 -0.685 . . . . 0.0 109.151 173.069 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -59.68 -45.41 92.15 Favored 'General case' 0 CA--C 1.533 0.319 0 N-CA-C 108.693 -0.854 . . . . 0.0 108.693 176.423 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -69.09 -28.29 73.03 Favored Glycine 0 C--N 1.337 0.635 0 N-CA-C 111.755 -0.538 . . . . 0.0 111.755 -179.425 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 38.0 p -67.15 -36.27 81.46 Favored 'General case' 0 N--CA 1.453 -0.324 0 CA-C-N 117.837 0.819 . . . . 0.0 109.151 177.672 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 81.6 mt -75.42 -26.54 58.43 Favored 'General case' 0 N--CA 1.45 -0.464 0 CA-C-O 119.398 -0.334 . . . . 0.0 110.756 -179.242 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 6.9 m-30 -67.39 -39.14 85.59 Favored 'General case' 0 C--O 1.233 0.189 0 CA-C-N 118.055 0.389 . . . . 0.0 110.686 172.098 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 68' ' ' ILE . . . . . 0.434 HD11 ' CE1' ' A' ' 17' ' ' PHE . 19.7 mt -68.32 -50.85 53.51 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.643 0 N-CA-C 108.761 -0.829 . . . . 0.0 108.761 179.474 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 69' ' ' ILE . . . . . 0.432 HG12 HD12 ' A' ' 50' ' ' ILE . 88.5 mt -56.93 -34.87 45.37 Favored 'Isoleucine or valine' 0 C--N 1.34 0.156 0 C-N-CA 124.103 0.961 . . . . 0.0 111.328 178.223 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 11.9 t70 -69.44 -41.5 76.21 Favored 'General case' 0 N--CA 1.451 -0.407 0 CA-C-N 118.146 0.43 . . . . 0.0 110.588 177.377 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 19.4 m -71.65 -52.88 15.67 Favored 'General case' 0 N--CA 1.452 -0.356 0 CA-C-N 116.603 -0.271 . . . . 0.0 110.423 -175.893 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -75.17 -31.61 24.87 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.244 0 N-CA-C 110.165 -0.309 . . . . 0.0 110.165 -178.136 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -68.74 -56.01 10.34 Favored Glycine 0 C--N 1.336 0.565 0 N-CA-C 110.811 -0.916 . . . . 0.0 110.811 -176.379 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 39.6 mtm105 -65.62 -42.87 91.06 Favored 'General case' 0 N--CA 1.449 -0.511 0 C-N-CA 120.345 -0.542 . . . . 0.0 110.154 -179.475 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -64.17 -28.8 70.0 Favored 'General case' 0 N--CA 1.449 -0.484 0 C-N-CA 119.969 -0.692 . . . . 0.0 110.614 -177.139 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 2.0 m-30 -68.89 -47.31 66.18 Favored 'General case' 0 CA--C 1.518 -0.253 0 CA-C-N 118.738 0.699 . . . . 0.0 110.523 175.527 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 7.3 tt -67.29 -44.61 78.86 Favored 'General case' 0 N--CA 1.449 -0.491 0 C-N-CA 118.041 -1.464 . . . . 0.0 108.726 -179.336 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 72.3 m-20 -57.86 -48.51 79.59 Favored 'General case' 0 CA--C 1.53 0.177 0 N-CA-C 112.353 0.501 . . . . 0.0 112.353 178.922 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 15.4 tm-20 -62.98 -47.02 84.96 Favored 'General case' 0 N--CA 1.452 -0.353 0 CA-C-N 118.343 0.52 . . . . 0.0 110.886 -178.368 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 80' ' ' THR . . . . . 0.493 HG21 ' HB3' ' A' ' 94' ' ' CYS . 69.7 p -67.72 -32.78 73.65 Favored 'General case' 0 N--CA 1.454 -0.23 0 N-CA-C 110.152 -0.314 . . . . 0.0 110.152 179.523 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 33.9 ttp180 -66.56 -24.0 66.29 Favored 'General case' 0 N--CA 1.45 -0.447 0 C-N-CA 123.434 0.694 . . . . 0.0 110.939 174.891 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 35.1 t . . . . . 0 CA--C 1.53 0.179 0 C-N-CA 123.63 0.772 . . . . 0.0 113.015 179.089 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 73.1 Cg_endo . . . . . 0 N--CA 1.449 -1.143 0 N-CA-C 107.716 -1.686 . . . . 0.0 107.716 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 90.46 21.39 37.82 Favored Glycine 0 CA--C 1.523 0.563 0 CA-C-O 119.57 -0.572 . . . . 0.0 111.795 -179.091 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 41.5 p -151.62 173.84 14.18 Favored 'General case' 0 N--CA 1.454 -0.259 0 C-N-CA 123.884 0.873 . . . . 0.0 110.112 176.632 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 94' ' ' CYS . . . . . 0.493 ' HB3' HG21 ' A' ' 80' ' ' THR . 17.4 p -62.81 -21.65 66.06 Favored 'General case' 0 N--CA 1.448 -0.559 0 CA-C-N 115.741 -0.663 . . . . 0.0 109.526 175.737 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -59.92 -58.59 7.87 Favored 'General case' 0 N--CA 1.447 -0.596 0 N-CA-C 109.373 -0.603 . . . . 0.0 109.373 -176.916 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 75.0 t60 -74.58 -28.05 60.75 Favored 'General case' 0 N--CA 1.45 -0.451 0 N-CA-C 111.583 0.216 . . . . 0.0 111.583 -179.405 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -68.45 -52.52 31.63 Favored 'General case' 0 N--CA 1.452 -0.339 0 CA-C-N 116.662 -0.245 . . . . 0.0 110.785 -178.154 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 98' ' ' ILE . . . . . 0.454 HD13 ' HB2' ' A' ' 94' ' ' CYS . 2.3 mp -69.49 -27.64 34.89 Favored 'Isoleucine or valine' 0 C--N 1.339 0.141 0 C-N-CA 120.266 -0.573 . . . . 0.0 109.889 177.749 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 53.1 t-20 -65.99 -42.81 89.32 Favored 'General case' 0 N--CA 1.452 -0.347 0 CA-C-N 118.03 0.377 . . . . 0.0 110.822 176.554 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 86.5 m -66.53 -43.72 84.42 Favored 'General case' 0 CA--C 1.518 -0.272 0 N-CA-C 110.16 -0.311 . . . . 0.0 110.16 -176.818 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 90.6 mt -69.24 -30.6 68.77 Favored 'General case' 0 N--CA 1.45 -0.431 0 C-N-CA 120.903 -0.319 . . . . 0.0 110.408 179.293 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -61.46 -14.82 43.59 Favored Glycine 0 CA--C 1.528 0.852 0 CA-C-O 119.132 -0.816 . . . . 0.0 112.749 -177.31 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 22.8 mt-10 -107.65 -12.78 15.18 Favored 'General case' 0 C--N 1.339 0.145 0 CA-C-N 118.359 1.079 . . . . 0.0 112.701 -177.981 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 13.2 m -130.03 -4.0 2.72 Favored 'Isoleucine or valine' 0 N--CA 1.461 0.118 0 N-CA-C 113.203 0.816 . . . . 0.0 113.203 -175.311 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 105' ' ' ILE . . . . . . . . . . . . . 10.5 tp -59.14 -23.44 24.59 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.173 0 CA-C-N 119.159 0.89 . . . . 0.0 109.991 178.828 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 25.4 pt20 -65.96 -30.74 71.36 Favored 'General case' 0 N--CA 1.453 -0.3 0 C-N-CA 123.059 0.543 . . . . 0.0 110.27 177.088 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 69.7 mt-10 -75.03 -44.65 46.69 Favored 'General case' 0 N--CA 1.451 -0.403 0 N-CA-C 109.638 -0.505 . . . . 0.0 109.638 -179.563 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 8.3 mp -66.36 -49.53 66.58 Favored 'General case' 0 N--CA 1.452 -0.353 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.624 -176.438 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 8.8 mp -70.13 -54.23 13.85 Favored 'General case' 0 N--CA 1.45 -0.459 0 CA-C-O 119.22 -0.419 . . . . 0.0 110.595 -176.741 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 32.3 t -55.9 -41.84 75.1 Favored 'General case' 0 N--CA 1.455 -0.192 0 CA-C-N 118.461 0.573 . . . . 0.0 111.464 -175.626 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 45.8 t0 -68.58 -41.02 80.27 Favored 'General case' 0 N--CA 1.451 -0.396 0 N-CA-C 109.495 -0.557 . . . . 0.0 109.495 178.013 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -65.33 -35.02 79.71 Favored 'General case' 0 N--CA 1.446 -0.634 0 CA-C-O 119.345 -0.36 . . . . 0.0 110.849 -177.298 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 113' ' ' ILE . . . . . 0.451 ' O ' ' HE3' ' A' ' 121' ' ' LYS . 21.1 mm -68.4 -43.13 84.34 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.32 0 CA-C-N 118.714 0.688 . . . . 0.0 109.17 177.81 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -69.07 -32.76 72.45 Favored 'General case' 0 N--CA 1.451 -0.388 0 N-CA-C 112.178 0.436 . . . . 0.0 112.178 -179.845 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 115' ' ' LYS . . . . . 0.495 ' N ' ' HZ2' ' A' ' 115' ' ' LYS . 0.0 OUTLIER -85.12 -39.6 17.72 Favored 'General case' 0 C--N 1.34 0.153 0 N-CA-C 112.619 0.6 . . . . 0.0 112.619 -178.258 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 116' ' ' SER . . . . . 0.452 ' HB2' ' CB ' ' A' ' 120' ' ' HIS . 49.5 p -85.31 157.16 20.63 Favored 'General case' 0 N--CA 1.455 -0.221 0 N-CA-C 112.257 0.466 . . . . 0.0 112.257 -171.556 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 50.8 t30 -79.97 170.69 16.11 Favored 'General case' 0 N--CA 1.454 -0.237 0 C-N-CA 123.243 0.617 . . . . 0.0 111.102 -178.226 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 118' ' ' GLN . . . . . . . . . . . . . 16.0 mm100 -56.92 -35.98 69.66 Favored 'General case' 0 CA--C 1.527 0.064 0 C-N-CA 123.199 0.6 . . . . 0.0 112.542 -173.634 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 10.0 p-10 -68.93 -40.1 79.22 Favored 'General case' 0 N--CA 1.454 -0.242 0 N-CA-C 109.358 -0.608 . . . . 0.0 109.358 178.299 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 120' ' ' HIS . . . . . 0.452 ' CB ' ' HB2' ' A' ' 116' ' ' SER . 27.8 m170 -66.47 -39.38 88.76 Favored 'General case' 0 N--CA 1.452 -0.352 0 CA-C-N 116.376 -0.375 . . . . 0.0 110.091 176.819 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 121' ' ' LYS . . . . . 0.451 ' HE3' ' O ' ' A' ' 113' ' ' ILE . 64.6 mttp -57.88 -36.18 72.03 Favored 'General case' 0 C--N 1.34 0.158 0 N-CA-C 109.537 -0.542 . . . . 0.0 109.537 176.795 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 40.3 tp10 -72.63 -36.56 68.05 Favored 'General case' 0 N--CA 1.452 -0.349 0 CA-C-O 119.746 -0.168 . . . . 0.0 111.448 -179.902 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 35.6 mmtp -63.43 -39.42 94.43 Favored 'General case' 0 N--CA 1.457 -0.103 0 N-CA-C 109.23 -0.656 . . . . 0.0 109.23 177.738 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 124' ' ' ILE . . . . . . . . . . . . . 65.7 mt -66.9 -34.93 73.18 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.37 0 N-CA-C 108.62 -0.881 . . . . 0.0 108.62 178.211 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 125' ' ' ARG . . . . . 0.462 ' HD2' ' HA ' ' A' ' 125' ' ' ARG . 20.5 tpt85 -68.18 -41.76 80.95 Favored 'General case' 0 N--CA 1.441 -0.877 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.988 -174.993 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 126' ' ' MET . . . . . . . . . . . . . 26.8 ptm -66.7 -32.4 73.68 Favored 'General case' 0 N--CA 1.453 -0.291 0 N-CA-C 108.811 -0.811 . . . . 0.0 108.811 174.809 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 4.7 mp -63.13 -33.83 76.32 Favored 'General case' 0 CA--C 1.531 0.239 0 CA-C-O 118.75 -0.643 . . . . 0.0 110.683 174.852 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 39.5 mt -68.77 -40.94 79.44 Favored 'General case' 0 C--N 1.34 0.162 0 CA-C-N 119.507 1.048 . . . . 0.0 110.148 179.007 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 51.9 m-20 -63.7 -39.2 93.73 Favored 'General case' 0 CA--C 1.522 -0.116 0 C-N-CA 120.353 -0.539 . . . . 0.0 109.911 176.322 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 58.3 mt -64.24 -33.31 61.72 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.256 0 C-N-CA 123.029 0.531 . . . . 0.0 109.959 178.178 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 131' ' ' TRP . . . . . . . . . . . . . 45.9 m0 . . . . . 0 N--CA 1.455 -0.188 0 N-CA-C 112.055 0.391 . . . . 0.0 112.055 176.379 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 16.0 p-10 . . . . . 0 N--CA 1.456 -0.141 0 N-CA-C 106.692 -1.596 . . . . 0.0 106.692 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 7' ' ' PHE . . . . . 0.503 ' CD1' ' HD3' ' A' ' 45' ' ' LYS . 1.1 t80 -63.01 -32.45 73.82 Favored 'General case' 0 N--CA 1.444 -0.764 0 C-N-CA 125.063 1.345 . . . . 0.0 110.141 -179.662 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 58.2 tp60 -48.38 -39.49 22.52 Favored 'General case' 0 N--CA 1.454 -0.229 0 C-N-CA 124.322 1.049 . . . . 0.0 111.765 -177.948 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 16.2 m-80 -71.75 -35.17 70.02 Favored 'General case' 0 N--CA 1.455 -0.177 0 N-CA-C 110.145 -0.317 . . . . 0.0 110.145 -178.261 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 1.7 t80 -72.29 -38.97 68.64 Favored 'General case' 0 N--CA 1.449 -0.483 0 C-N-CA 123.731 0.812 . . . . 0.0 109.514 178.148 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 93.0 t -66.24 -52.1 51.52 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.271 0 N-CA-C 108.608 -0.886 . . . . 0.0 108.608 178.601 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -60.36 -29.27 68.8 Favored 'General case' 0 N--CA 1.452 -0.367 0 C-N-CA 122.665 0.386 . . . . 0.0 111.848 179.902 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 59.8 m -73.96 -36.62 64.61 Favored 'General case' 0 CA--C 1.53 0.207 0 N-CA-C 109.055 -0.72 . . . . 0.0 109.055 176.484 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.529 ' HA ' ' CD1' ' A' ' 17' ' ' PHE . 4.8 tp -66.57 -46.53 75.71 Favored 'General case' 0 N--CA 1.453 -0.287 0 CA-C-O 121.284 0.564 . . . . 0.0 109.776 177.899 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 67.8 mm-40 -62.01 -28.09 69.33 Favored 'General case' 0 N--CA 1.447 -0.579 0 C-N-CA 124.167 0.987 . . . . 0.0 109.189 178.485 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 48.2 t -70.99 -28.5 64.48 Favored 'General case' 0 N--CA 1.449 -0.517 0 CA-C-N 116.109 -0.496 . . . . 0.0 109.856 177.31 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 17' ' ' PHE . . . . . 0.529 ' CD1' ' HA ' ' A' ' 14' ' ' LEU . 19.4 m-85 -72.42 -35.55 68.39 Favored 'General case' 0 N--CA 1.455 -0.19 0 CA-C-N 118.584 0.629 . . . . 0.0 110.951 171.161 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 18' ' ' LYS . . . . . 0.464 ' HA ' ' CE1' ' A' ' 61' ' ' HIS . 84.7 mttt -62.93 -26.47 68.83 Favored 'General case' 0 C--N 1.339 0.132 0 N-CA-C 109.643 -0.503 . . . . 0.0 109.643 177.521 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 43.6 t0 -76.71 -15.28 59.82 Favored 'General case' 0 CA--C 1.537 0.478 0 CA-C-N 115.17 -0.923 . . . . 0.0 111.837 176.348 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 87.8 mt -86.06 144.68 27.43 Favored 'General case' 0 N--CA 1.45 -0.432 0 O-C-N 121.243 -0.91 . . . . 0.0 111.276 -179.143 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 21' ' ' LYS . . . . . 0.582 ' HE2' ' H ' ' A' ' 21' ' ' LYS . 1.6 mppt? -83.51 15.04 3.29 Favored 'General case' 0 CA--C 1.531 0.219 0 CA-C-N 115.116 -0.947 . . . . 0.0 108.849 177.316 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 86.0 p -141.73 -26.05 0.68 Allowed 'General case' 0 N--CA 1.454 -0.263 0 C-N-CA 124.735 1.214 . . . . 0.0 111.796 -175.416 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 75.83 -15.46 4.98 Favored Glycine 0 CA--C 1.526 0.731 0 C-N-CA 123.804 0.716 . . . . 0.0 113.141 175.965 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 81.5 mt -97.07 147.07 6.63 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.383 0 C-N-CA 123.395 0.678 . . . . 0.0 109.904 176.948 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 41.4 t -166.03 99.1 0.64 Allowed 'General case' 0 N--CA 1.455 -0.213 0 N-CA-C 109.055 -0.721 . . . . 0.0 109.055 171.296 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -55.2 -48.71 66.93 Favored Glycine 0 CA--C 1.523 0.544 0 CA-C-O 119.428 -0.651 . . . . 0.0 112.591 -172.65 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 27' ' ' SER . . . . . 0.434 ' HA ' ' HE3' ' A' ' 30' ' ' LYS . 16.5 m -63.05 -43.17 99.37 Favored 'General case' 0 N--CA 1.454 -0.251 0 CA-C-N 118.546 1.173 . . . . 0.0 111.08 -177.346 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 81.2 mtt180 -69.55 -42.31 74.77 Favored 'General case' 0 N--CA 1.457 -0.11 0 C-N-CA 122.509 0.324 . . . . 0.0 110.507 -179.888 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 62.6 mt -58.11 -41.78 81.47 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.616 0 N-CA-C 108.467 -0.938 . . . . 0.0 108.467 175.29 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 30' ' ' LYS . . . . . 0.434 ' HE3' ' HA ' ' A' ' 27' ' ' SER . 46.9 mtmt -69.37 -22.11 63.75 Favored 'General case' 0 N--CA 1.456 -0.171 0 CA-C-O 118.427 -0.797 . . . . 0.0 111.979 177.853 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 31' ' ' LYS . . . . . 0.574 ' HE2' ' HA ' ' A' ' 31' ' ' LYS . 8.3 mmpt? -67.1 -56.6 9.34 Favored 'General case' 0 C--N 1.34 0.172 0 CA-C-N 119.621 1.1 . . . . 0.0 109.295 175.352 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 4.6 pp -70.88 -25.73 62.92 Favored 'General case' 0 CA--C 1.528 0.107 0 C-N-CA 120.121 -0.632 . . . . 0.0 110.914 -177.603 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 60.4 m -71.72 -35.61 70.24 Favored 'General case' 0 N--CA 1.457 -0.103 0 N-CA-C 109.94 -0.392 . . . . 0.0 109.94 178.855 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 76.2 m -73.41 -37.33 65.97 Favored 'General case' 0 N--CA 1.454 -0.236 0 N-CA-C 110.414 -0.217 . . . . 0.0 110.414 -178.251 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 42.8 t80 -68.43 -33.22 73.81 Favored 'General case' 0 N--CA 1.457 -0.089 0 C-N-CA 119.852 -0.739 . . . . 0.0 110.087 176.619 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -69.4 -33.6 73.25 Favored 'General case' 0 N--CA 1.448 -0.567 0 CA-C-O 119.775 -0.155 . . . . 0.0 110.617 177.951 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 16.7 mt -73.14 -39.48 65.66 Favored 'General case' 0 N--CA 1.455 -0.209 0 C-N-CA 122.513 0.325 . . . . 0.0 110.684 177.919 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 44.3 t0 -63.61 -26.24 68.59 Favored 'General case' 0 N--CA 1.452 -0.356 0 C-N-CA 122.267 0.227 . . . . 0.0 110.78 176.39 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 39' ' ' HIS . . . . . 0.424 ' HB2' HD11 ' A' ' 42' ' ' ILE . 97.1 m-70 -149.38 99.84 2.95 Favored 'General case' 0 N--CA 1.454 -0.261 0 C-N-CA 122.658 0.383 . . . . 0.0 111.476 -177.028 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 40' ' ' ILE . . . . . 0.6 ' H ' HD13 ' A' ' 40' ' ' ILE . 0.0 OUTLIER -75.39 -19.26 15.97 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.485 0 CA-C-O 118.844 -0.598 . . . . 0.0 110.79 178.0 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 71.1 m-20 -62.21 -9.16 6.97 Favored 'General case' 0 CA--C 1.531 0.212 0 N-CA-C 113.455 0.909 . . . . 0.0 113.455 -175.567 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 42' ' ' ILE . . . . . 0.424 HD11 ' HB2' ' A' ' 39' ' ' HIS . 0.0 OUTLIER -110.4 13.9 8.52 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.168 0 CA-C-N 118.187 0.449 . . . . 0.0 111.655 173.447 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 3.1 pp20? -52.89 -33.4 49.95 Favored 'General case' 0 CA--C 1.529 0.143 0 O-C-N 121.507 -0.746 . . . . 0.0 111.306 177.61 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 3.3 m -64.9 -40.69 95.47 Favored 'General case' 0 CA--C 1.533 0.304 0 CA-C-O 119.053 -0.499 . . . . 0.0 111.911 -176.369 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 45' ' ' LYS . . . . . 0.503 ' HD3' ' CD1' ' A' ' 7' ' ' PHE . 15.3 ptpt -73.17 -27.06 61.43 Favored 'General case' 0 C--N 1.341 0.236 0 CA-C-N 119.346 0.975 . . . . 0.0 109.51 176.803 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 78.7 mt -72.34 -47.15 54.03 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.396 0 C-N-CA 122.715 0.406 . . . . 0.0 110.036 -177.427 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 42.2 mm -65.24 -38.16 81.93 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.203 0 N-CA-C 109.658 -0.497 . . . . 0.0 109.658 179.41 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 37.6 t -65.7 -32.49 74.07 Favored 'General case' 0 N--CA 1.455 -0.192 0 C-N-CA 120.38 -0.528 . . . . 0.0 110.478 177.513 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 49' ' ' LEU . . . . . 0.497 HD22 ' CE1' ' A' ' 7' ' ' PHE . 29.4 tp -75.87 -32.71 59.84 Favored 'General case' 0 N--CA 1.452 -0.364 0 N-CA-C 112.691 0.626 . . . . 0.0 112.691 -177.061 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 50' ' ' ILE . . . . . 0.405 HD12 HG12 ' A' ' 69' ' ' ILE . 11.6 pt -73.97 -38.5 49.74 Favored 'Isoleucine or valine' 0 C--N 1.338 0.098 0 CA-C-N 118.995 0.816 . . . . 0.0 110.956 177.819 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 46.9 pt -66.31 -37.06 78.86 Favored 'Isoleucine or valine' 0 C--O 1.227 -0.084 0 C-N-CA 119.484 -0.886 . . . . 0.0 109.991 178.351 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 95.1 m-20 -67.39 -36.91 82.27 Favored 'General case' 0 N--CA 1.454 -0.263 0 CA-C-N 117.559 0.163 . . . . 0.0 111.113 176.415 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 53' ' ' TYR . . . . . 0.411 ' CE1' ' HB3' ' A' ' 61' ' ' HIS . 18.5 t80 -67.67 -36.55 80.91 Favored 'General case' 0 C--O 1.226 -0.154 0 N-CA-C 109.908 -0.404 . . . . 0.0 109.908 176.172 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 15.2 m -75.59 -22.3 57.06 Favored 'General case' 0 N--CA 1.452 -0.352 0 C-N-CA 122.503 0.321 . . . . 0.0 111.532 -178.464 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 28.9 ttp-105 -86.69 -47.01 9.51 Favored 'General case' 0 N--CA 1.455 -0.199 0 N-CA-C 112.666 0.617 . . . . 0.0 112.666 -177.354 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 46.7 mt -84.95 -47.19 10.52 Favored 'General case' 0 N--CA 1.455 -0.196 0 N-CA-C 112.728 0.64 . . . . 0.0 112.728 -174.242 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 57' ' ' CYS . . . . . 0.542 ' HB3' ' HD2' ' A' ' 58' ' ' PRO . 59.5 m -74.62 160.01 81.99 Favored Pre-proline 0 CA--C 1.534 0.338 0 C-N-CA 122.97 0.508 . . . . 0.0 112.176 -173.573 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 58' ' ' PRO . . . . . 0.542 ' HD2' ' HB3' ' A' ' 57' ' ' CYS . 68.0 Cg_endo -79.01 -176.17 3.14 Favored 'Trans proline' 0 N--CA 1.455 -0.775 0 C-N-CA 125.174 3.916 . . . . 0.0 112.252 -170.073 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 59' ' ' ASP . . . . . 0.458 ' HB2' ' HA ' ' A' ' 116' ' ' SER . 26.0 p-10 -51.15 -50.13 59.5 Favored 'General case' 0 N--CA 1.457 -0.083 0 C-N-CA 124.605 1.162 . . . . 0.0 113.439 -172.837 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 24.5 m -66.18 -33.75 76.48 Favored 'General case' 0 N--CA 1.453 -0.309 0 N-CA-C 109.881 -0.415 . . . . 0.0 109.881 -175.405 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 61' ' ' HIS . . . . . 0.464 ' CE1' ' HA ' ' A' ' 18' ' ' LYS . 33.6 m170 -75.92 -27.44 57.64 Favored 'General case' 0 N--CA 1.451 -0.42 0 N-CA-C 110.051 -0.351 . . . . 0.0 110.051 179.283 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 62' ' ' LYS . . . . . 0.408 ' HB3' ' HE3' ' A' ' 62' ' ' LYS . 29.4 mtpp -73.58 -34.83 65.29 Favored 'General case' 0 C--N 1.339 0.115 0 N-CA-C 110.008 -0.367 . . . . 0.0 110.008 174.48 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -62.85 -43.77 97.91 Favored 'General case' 0 CA--C 1.535 0.402 0 N-CA-C 107.733 -1.21 . . . . 0.0 107.733 175.894 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -70.01 -24.74 76.31 Favored Glycine 0 C--N 1.34 0.751 0 CA-C-N 116.032 -0.531 . . . . 0.0 111.78 179.071 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 42.9 t -69.29 -37.44 77.83 Favored 'General case' 0 N--CA 1.452 -0.348 0 CA-C-N 117.972 0.886 . . . . 0.0 109.707 175.546 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 77.0 mt -72.96 -25.05 60.88 Favored 'General case' 0 N--CA 1.451 -0.412 0 CA-C-O 119.41 -0.329 . . . . 0.0 110.341 178.789 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 3.1 m-30 -70.23 -37.43 74.98 Favored 'General case' 0 CA--C 1.52 -0.204 0 CA-C-N 118.078 0.399 . . . . 0.0 110.5 171.016 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 68' ' ' ILE . . . . . 0.501 HD11 ' CE1' ' A' ' 17' ' ' PHE . 32.2 mt -67.4 -52.94 36.73 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.6 0 N-CA-C 108.389 -0.967 . . . . 0.0 108.389 178.189 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 69' ' ' ILE . . . . . 0.405 HG12 HD12 ' A' ' 50' ' ' ILE . 71.6 mt -52.86 -35.42 21.78 Favored 'Isoleucine or valine' 0 C--N 1.339 0.145 0 C-N-CA 123.6 0.76 . . . . 0.0 111.6 175.88 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 18.4 t70 -69.61 -41.2 76.0 Favored 'General case' 0 C--N 1.333 -0.113 0 CA-C-N 118.538 0.608 . . . . 0.0 110.73 177.907 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 20.2 m -70.66 -56.5 6.29 Favored 'General case' 0 N--CA 1.45 -0.439 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.251 -176.509 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 72' ' ' ILE . . . . . 0.462 HD11 ' CZ ' ' A' ' 76' ' ' TYR . 0.0 OUTLIER -75.01 -29.89 22.73 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.247 0 N-CA-C 110.077 -0.342 . . . . 0.0 110.077 -176.85 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -69.72 -56.72 7.97 Favored Glycine 0 C--N 1.336 0.562 0 N-CA-C 111.533 -0.627 . . . . 0.0 111.533 -176.421 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 39.7 mtm105 -68.94 -38.46 79.5 Favored 'General case' 0 N--CA 1.453 -0.288 0 CA-C-N 117.48 0.64 . . . . 0.0 110.309 -179.395 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -64.36 -29.47 70.54 Favored 'General case' 0 N--CA 1.45 -0.449 0 C-N-CA 119.6 -0.84 . . . . 0.0 110.468 -179.219 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 76' ' ' TYR . . . . . 0.462 ' CZ ' HD11 ' A' ' 72' ' ' ILE . 2.1 m-30 -71.78 -46.36 58.57 Favored 'General case' 0 N--CA 1.455 -0.203 0 CA-C-N 118.427 0.558 . . . . 0.0 110.847 176.65 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -65.07 -41.21 95.3 Favored 'General case' 0 N--CA 1.45 -0.432 0 C-N-CA 118.427 -1.309 . . . . 0.0 107.896 -178.357 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 94.3 m-20 -65.55 -42.54 91.76 Favored 'General case' 0 C--O 1.23 0.064 0 N-CA-C 113.377 0.88 . . . . 0.0 113.377 178.161 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 15.5 tm-20 -64.29 -41.86 96.68 Favored 'General case' 0 N--CA 1.448 -0.541 0 CA-C-N 118.45 0.568 . . . . 0.0 110.746 178.322 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 80' ' ' THR . . . . . 0.45 HG21 ' HB3' ' A' ' 94' ' ' CYS . 71.5 p -74.36 -21.34 59.72 Favored 'General case' 0 N--CA 1.456 -0.146 0 CA-C-O 119.783 -0.151 . . . . 0.0 111.057 -179.737 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 64.6 mtt180 -68.35 -36.81 79.8 Favored 'General case' 0 CA--C 1.526 0.054 0 N-CA-C 109.835 -0.432 . . . . 0.0 109.835 169.124 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 35.4 t . . . . . 0 N--CA 1.457 -0.105 0 C-N-CA 123.958 0.903 . . . . 0.0 113.226 -176.19 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 71.9 Cg_endo . . . . . 0 N--CA 1.451 -1.012 0 N-CA-C 106.435 -2.179 . . . . 0.0 106.435 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 92' ' ' GLY . . . . . 0.449 ' HA2' ' O ' ' A' ' 40' ' ' ILE . . . 105.98 24.98 6.66 Favored Glycine 0 CA--C 1.527 0.81 0 C-N-CA 120.386 -0.911 . . . . 0.0 112.436 -172.902 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 37.9 p -153.94 171.93 18.22 Favored 'General case' 0 CA--C 1.522 -0.121 0 CA-C-N 117.908 0.854 . . . . 0.0 109.951 177.09 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 94' ' ' CYS . . . . . 0.454 ' HB2' HD13 ' A' ' 98' ' ' ILE . 19.6 p -62.24 -22.46 65.99 Favored 'General case' 0 N--CA 1.448 -0.541 0 N-CA-C 109.183 -0.673 . . . . 0.0 109.183 176.381 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -63.16 -58.03 8.59 Favored 'General case' 0 N--CA 1.445 -0.691 0 N-CA-C 109.352 -0.61 . . . . 0.0 109.352 -175.609 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 65.2 t60 -71.51 -33.38 69.16 Favored 'General case' 0 N--CA 1.45 -0.459 0 N-CA-C 110.228 -0.286 . . . . 0.0 110.228 -179.973 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -65.88 -53.95 32.96 Favored 'General case' 0 N--CA 1.448 -0.537 0 CA-C-O 119.831 -0.128 . . . . 0.0 111.104 -176.741 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 98' ' ' ILE . . . . . 0.454 HD13 ' HB2' ' A' ' 94' ' ' CYS . 2.5 mp -70.29 -29.57 39.78 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.336 0 C-N-CA 120.474 -0.49 . . . . 0.0 110.926 -178.375 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 13.4 m-80 -70.45 -38.15 74.44 Favored 'General case' 0 N--CA 1.456 -0.165 0 CA-C-N 118.737 0.698 . . . . 0.0 111.522 176.53 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 89.2 m -67.18 -31.93 72.66 Favored 'General case' 0 CA--C 1.519 -0.221 0 N-CA-C 109.577 -0.527 . . . . 0.0 109.577 179.528 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 83.5 mt -72.22 -42.15 66.05 Favored 'General case' 0 N--CA 1.446 -0.656 0 N-CA-C 109.124 -0.695 . . . . 0.0 109.124 174.874 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -59.38 -14.66 28.0 Favored Glycine 0 CA--C 1.526 0.76 0 CA-C-O 119.155 -0.803 . . . . 0.0 112.849 -177.392 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 21.6 pt-20 -104.28 -2.93 24.91 Favored 'General case' 0 CA--C 1.533 0.289 0 CA-C-N 118.557 1.178 . . . . 0.0 113.502 -177.56 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 34.9 m -143.58 -7.6 0.27 Allowed 'Isoleucine or valine' 0 N--CA 1.466 0.325 0 CA-C-N 118.977 0.808 . . . . 0.0 113.133 176.557 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 105' ' ' ILE . . . . . . . . . . . . . 10.8 tp -64.39 -24.87 36.64 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.169 0 CA-C-N 118.741 0.7 . . . . 0.0 111.018 -176.339 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 23.0 pt20 -69.72 -40.36 76.28 Favored 'General case' 0 N--CA 1.452 -0.33 0 CA-C-O 119.557 -0.258 . . . . 0.0 111.299 -175.591 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 76.4 mm-40 -80.1 -24.97 40.2 Favored 'General case' 0 N--CA 1.453 -0.313 0 CA-C-N 118.401 0.546 . . . . 0.0 110.8 175.958 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 9.1 tt -68.2 -41.62 81.1 Favored 'General case' 0 N--CA 1.452 -0.337 0 N-CA-C 108.908 -0.775 . . . . 0.0 108.908 177.195 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 55.6 mt -68.91 -52.25 31.42 Favored 'General case' 0 N--CA 1.453 -0.298 0 N-CA-C 109.016 -0.735 . . . . 0.0 109.016 174.893 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 34.5 t -42.28 -48.67 5.02 Favored 'General case' 0 C--O 1.234 0.24 0 C-N-CA 123.455 0.702 . . . . 0.0 112.527 175.333 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 35.6 t0 -67.8 -41.25 83.46 Favored 'General case' 0 N--CA 1.455 -0.224 0 N-CA-C 109.937 -0.394 . . . . 0.0 109.937 179.26 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -67.69 -32.94 73.95 Favored 'General case' 0 N--CA 1.446 -0.674 0 C-N-CA 120.848 -0.341 . . . . 0.0 110.794 -176.981 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 113' ' ' ILE . . . . . . . . . . . . . 40.9 mm -70.21 -38.82 75.8 Favored 'Isoleucine or valine' 0 C--N 1.339 0.144 0 CA-C-N 118.474 0.579 . . . . 0.0 109.941 178.766 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -74.27 -47.73 33.09 Favored 'General case' 0 N--CA 1.453 -0.322 0 N-CA-C 111.469 0.174 . . . . 0.0 111.469 179.792 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 115' ' ' LYS . . . . . 0.408 ' HE3' ' HB2' ' A' ' 115' ' ' LYS . 30.4 ttmt -76.98 -30.83 56.14 Favored 'General case' 0 N--CA 1.452 -0.331 0 C-N-CA 124.262 1.025 . . . . 0.0 113.619 -172.492 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 116' ' ' SER . . . . . 0.458 ' HA ' ' HB2' ' A' ' 59' ' ' ASP . 1.5 m -90.05 150.57 22.04 Favored 'General case' 0 CA--C 1.528 0.134 0 CA-C-N 118.177 0.444 . . . . 0.0 111.383 -174.185 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 19.1 t30 -71.21 169.31 15.42 Favored 'General case' 0 C--O 1.225 -0.213 0 C-N-CA 122.802 0.441 . . . . 0.0 110.685 -174.2 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 118' ' ' GLN . . . . . . . . . . . . . 17.1 mt-30 -55.39 -36.23 66.17 Favored 'General case' 0 CA--C 1.528 0.103 0 N-CA-C 111.947 0.351 . . . . 0.0 111.947 -173.616 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -66.59 -34.29 77.56 Favored 'General case' 0 N--CA 1.456 -0.14 0 N-CA-C 109.64 -0.504 . . . . 0.0 109.64 178.331 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 120' ' ' HIS . . . . . 0.455 ' CB ' ' HB3' ' A' ' 116' ' ' SER . 19.4 m170 -75.48 -41.3 55.86 Favored 'General case' 0 N--CA 1.448 -0.549 0 N-CA-C 109.178 -0.675 . . . . 0.0 109.178 179.07 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 49.4 mttm -54.75 -43.6 72.86 Favored 'General case' 0 N--CA 1.456 -0.165 0 N-CA-C 108.824 -0.806 . . . . 0.0 108.824 177.2 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 39.1 tp10 -66.17 -41.81 89.82 Favored 'General case' 0 N--CA 1.454 -0.266 0 CA-C-O 119.62 -0.228 . . . . 0.0 110.633 -179.269 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 88.9 mttt -66.6 -28.64 68.66 Favored 'General case' 0 N--CA 1.452 -0.342 0 C-N-CA 119.721 -0.792 . . . . 0.0 111.112 178.801 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 124' ' ' ILE . . . . . . . . . . . . . 58.1 mt -72.27 -38.22 61.1 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.198 0 CA-C-N 118.52 0.6 . . . . 0.0 109.897 177.906 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 27.9 mmt180 -64.62 -40.37 95.36 Favored 'General case' 0 N--CA 1.455 -0.216 0 O-C-N 121.887 -0.508 . . . . 0.0 110.819 -179.744 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 126' ' ' MET . . . . . . . . . . . . . 28.3 ptm -71.8 -30.69 65.79 Favored 'General case' 0 CA--C 1.528 0.117 0 C-N-CA 120.181 -0.608 . . . . 0.0 110.827 -179.648 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 66.7 mt -64.74 -35.85 82.4 Favored 'General case' 0 N--CA 1.456 -0.128 0 CA-C-N 118.392 0.542 . . . . 0.0 110.103 175.347 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 95.4 mt -69.4 -35.74 76.07 Favored 'General case' 0 CA--C 1.529 0.159 0 CA-C-N 118.193 0.451 . . . . 0.0 110.64 178.12 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 14.9 t0 -63.29 -44.52 94.8 Favored 'General case' 0 N--CA 1.456 -0.172 0 N-CA-C 109.367 -0.605 . . . . 0.0 109.367 176.368 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 65.4 mt -60.93 -34.27 58.95 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.251 0 N-CA-C 109.993 -0.373 . . . . 0.0 109.993 -179.981 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 131' ' ' TRP . . . . . . . . . . . . . 43.4 m0 . . . . . 0 N--CA 1.452 -0.334 0 C-N-CA 120.057 -0.657 . . . . 0.0 112.617 -179.271 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 20.7 p-10 . . . . . 0 N--CA 1.449 -0.488 0 N-CA-C 108.928 -0.767 . . . . 0.0 108.928 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 7' ' ' PHE . . . . . 0.474 ' CD1' ' HD3' ' A' ' 45' ' ' LYS . 1.5 t80 -49.73 -39.6 37.87 Favored 'General case' 0 N--CA 1.456 -0.145 0 C-N-CA 124.028 0.931 . . . . 0.0 110.089 177.416 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 50.8 tp60 -51.79 -34.63 40.67 Favored 'General case' 0 N--CA 1.455 -0.189 0 C-N-CA 124.061 0.944 . . . . 0.0 111.919 -177.183 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 30.7 m-80 -74.2 -30.7 62.33 Favored 'General case' 0 N--CA 1.451 -0.394 0 N-CA-C 109.916 -0.401 . . . . 0.0 109.916 -179.175 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 10' ' ' PHE . . . . . 0.42 ' CE2' ' HB2' ' A' ' 32' ' ' LEU . 3.2 t80 -71.04 -38.99 72.53 Favored 'General case' 0 N--CA 1.451 -0.414 0 N-CA-C 109.125 -0.695 . . . . 0.0 109.125 176.221 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 65.2 t -64.69 -56.47 15.85 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.307 0 N-CA-C 108.948 -0.76 . . . . 0.0 108.948 178.409 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -59.49 -27.17 65.89 Favored 'General case' 0 N--CA 1.451 -0.393 0 C-N-CA 123.109 0.564 . . . . 0.0 112.247 -179.933 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 81.8 m -73.38 -41.4 63.42 Favored 'General case' 0 N--CA 1.456 -0.162 0 CA-C-N 118.785 0.721 . . . . 0.0 109.262 177.163 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.498 ' HA ' ' CD1' ' A' ' 17' ' ' PHE . 11.8 tp -64.06 -48.0 77.94 Favored 'General case' 0 N--CA 1.452 -0.345 0 CA-C-O 121.357 0.599 . . . . 0.0 109.643 177.728 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 61.7 mm-40 -62.33 -30.48 71.19 Favored 'General case' 0 N--CA 1.452 -0.359 0 C-N-CA 124.209 1.003 . . . . 0.0 109.886 179.303 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 31.4 t -67.84 -31.42 71.24 Favored 'General case' 0 N--CA 1.45 -0.458 0 CA-C-O 119.011 -0.519 . . . . 0.0 110.033 177.476 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 17' ' ' PHE . . . . . 0.498 ' CD1' ' HA ' ' A' ' 14' ' ' LEU . 13.8 m-85 -67.85 -39.91 83.74 Favored 'General case' 0 C--N 1.339 0.132 0 CA-C-N 118.495 0.589 . . . . 0.0 110.439 172.999 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 18' ' ' LYS . . . . . 0.442 ' HG2' ' CE1' ' A' ' 53' ' ' TYR . 65.8 mttt -64.8 -27.88 69.19 Favored 'General case' 0 C--N 1.338 0.106 0 CA-C-O 120.468 0.175 . . . . 0.0 110.864 -178.008 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 36.3 t0 -75.29 -14.72 60.52 Favored 'General case' 0 CA--C 1.533 0.293 0 C-N-CA 123.634 0.774 . . . . 0.0 112.186 179.865 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 48.7 mt -77.12 168.84 19.39 Favored 'General case' 0 N--CA 1.457 -0.124 0 O-C-N 121.714 -0.616 . . . . 0.0 111.758 -178.992 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 8.3 mtmp? -99.41 -27.19 13.86 Favored 'General case' 0 N--CA 1.455 -0.215 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.049 174.698 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 80.7 p -90.56 -25.33 20.27 Favored 'General case' 0 CA--C 1.529 0.167 0 C-N-CA 122.913 0.485 . . . . 0.0 110.597 176.03 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 77.47 -22.28 2.7 Favored Glycine 0 CA--C 1.529 0.93 0 C-N-CA 123.631 0.634 . . . . 0.0 113.793 176.155 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 66.6 mt -84.72 151.86 3.76 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.215 0 CA-C-N 118.086 0.943 . . . . 0.0 108.912 172.927 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 5.1 t -159.09 79.84 0.76 Allowed 'General case' 0 N--CA 1.453 -0.312 0 CA-C-N 118.46 0.573 . . . . 0.0 110.895 -179.52 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 26' ' ' GLY . . . . . 0.442 ' O ' ' HE2' ' A' ' 30' ' ' LYS . . . -47.11 -51.22 14.56 Favored Glycine 0 CA--C 1.524 0.606 0 CA-C-O 118.932 -0.927 . . . . 0.0 114.059 -171.954 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 14.6 m -63.98 -49.04 74.04 Favored 'General case' 0 CA--C 1.52 -0.19 0 CA-C-N 119.044 1.422 . . . . 0.0 110.647 -175.511 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 15.2 mtm180 -70.38 -34.04 72.11 Favored 'General case' 0 C--O 1.234 0.26 0 CA-C-O 119.704 -0.189 . . . . 0.0 111.128 -176.737 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 29' ' ' ILE . . . . . 0.41 HG12 ' CG1' ' A' ' 68' ' ' ILE . 54.4 mt -58.73 -45.84 90.89 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.592 0 N-CA-C 108.006 -1.109 . . . . 0.0 108.006 173.133 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 30' ' ' LYS . . . . . 0.442 ' HE2' ' O ' ' A' ' 26' ' ' GLY . 53.1 mtmt -67.25 -23.6 65.72 Favored 'General case' 0 CA--C 1.529 0.166 0 CA-C-O 118.776 -0.63 . . . . 0.0 111.592 178.579 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 31' ' ' LYS . . . . . 0.593 ' HA ' ' HE2' ' A' ' 31' ' ' LYS . 8.4 mmpt? -67.85 -58.39 4.66 Favored 'General case' 0 C--N 1.342 0.25 0 CA-C-N 119.218 0.917 . . . . 0.0 110.595 178.047 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.467 HD12 ' N ' ' A' ' 33' ' ' THR . 1.8 pp -74.94 -17.32 60.58 Favored 'General case' 0 CA--C 1.531 0.247 0 C-N-CA 119.286 -0.966 . . . . 0.0 111.552 -177.329 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 33' ' ' THR . . . . . 0.467 ' N ' HD12 ' A' ' 32' ' ' LEU . 54.2 m -74.44 -38.13 63.1 Favored 'General case' 0 N--CA 1.455 -0.225 0 N-CA-C 109.509 -0.552 . . . . 0.0 109.509 177.211 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 98.4 m -73.15 -38.07 66.37 Favored 'General case' 0 N--CA 1.45 -0.46 0 N-CA-C 110.153 -0.314 . . . . 0.0 110.153 -178.555 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 27.3 t80 -64.23 -37.08 86.21 Favored 'General case' 0 N--CA 1.456 -0.149 0 N-CA-C 109.942 -0.392 . . . . 0.0 109.942 175.997 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -72.03 -38.63 69.51 Favored 'General case' 0 N--CA 1.448 -0.529 0 CA-C-O 119.462 -0.304 . . . . 0.0 111.429 178.081 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 9.9 mt -67.71 -36.1 80.0 Favored 'General case' 0 C--O 1.231 0.1 0 CA-C-N 118.217 0.462 . . . . 0.0 110.796 -179.757 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 42.6 t0 -71.0 -20.03 62.46 Favored 'General case' 0 N--CA 1.453 -0.291 0 C-N-CA 122.451 0.3 . . . . 0.0 111.358 177.199 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 39' ' ' HIS . . . . . 0.403 ' HB2' HD11 ' A' ' 42' ' ' ILE . 97.9 m-70 -148.69 97.74 2.77 Favored 'General case' 0 C--N 1.339 0.125 0 C-N-CA 122.852 0.461 . . . . 0.0 111.34 -175.036 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 40' ' ' ILE . . . . . 0.61 ' H ' HD13 ' A' ' 40' ' ' ILE . 0.0 OUTLIER -76.02 -12.29 14.42 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.454 0 C-N-CA 123.205 0.602 . . . . 0.0 110.866 176.551 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 19.7 m-20 -58.56 -21.11 51.73 Favored 'General case' 0 C--N 1.339 0.111 0 C-N-CA 122.925 0.49 . . . . 0.0 112.295 -176.793 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 42' ' ' ILE . . . . . 0.403 HD11 ' HB2' ' A' ' 39' ' ' HIS . 0.0 OUTLIER -104.1 12.93 7.61 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.208 0 C-N-CA 123.104 0.562 . . . . 0.0 112.211 178.353 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 2.9 pp20? -50.37 -33.32 20.09 Favored 'General case' 0 CA--C 1.53 0.21 0 CA-C-N 118.587 0.631 . . . . 0.0 111.766 -179.764 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 39.5 t -62.05 -49.93 74.01 Favored 'General case' 0 C--O 1.233 0.184 0 N-CA-C 111.912 0.338 . . . . 0.0 111.912 -178.047 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 45' ' ' LYS . . . . . 0.474 ' HD3' ' CD1' ' A' ' 7' ' ' PHE . 18.8 ptpt -70.98 -28.18 64.26 Favored 'General case' 0 C--N 1.339 0.128 0 O-C-N 121.85 -0.531 . . . . 0.0 109.778 -179.531 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 46' ' ' ILE . . . . . 0.414 HG12 ' CZ ' ' A' ' 10' ' ' PHE . 88.1 mt -68.7 -45.03 81.92 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.205 0 N-CA-C 110.049 -0.352 . . . . 0.0 110.049 -178.559 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 30.5 mm -62.72 -36.58 75.97 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.257 0 N-CA-C 109.024 -0.732 . . . . 0.0 109.024 177.309 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 39.4 t -64.63 -31.74 73.1 Favored 'General case' 0 CA--C 1.531 0.224 0 C-N-CA 120.984 -0.286 . . . . 0.0 111.729 179.023 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 6.7 mp -80.04 -31.97 39.5 Favored 'General case' 0 N--CA 1.451 -0.409 0 N-CA-C 113.265 0.839 . . . . 0.0 113.265 -179.698 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 12.5 pt -72.32 -38.46 61.45 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.207 0 CA-C-N 119.874 1.215 . . . . 0.0 110.708 177.558 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 24.4 pt -68.62 -35.22 69.13 Favored 'Isoleucine or valine' 0 CA--C 1.528 0.115 0 C-N-CA 120.336 -0.545 . . . . 0.0 110.032 176.981 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 21.0 t70 -59.3 -53.25 60.39 Favored 'General case' 0 C--N 1.339 0.134 0 CA-C-N 118.417 0.553 . . . . 0.0 110.053 174.858 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 53' ' ' TYR . . . . . 0.442 ' CE1' ' HG2' ' A' ' 18' ' ' LYS . 8.5 t80 -61.63 -44.53 96.81 Favored 'General case' 0 N--CA 1.451 -0.422 0 N-CA-C 109.836 -0.431 . . . . 0.0 109.836 -177.323 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 15.5 m -71.14 -23.03 62.0 Favored 'General case' 0 N--CA 1.453 -0.305 0 N-CA-C 112.196 0.443 . . . . 0.0 112.196 -175.264 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 18.4 tpp180 -84.11 -38.33 20.88 Favored 'General case' 0 N--CA 1.455 -0.216 0 CA-C-N 118.219 0.463 . . . . 0.0 110.642 179.359 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 95.9 mt -85.01 -50.01 7.82 Favored 'General case' 0 N--CA 1.452 -0.333 0 N-CA-C 113.188 0.81 . . . . 0.0 113.188 -175.884 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 5.8 p -66.33 153.87 91.71 Favored Pre-proline 0 CA--C 1.534 0.358 0 N-CA-C 113.647 0.981 . . . . 0.0 113.647 -170.39 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 67.8 Cg_endo -76.87 -170.72 0.96 Allowed 'Trans proline' 0 N--CA 1.455 -0.741 0 C-N-CA 124.837 3.691 . . . . 0.0 111.474 178.866 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 23.6 p-10 -53.82 -60.0 3.89 Favored 'General case' 0 CA--C 1.53 0.189 0 N-CA-C 114.55 1.315 . . . . 0.0 114.55 -170.732 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 22.6 t -67.64 -32.48 73.21 Favored 'General case' 0 N--CA 1.456 -0.134 0 CA-C-N 118.038 0.381 . . . . 0.0 110.947 -173.679 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 39.4 m80 -72.46 -26.55 61.86 Favored 'General case' 0 N--CA 1.453 -0.279 0 N-CA-C 110.035 -0.357 . . . . 0.0 110.035 177.131 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 17.1 ttmt -75.59 -28.52 58.96 Favored 'General case' 0 N--CA 1.451 -0.391 0 N-CA-C 110.113 -0.328 . . . . 0.0 110.113 177.041 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -65.05 -44.36 89.3 Favored 'General case' 0 N--CA 1.454 -0.227 0 N-CA-C 107.479 -1.304 . . . . 0.0 107.479 172.312 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -68.93 -25.3 75.42 Favored Glycine 0 C--N 1.34 0.758 0 N-CA-C 111.398 -0.681 . . . . 0.0 111.398 178.532 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 22.8 t -72.97 -40.32 65.42 Favored 'General case' 0 N--CA 1.452 -0.352 0 CA-C-N 117.782 0.791 . . . . 0.0 109.977 175.843 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 60.0 mt -68.57 -27.39 66.03 Favored 'General case' 0 N--CA 1.452 -0.342 0 N-CA-C 109.813 -0.44 . . . . 0.0 109.813 177.892 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 3.0 m-30 -66.01 -41.39 91.05 Favored 'General case' 0 CA--C 1.518 -0.269 0 N-CA-C 109.918 -0.401 . . . . 0.0 109.918 171.839 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 68' ' ' ILE . . . . . 0.41 ' CG1' HG12 ' A' ' 29' ' ' ILE . 21.0 mt -67.24 -45.32 86.49 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.585 0 N-CA-C 109.261 -0.644 . . . . 0.0 109.261 178.539 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 86.9 mt -58.87 -36.01 59.2 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.321 0 C-N-CA 123.273 0.629 . . . . 0.0 111.62 178.595 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 28.2 t70 -72.58 -40.82 66.29 Favored 'General case' 0 CA--C 1.517 -0.302 0 CA-C-N 119.015 0.825 . . . . 0.0 109.309 174.007 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 42.3 m -59.58 -66.63 0.48 Allowed 'General case' 0 N--CA 1.448 -0.547 0 N-CA-C 108.926 -0.768 . . . . 0.0 108.926 -178.36 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 72' ' ' ILE . . . . . 0.461 HD11 ' CZ ' ' A' ' 76' ' ' TYR . 0.0 OUTLIER -73.98 -44.4 50.86 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.363 0 CA-C-N 117.845 0.293 . . . . 0.0 111.014 -176.372 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -72.22 -49.8 19.55 Favored Glycine 0 CA--C 1.521 0.446 0 N-CA-C 112.418 -0.273 . . . . 0.0 112.418 -171.207 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 7.8 tmm_? -79.38 -30.26 42.46 Favored 'General case' 0 N--CA 1.445 -0.711 0 C-N-CA 119.814 -0.754 . . . . 0.0 110.256 -176.95 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -70.36 -25.54 63.32 Favored 'General case' 0 C--N 1.342 0.268 0 C-N-CA 118.646 -1.222 . . . . 0.0 109.795 173.458 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 76' ' ' TYR . . . . . 0.461 ' CZ ' HD11 ' A' ' 72' ' ' ILE . 1.4 m-30 -64.84 -49.3 71.15 Favored 'General case' 0 CA--C 1.515 -0.373 0 CA-C-N 118.75 0.704 . . . . 0.0 109.811 175.023 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 77' ' ' LEU . . . . . 0.462 ' O ' HD13 ' A' ' 77' ' ' LEU . 2.2 tm? -66.2 -43.95 85.33 Favored 'General case' 0 N--CA 1.447 -0.587 0 C-N-CA 118.219 -1.393 . . . . 0.0 108.711 -178.892 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 88.2 m-20 -59.3 -46.27 89.02 Favored 'General case' 0 CA--C 1.529 0.171 0 N-CA-C 112.318 0.488 . . . . 0.0 112.318 178.895 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 15.1 tm-20 -67.44 -48.89 65.91 Favored 'General case' 0 N--CA 1.45 -0.428 0 CA-C-N 118.34 0.518 . . . . 0.0 112.034 -178.081 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 64.4 p -64.57 -26.98 68.65 Favored 'General case' 0 N--CA 1.456 -0.147 0 CA-C-N 117.709 0.232 . . . . 0.0 111.312 179.965 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 11.9 ttm105 -75.5 -30.73 59.94 Favored 'General case' 0 N--CA 1.451 -0.392 0 CA-C-N 117.757 0.253 . . . . 0.0 110.341 175.383 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 35.3 t . . . . . 0 N--CA 1.455 -0.207 0 N-CA-C 112.408 0.521 . . . . 0.0 112.408 179.702 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 73.5 Cg_endo . . . . . 0 N--CA 1.455 -0.775 0 N-CA-C 110.237 -0.716 . . . . 0.0 110.237 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 89.7 19.48 47.98 Favored Glycine 0 CA--C 1.527 0.79 0 CA-C-O 119.362 -0.688 . . . . 0.0 112.242 179.925 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 20.3 p -153.16 168.87 24.49 Favored 'General case' 0 CA--C 1.521 -0.162 0 CA-C-N 117.89 0.845 . . . . 0.0 110.75 178.052 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 94' ' ' CYS . . . . . 0.417 ' HB2' HD13 ' A' ' 98' ' ' ILE . 29.5 p -57.94 -23.67 54.56 Favored 'General case' 0 N--CA 1.449 -0.515 0 CA-C-N 115.698 -0.683 . . . . 0.0 110.176 174.402 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -58.95 -57.85 11.23 Favored 'General case' 0 N--CA 1.451 -0.42 0 N-CA-C 109.361 -0.607 . . . . 0.0 109.361 -177.339 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 62.2 t60 -75.74 -32.01 59.81 Favored 'General case' 0 N--CA 1.451 -0.376 0 C-N-CA 121.094 -0.242 . . . . 0.0 111.639 -179.506 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -65.36 -48.88 71.42 Favored 'General case' 0 N--CA 1.45 -0.457 0 O-C-N 122.959 0.162 . . . . 0.0 111.053 -178.895 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 98' ' ' ILE . . . . . 0.417 HD13 ' HB2' ' A' ' 94' ' ' CYS . 1.8 mp -74.44 -27.71 21.63 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.162 0 CA-C-O 119.507 -0.282 . . . . 0.0 110.583 -179.886 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 70.3 m-20 -64.23 -48.9 74.05 Favored 'General case' 0 N--CA 1.452 -0.339 0 CA-C-N 118.605 0.639 . . . . 0.0 110.163 173.902 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 26.4 m -74.64 -27.52 60.48 Favored 'General case' 0 N--CA 1.456 -0.164 0 N-CA-C 110.553 -0.166 . . . . 0.0 110.553 -175.947 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 57.0 tp -75.46 -47.97 24.79 Favored 'General case' 0 N--CA 1.448 -0.534 0 N-CA-C 110.272 -0.27 . . . . 0.0 110.272 177.027 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -65.81 -14.48 60.84 Favored Glycine 0 CA--C 1.528 0.846 0 CA-C-O 119.521 -0.6 . . . . 0.0 113.063 -173.33 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 24.2 pt-20 -95.98 -7.51 36.25 Favored 'General case' 0 CA--C 1.531 0.229 0 CA-C-N 118.297 1.049 . . . . 0.0 112.5 -178.482 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 27.3 m -129.97 -14.3 2.12 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.147 0 CA-C-N 118.542 0.61 . . . . 0.0 112.264 176.911 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 105' ' ' ILE . . . . . . . . . . . . . 9.7 tp -61.24 -22.62 27.86 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.137 0 CA-C-N 118.473 0.579 . . . . 0.0 110.7 -179.938 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 22.9 pt20 -64.79 -33.06 75.08 Favored 'General case' 0 N--CA 1.452 -0.359 0 C-N-CA 122.912 0.485 . . . . 0.0 110.445 177.145 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 82.9 mt-10 -75.61 -36.04 60.37 Favored 'General case' 0 N--CA 1.455 -0.218 0 CA-C-O 120.769 0.319 . . . . 0.0 110.171 177.991 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 50.2 mt -75.37 -37.42 60.61 Favored 'General case' 0 N--CA 1.448 -0.549 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.925 -177.359 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 67.0 mt -69.55 -57.13 5.59 Favored 'General case' 0 N--CA 1.452 -0.361 0 N-CA-C 109.909 -0.404 . . . . 0.0 109.909 177.377 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 6.4 p -46.07 -53.35 10.39 Favored 'General case' 0 CA--C 1.522 -0.121 0 C-N-CA 122.606 0.362 . . . . 0.0 111.434 179.294 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 34.4 t0 -61.66 -43.74 98.29 Favored 'General case' 0 N--CA 1.443 -0.784 0 N-CA-C 109.987 -0.375 . . . . 0.0 109.987 -179.954 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -65.6 -32.92 74.76 Favored 'General case' 0 N--CA 1.446 -0.636 0 C-N-CA 120.038 -0.665 . . . . 0.0 110.895 -176.984 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 113' ' ' ILE . . . . . . . . . . . . . 27.8 mm -68.28 -41.55 83.83 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.115 0 CA-C-N 118.984 0.811 . . . . 0.0 109.944 179.931 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -75.95 -39.39 56.15 Favored 'General case' 0 N--CA 1.454 -0.268 0 N-CA-C 112.033 0.383 . . . . 0.0 112.033 -179.711 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 1.3 tppp? -77.13 -33.03 56.8 Favored 'General case' 0 N--CA 1.449 -0.477 0 C-N-CA 123.966 0.906 . . . . 0.0 113.148 -175.086 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 116' ' ' SER . . . . . 0.467 ' HB2' ' CB ' ' A' ' 120' ' ' HIS . 51.7 p -84.89 160.68 20.1 Favored 'General case' 0 CA--C 1.53 0.2 0 N-CA-C 111.952 0.353 . . . . 0.0 111.952 -174.082 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 48.9 t30 -80.03 167.71 20.09 Favored 'General case' 0 CA--C 1.534 0.349 0 C-N-CA 122.901 0.48 . . . . 0.0 110.445 -179.618 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 118' ' ' GLN . . . . . . . . . . . . . 24.6 mm100 -52.64 -42.83 65.01 Favored 'General case' 0 CA--C 1.529 0.144 0 N-CA-C 112.954 0.724 . . . . 0.0 112.954 -173.047 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 11.1 p-10 -66.39 -35.71 81.01 Favored 'General case' 0 N--CA 1.456 -0.165 0 N-CA-C 110.223 -0.288 . . . . 0.0 110.223 179.296 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 120' ' ' HIS . . . . . 0.467 ' CB ' ' HB2' ' A' ' 116' ' ' SER . 25.6 m170 -68.98 -41.65 77.6 Favored 'General case' 0 N--CA 1.451 -0.423 0 CA-C-N 116.416 -0.357 . . . . 0.0 110.092 177.351 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 45.9 mttm -58.57 -39.24 79.74 Favored 'General case' 0 C--N 1.34 0.184 0 N-CA-C 109.371 -0.603 . . . . 0.0 109.371 178.813 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 1.8 tm-20 -65.51 -46.0 81.34 Favored 'General case' 0 N--CA 1.452 -0.331 0 C-N-CA 122.885 0.474 . . . . 0.0 110.756 -179.115 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 62.8 mttp -66.3 -31.45 72.25 Favored 'General case' 0 N--CA 1.455 -0.215 0 CA-C-N 117.741 0.246 . . . . 0.0 111.31 -179.782 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 124' ' ' ILE . . . . . . . . . . . . . 61.7 mt -74.59 -32.94 30.77 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.239 0 O-C-N 121.952 -0.468 . . . . 0.0 109.9 176.473 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -71.7 -36.86 70.68 Favored 'General case' 0 N--CA 1.455 -0.209 0 CA-C-O 119.163 -0.446 . . . . 0.0 111.492 179.032 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 126' ' ' MET . . . . . . . . . . . . . 28.2 ptm -68.14 -32.68 73.12 Favored 'General case' 0 CA--C 1.53 0.184 0 C-N-CA 119.148 -1.021 . . . . 0.0 109.243 174.648 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 4.0 mp -65.24 -32.73 74.55 Favored 'General case' 0 C--N 1.342 0.247 0 CA-C-O 119.474 -0.298 . . . . 0.0 110.321 171.926 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 44.2 tp -68.24 -43.09 78.68 Favored 'General case' 0 N--CA 1.455 -0.208 0 CA-C-N 118.165 0.439 . . . . 0.0 109.83 179.098 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 35.6 m-20 -60.06 -41.54 92.57 Favored 'General case' 0 N--CA 1.455 -0.208 0 N-CA-C 109.889 -0.411 . . . . 0.0 109.889 176.511 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 65.0 mt -63.26 -36.7 77.12 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.273 0 N-CA-C 109.989 -0.374 . . . . 0.0 109.989 179.116 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 131' ' ' TRP . . . . . . . . . . . . . 42.2 m0 . . . . . 0 N--CA 1.451 -0.406 0 N-CA-C 112.589 0.589 . . . . 0.0 112.589 -179.382 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 3.8 p30 . . . . . 0 N--CA 1.447 -0.607 0 N-CA-C 107.13 -1.433 . . . . 0.0 107.13 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 7' ' ' PHE . . . . . 0.482 ' CD1' ' HD3' ' A' ' 45' ' ' LYS . 1.3 t80 -62.55 -34.21 76.49 Favored 'General case' 0 N--CA 1.45 -0.475 0 C-N-CA 124.482 1.113 . . . . 0.0 108.998 172.657 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 51.5 tp60 -49.64 -36.37 24.33 Favored 'General case' 0 N--CA 1.453 -0.281 0 C-N-CA 124.953 1.301 . . . . 0.0 112.167 -177.481 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 22.9 m-80 -71.8 -34.48 69.41 Favored 'General case' 0 N--CA 1.454 -0.264 0 CA-C-O 120.801 0.334 . . . . 0.0 110.176 -179.524 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 10' ' ' PHE . . . . . 0.439 ' CZ ' HG12 ' A' ' 46' ' ' ILE . 1.6 t80 -70.98 -39.57 72.43 Favored 'General case' 0 N--CA 1.45 -0.45 0 C-N-CA 123.787 0.835 . . . . 0.0 109.107 177.451 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 95.2 t -66.42 -52.21 49.3 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.353 0 N-CA-C 109.164 -0.68 . . . . 0.0 109.164 178.666 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -59.12 -31.16 68.68 Favored 'General case' 0 N--CA 1.451 -0.389 0 C-N-CA 122.428 0.291 . . . . 0.0 111.486 -178.86 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 78.6 m -69.88 -37.45 76.05 Favored 'General case' 0 CA--C 1.531 0.214 0 N-CA-C 108.753 -0.832 . . . . 0.0 108.753 176.061 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.495 HD21 ' HB2' ' A' ' 53' ' ' TYR . 6.2 tp -66.73 -41.43 87.89 Favored 'General case' 0 N--CA 1.455 -0.203 0 CA-C-O 121.485 0.66 . . . . 0.0 110.488 178.742 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 63.3 mm-40 -64.82 -27.79 69.12 Favored 'General case' 0 N--CA 1.451 -0.417 0 C-N-CA 123.698 0.799 . . . . 0.0 109.08 178.027 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 5.3 p -71.75 -29.3 64.35 Favored 'General case' 0 N--CA 1.452 -0.346 0 N-CA-C 109.966 -0.383 . . . . 0.0 109.966 177.596 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 17' ' ' PHE . . . . . 0.502 ' CE1' HD11 ' A' ' 68' ' ' ILE . 24.3 m-85 -68.85 -34.32 75.27 Favored 'General case' 0 N--CA 1.457 -0.124 0 C-N-CA 119.718 -0.793 . . . . 0.0 110.395 171.536 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 18' ' ' LYS . . . . . 0.422 ' HA ' ' CE1' ' A' ' 61' ' ' HIS . 55.1 mttt -65.76 -26.3 67.66 Favored 'General case' 0 C--N 1.338 0.103 0 C-N-CA 120.395 -0.522 . . . . 0.0 110.153 176.112 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 40.3 t0 -73.48 -43.73 59.54 Favored 'General case' 0 CA--C 1.532 0.26 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.637 177.137 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 87.6 mt -65.12 146.66 54.69 Favored 'General case' 0 N--CA 1.456 -0.148 0 O-C-N 121.862 -0.524 . . . . 0.0 110.001 179.546 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -81.54 -32.5 32.25 Favored 'General case' 0 C--N 1.334 -0.076 0 N-CA-C 109.737 -0.468 . . . . 0.0 109.737 -179.916 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 14.1 m -79.22 -21.55 46.1 Favored 'General case' 0 N--CA 1.453 -0.289 0 C-N-CA 123.166 0.586 . . . . 0.0 110.738 175.487 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 72.74 -26.93 0.75 Allowed Glycine 0 CA--C 1.527 0.826 0 C-N-CA 124.578 1.085 . . . . 0.0 112.328 -178.792 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 74.3 mt -81.61 147.37 6.23 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.441 0 C-N-CA 123.396 0.678 . . . . 0.0 110.413 178.916 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 37.8 t -165.67 97.4 0.66 Allowed 'General case' 0 CA--C 1.517 -0.305 0 N-CA-C 108.42 -0.956 . . . . 0.0 108.42 173.606 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 26' ' ' GLY . . . . . 0.467 ' O ' ' HE2' ' A' ' 30' ' ' LYS . . . -55.84 -36.83 67.35 Favored Glycine 0 CA--C 1.527 0.796 0 N-CA-C 110.313 -1.115 . . . . 0.0 110.313 -176.497 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 88.5 p -62.27 -51.76 66.41 Favored 'General case' 0 N--CA 1.454 -0.274 0 CA-C-N 117.502 0.651 . . . . 0.0 110.123 -177.817 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 83.7 mtt180 -70.86 -40.97 72.0 Favored 'General case' 0 N--CA 1.455 -0.188 0 C-N-CA 123.626 0.77 . . . . 0.0 110.737 -178.71 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 64.0 mt -56.43 -42.01 73.74 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.707 0 N-CA-C 109.101 -0.703 . . . . 0.0 109.101 174.861 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 30' ' ' LYS . . . . . 0.467 ' HE2' ' O ' ' A' ' 26' ' ' GLY . 48.8 mtmt -67.81 -26.88 66.29 Favored 'General case' 0 C--N 1.34 0.194 0 CA-C-O 118.79 -0.624 . . . . 0.0 111.385 177.554 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 31' ' ' LYS . . . . . 0.49 ' HA ' ' HE3' ' A' ' 31' ' ' LYS . 0.0 OUTLIER -63.93 -56.56 14.32 Favored 'General case' 0 C--N 1.339 0.112 0 CA-C-N 119.187 0.903 . . . . 0.0 110.146 176.568 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.439 HD12 ' N ' ' A' ' 33' ' ' THR . 3.3 pp -75.21 -20.63 59.17 Favored 'General case' 0 CA--C 1.531 0.222 0 C-N-CA 119.662 -0.815 . . . . 0.0 111.419 -177.532 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 33' ' ' THR . . . . . 0.439 ' N ' HD12 ' A' ' 32' ' ' LEU . 31.3 m -69.8 -41.68 74.71 Favored 'General case' 0 C--O 1.231 0.107 0 N-CA-C 108.28 -1.007 . . . . 0.0 108.28 175.96 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 97.5 m -68.44 -41.82 79.75 Favored 'General case' 0 N--CA 1.45 -0.46 0 N-CA-C 109.876 -0.416 . . . . 0.0 109.876 -178.751 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 52.7 t80 -62.89 -32.12 73.32 Favored 'General case' 0 C--N 1.337 0.046 0 N-CA-C 109.972 -0.381 . . . . 0.0 109.972 177.475 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -72.97 -28.72 62.57 Favored 'General case' 0 N--CA 1.447 -0.62 0 CA-C-O 119.491 -0.29 . . . . 0.0 111.061 178.999 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 2.2 mm? -79.78 -33.93 40.14 Favored 'General case' 0 CA--C 1.519 -0.224 0 N-CA-C 109.009 -0.737 . . . . 0.0 109.009 -178.371 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 81.2 m-20 -66.32 -17.25 64.65 Favored 'General case' 0 N--CA 1.443 -0.818 0 C-N-CA 123.892 0.877 . . . . 0.0 111.188 173.966 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 96.5 m-70 -152.52 90.78 1.52 Allowed 'General case' 0 N--CA 1.453 -0.286 0 C-N-CA 123.904 0.882 . . . . 0.0 110.681 -176.87 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 40' ' ' ILE . . . . . 0.567 ' H ' HD13 ' A' ' 40' ' ' ILE . 0.0 OUTLIER -71.23 -18.39 20.4 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.29 0 CA-C-N 119.235 0.925 . . . . 0.0 108.526 172.374 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 7.7 m-20 -44.84 -41.78 7.36 Favored 'General case' 0 N--CA 1.455 -0.212 0 C-N-CA 125.817 1.647 . . . . 0.0 112.806 -179.525 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 42' ' ' ILE . . . . . 0.402 HD13 HD11 ' A' ' 46' ' ' ILE . 1.4 pp -101.07 16.73 4.14 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.57 0 C-N-CA 124.151 0.98 . . . . 0.0 111.742 -173.283 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 43' ' ' GLU . . . . . 0.44 ' HA ' HD12 ' A' ' 46' ' ' ILE . 3.0 pp20? -52.97 -32.96 48.95 Favored 'General case' 0 CA--C 1.529 0.14 0 O-C-N 122.076 -0.39 . . . . 0.0 111.205 176.759 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 47.8 t -59.71 -46.14 90.0 Favored 'General case' 0 CA--C 1.53 0.211 0 O-C-N 122.273 -0.267 . . . . 0.0 111.654 -177.326 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 45' ' ' LYS . . . . . 0.482 ' HD3' ' CD1' ' A' ' 7' ' ' PHE . 18.4 ptpt -75.09 -23.03 57.91 Favored 'General case' 0 C--N 1.341 0.223 0 C-N-CA 121.006 -0.278 . . . . 0.0 110.547 179.434 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 46' ' ' ILE . . . . . 0.44 HD12 ' HA ' ' A' ' 43' ' ' GLU . 77.0 mt -73.88 -50.13 30.67 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.253 0 N-CA-C 110.18 -0.304 . . . . 0.0 110.18 -179.92 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 46.0 mm -67.32 -37.25 78.69 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.431 0 O-C-N 123.357 0.41 . . . . 0.0 110.364 -177.302 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 22.6 t -67.5 -39.7 85.19 Favored 'General case' 0 N--CA 1.452 -0.346 0 C-N-CA 119.351 -0.94 . . . . 0.0 109.818 176.939 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 49' ' ' LEU . . . . . 0.467 ' HG ' HD22 ' A' ' 14' ' ' LEU . 53.4 tp -69.33 -35.48 75.98 Favored 'General case' 0 N--CA 1.449 -0.507 0 CA-C-O 119.162 -0.447 . . . . 0.0 111.832 -174.444 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 50' ' ' ILE . . . . . 0.472 HD12 HG12 ' A' ' 69' ' ' ILE . 3.9 pt -72.07 -44.68 65.36 Favored 'Isoleucine or valine' 0 C--N 1.34 0.163 0 CA-C-N 118.834 0.743 . . . . 0.0 110.855 178.032 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 30.9 pt -66.16 -39.06 83.35 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.141 0 C-N-CA 119.559 -0.856 . . . . 0.0 111.064 179.628 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 88.9 m-20 -64.86 -45.21 87.01 Favored 'General case' 0 N--CA 1.452 -0.338 0 CA-C-N 117.958 0.344 . . . . 0.0 110.749 178.959 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 53' ' ' TYR . . . . . 0.495 ' HB2' HD21 ' A' ' 14' ' ' LEU . 3.2 t80 -65.04 -34.79 79.27 Favored 'General case' 0 N--CA 1.456 -0.16 0 N-CA-C 109.326 -0.62 . . . . 0.0 109.326 175.867 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 28.7 t -62.37 -34.72 77.24 Favored 'General case' 0 N--CA 1.454 -0.261 0 CA-C-N 117.878 0.308 . . . . 0.0 111.082 -178.692 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 55' ' ' ARG . . . . . 0.431 ' NE ' ' HA ' ' A' ' 55' ' ' ARG . 11.8 mmp_? -75.42 -46.41 32.94 Favored 'General case' 0 C--N 1.34 0.183 0 CA-C-N 118.489 0.586 . . . . 0.0 111.525 177.709 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 30.5 mt -75.23 -41.25 57.98 Favored 'General case' 0 C--O 1.227 -0.085 0 N-CA-C 112.92 0.711 . . . . 0.0 112.92 -173.253 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 13.2 p -63.66 155.53 75.93 Favored Pre-proline 0 CA--C 1.535 0.391 0 N-CA-C 112.607 0.595 . . . . 0.0 112.607 -174.857 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 87.2 Cg_endo -74.57 173.04 15.0 Favored 'Trans proline' 0 N--CA 1.453 -0.876 0 C-N-CA 124.746 3.631 . . . . 0.0 111.668 -179.433 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -46.57 -52.8 12.71 Favored 'General case' 0 N--CA 1.452 -0.328 0 C-N-CA 125.407 1.483 . . . . 0.0 113.952 -170.744 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 95.1 p -68.14 -31.86 71.74 Favored 'General case' 0 N--CA 1.457 -0.089 0 O-C-N 121.915 -0.491 . . . . 0.0 110.111 -177.154 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 61' ' ' HIS . . . . . 0.422 ' CE1' ' HA ' ' A' ' 18' ' ' LYS . 37.0 m170 -75.34 -24.93 57.43 Favored 'General case' 0 N--CA 1.45 -0.431 0 N-CA-C 109.923 -0.399 . . . . 0.0 109.923 179.395 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 67.7 mttm -67.05 -40.4 87.14 Favored 'General case' 0 C--N 1.34 0.184 0 N-CA-C 109.246 -0.65 . . . . 0.0 109.246 173.292 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -60.79 -40.8 93.97 Favored 'General case' 0 CA--C 1.533 0.29 0 N-CA-C 108.458 -0.941 . . . . 0.0 108.458 175.548 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -67.62 -30.58 74.94 Favored Glycine 0 CA--C 1.528 0.876 0 N-CA-C 111.727 -0.549 . . . . 0.0 111.727 178.442 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 35.6 p -66.94 -35.12 79.27 Favored 'General case' 0 N--CA 1.456 -0.153 0 CA-C-N 117.805 0.803 . . . . 0.0 109.637 178.217 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 66' ' ' LEU . . . . . 0.434 HD21 ' CD2' ' A' ' 108' ' ' LEU . 43.0 mt -73.94 -30.51 62.59 Favored 'General case' 0 N--CA 1.453 -0.277 0 C-N-CA 122.346 0.258 . . . . 0.0 110.579 177.424 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 2.6 m-85 -68.93 -36.44 77.97 Favored 'General case' 0 CA--C 1.518 -0.265 0 CA-C-N 117.75 0.25 . . . . 0.0 110.776 176.577 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 68' ' ' ILE . . . . . 0.502 HD11 ' CE1' ' A' ' 17' ' ' PHE . 16.3 mt -69.51 -51.52 41.15 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.484 0 C-N-CA 119.631 -0.827 . . . . 0.0 108.776 178.536 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 69' ' ' ILE . . . . . 0.472 HG12 HD12 ' A' ' 50' ' ' ILE . 77.2 mt -48.47 -37.45 7.98 Favored 'Isoleucine or valine' 0 C--N 1.341 0.224 0 O-C-N 123.574 0.546 . . . . 0.0 111.161 172.355 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 19.9 t70 -70.9 -48.16 55.23 Favored 'General case' 0 C--O 1.233 0.202 0 CA-C-N 118.863 0.756 . . . . 0.0 111.096 179.418 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 30.8 t -65.11 -51.45 61.25 Favored 'General case' 0 N--CA 1.451 -0.404 0 C-N-CA 122.447 0.299 . . . . 0.0 111.251 -176.4 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 72' ' ' ILE . . . . . 0.422 HD11 ' CZ ' ' A' ' 76' ' ' TYR . 0.0 OUTLIER -75.82 -32.62 24.25 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.234 0 N-CA-C 109.89 -0.411 . . . . 0.0 109.89 -178.557 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -69.19 -46.49 57.56 Favored Glycine 0 CA--C 1.523 0.558 0 N-CA-C 111.419 -0.672 . . . . 0.0 111.419 -176.531 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 37.5 mtm105 -69.47 -42.01 75.41 Favored 'General case' 0 CA--C 1.515 -0.395 0 CA-C-N 117.694 0.747 . . . . 0.0 110.09 177.641 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -62.83 -31.32 72.31 Favored 'General case' 0 N--CA 1.448 -0.528 0 C-N-CA 119.996 -0.682 . . . . 0.0 110.306 -179.194 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 76' ' ' TYR . . . . . 0.422 ' CZ ' HD11 ' A' ' 72' ' ' ILE . 2.3 m-30 -72.29 -56.38 5.6 Favored 'General case' 0 CA--C 1.518 -0.281 0 CA-C-N 118.149 0.431 . . . . 0.0 111.065 175.428 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 53.8 tp -63.87 -40.88 97.58 Favored 'General case' 0 N--CA 1.447 -0.577 0 C-N-CA 117.885 -1.526 . . . . 0.0 109.948 -175.265 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 95.8 m-20 -60.69 -50.97 71.35 Favored 'General case' 0 N--CA 1.454 -0.24 0 CA-C-O 118.693 -0.67 . . . . 0.0 112.389 -179.843 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 68.0 mm-40 -72.52 -35.73 68.16 Favored 'General case' 0 N--CA 1.455 -0.196 0 CA-C-N 119.385 0.993 . . . . 0.0 112.078 -177.357 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 80.5 p -72.11 -30.63 65.26 Favored 'General case' 0 N--CA 1.451 -0.404 0 C-N-CA 120.18 -0.608 . . . . 0.0 110.579 179.493 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 7.4 ttm105 -82.71 -29.6 29.74 Favored 'General case' 0 CA--C 1.531 0.224 0 C-N-CA 123.649 0.78 . . . . 0.0 112.159 177.76 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 44.2 m . . . . . 0 CA--C 1.528 0.111 0 N-CA-C 112.645 0.609 . . . . 0.0 112.645 -179.102 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 82.1 Cg_endo . . . . . 0 N--CA 1.454 -0.809 0 N-CA-C 110.522 -0.607 . . . . 0.0 110.522 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 83.59 20.63 59.66 Favored Glycine 0 CA--C 1.526 0.773 0 CA-C-O 119.775 -0.458 . . . . 0.0 112.448 177.442 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -158.28 167.16 30.51 Favored 'General case' 0 N--CA 1.451 -0.392 0 C-N-CA 124.281 1.033 . . . . 0.0 109.528 179.94 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 94' ' ' CYS . . . . . 0.569 ' SG ' HD13 ' A' ' 98' ' ' ILE . 2.0 t -52.37 -28.06 18.07 Favored 'General case' 0 N--CA 1.454 -0.241 0 C-N-CA 123.82 0.848 . . . . 0.0 110.816 175.176 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -52.94 -62.57 1.57 Allowed 'General case' 0 N--CA 1.448 -0.548 0 O-C-N 122.497 -0.127 . . . . 0.0 111.086 -178.239 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 76.4 t60 -73.56 -32.98 64.45 Favored 'General case' 0 N--CA 1.453 -0.323 0 O-C-N 122.27 -0.269 . . . . 0.0 110.954 -178.308 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -64.04 -53.58 47.66 Favored 'General case' 0 N--CA 1.451 -0.397 0 O-C-N 122.934 0.147 . . . . 0.0 111.183 -177.252 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 98' ' ' ILE . . . . . 0.569 HD13 ' SG ' ' A' ' 94' ' ' CYS . 1.7 mp -69.88 -34.55 60.77 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.166 0 N-CA-C 109.83 -0.433 . . . . 0.0 109.83 -179.81 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 59.6 m-20 -62.07 -42.39 99.15 Favored 'General case' 0 N--CA 1.456 -0.168 0 O-C-N 122.163 -0.336 . . . . 0.0 110.6 178.102 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 98.0 m -64.23 -41.28 97.08 Favored 'General case' 0 N--CA 1.454 -0.249 0 N-CA-C 109.9 -0.407 . . . . 0.0 109.9 -178.653 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 90.8 mt -68.98 -24.1 64.2 Favored 'General case' 0 N--CA 1.452 -0.329 0 CA-C-N 116.426 -0.352 . . . . 0.0 111.389 179.882 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -73.73 -25.59 71.63 Favored Glycine 0 CA--C 1.527 0.833 0 CA-C-O 119.551 -0.583 . . . . 0.0 113.518 -178.212 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 74.1 mm-40 -81.08 -45.55 16.32 Favored 'General case' 0 N--CA 1.453 -0.294 0 CA-C-N 118.3 1.05 . . . . 0.0 111.996 179.35 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 18.1 m -85.26 6.69 2.19 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.14 0 C-N-CA 123.641 0.777 . . . . 0.0 111.097 -175.79 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 105' ' ' ILE . . . . . . . . . . . . . 9.7 tp -62.0 -37.0 77.25 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.354 0 C-N-CA 122.125 0.17 . . . . 0.0 110.795 -174.464 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 16.5 pt20 -76.05 -35.67 59.35 Favored 'General case' 0 N--CA 1.451 -0.404 0 CA-C-O 119.14 -0.457 . . . . 0.0 111.153 -177.231 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 59.3 mp0 -74.7 -39.36 61.99 Favored 'General case' 0 N--CA 1.451 -0.382 0 CA-C-N 118.814 0.734 . . . . 0.0 110.449 -179.684 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 108' ' ' LEU . . . . . 0.434 ' CD2' HD21 ' A' ' 66' ' ' LEU . 7.6 tt -73.5 -41.38 63.17 Favored 'General case' 0 N--CA 1.45 -0.475 0 CA-C-O 119.672 -0.204 . . . . 0.0 111.326 -174.774 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 9.6 mp -73.43 -49.9 24.53 Favored 'General case' 0 C--O 1.225 -0.203 0 C-N-CA 120.534 -0.466 . . . . 0.0 110.012 179.148 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 23.3 t -55.32 -39.47 70.0 Favored 'General case' 0 N--CA 1.454 -0.231 0 CA-C-N 118.334 0.515 . . . . 0.0 111.109 -177.452 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 36.9 t0 -62.4 -49.33 75.94 Favored 'General case' 0 N--CA 1.454 -0.264 0 N-CA-C 109.067 -0.716 . . . . 0.0 109.067 175.423 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -66.69 -35.72 80.8 Favored 'General case' 0 N--CA 1.446 -0.657 0 CA-C-O 119.031 -0.509 . . . . 0.0 112.097 -175.457 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 113' ' ' ILE . . . . . . . . . . . . . 20.6 mm -70.26 -40.71 78.28 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.213 0 CA-C-N 119.315 0.961 . . . . 0.0 110.209 -178.936 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -74.35 -40.38 62.19 Favored 'General case' 0 N--CA 1.451 -0.377 0 C-N-CA 121.288 -0.165 . . . . 0.0 111.385 -179.421 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 115' ' ' LYS . . . . . 0.614 ' HE2' ' HA ' ' A' ' 115' ' ' LYS . 0.6 OUTLIER -75.58 -39.31 58.25 Favored 'General case' 0 N--CA 1.449 -0.485 0 N-CA-C 113.341 0.867 . . . . 0.0 113.341 -178.516 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 116' ' ' SER . . . . . 0.477 ' HB2' ' CB ' ' A' ' 120' ' ' HIS . 44.4 p -80.5 161.3 24.91 Favored 'General case' 0 N--CA 1.455 -0.198 0 N-CA-C 112.425 0.528 . . . . 0.0 112.425 -172.52 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 22.6 m120 -88.64 178.02 6.61 Favored 'General case' 0 C--O 1.227 -0.1 0 C-N-CA 123.435 0.694 . . . . 0.0 112.59 -177.367 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 118' ' ' GLN . . . . . . . . . . . . . 12.2 pt20 -49.21 -55.09 13.65 Favored 'General case' 0 N--CA 1.456 -0.128 0 C-N-CA 123.633 0.773 . . . . 0.0 112.937 -177.661 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 21.9 t70 -56.59 -33.98 66.75 Favored 'General case' 0 C--O 1.23 0.052 0 CA-C-N 118.451 0.569 . . . . 0.0 110.104 -179.993 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 120' ' ' HIS . . . . . 0.477 ' CB ' ' HB2' ' A' ' 116' ' ' SER . 15.9 m170 -75.05 -41.41 59.17 Favored 'General case' 0 N--CA 1.449 -0.489 0 N-CA-C 109.932 -0.395 . . . . 0.0 109.932 -177.571 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 62.1 mttp -58.08 -37.97 75.48 Favored 'General case' 0 N--CA 1.455 -0.202 0 N-CA-C 110.228 -0.286 . . . . 0.0 110.228 179.88 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 81.6 mm-40 -68.86 -46.24 69.0 Favored 'General case' 0 N--CA 1.449 -0.486 0 C-N-CA 122.72 0.408 . . . . 0.0 110.299 179.033 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 97.4 mttt -64.55 -31.33 72.5 Favored 'General case' 0 N--CA 1.453 -0.307 0 CA-C-N 115.75 -0.659 . . . . 0.0 111.07 -178.698 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 124' ' ' ILE . . . . . . . . . . . . . 58.4 mt -75.62 -38.47 38.4 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.242 0 O-C-N 121.791 -0.568 . . . . 0.0 110.132 176.761 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 22.9 mtp180 -67.49 -33.11 74.44 Favored 'General case' 0 N--CA 1.453 -0.277 0 N-CA-C 112.385 0.513 . . . . 0.0 112.385 178.14 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 126' ' ' MET . . . . . . . . . . . . . 28.1 ptm -72.5 -33.82 67.2 Favored 'General case' 0 N--CA 1.455 -0.207 0 C-N-CA 119.489 -0.884 . . . . 0.0 108.686 174.328 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 2.6 mp -63.33 -38.23 90.34 Favored 'General case' 0 C--N 1.34 0.163 0 N-CA-C 109.896 -0.409 . . . . 0.0 109.896 175.19 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 57.4 tp -64.24 -42.62 96.45 Favored 'General case' 0 N--CA 1.453 -0.285 0 CA-C-N 117.747 0.249 . . . . 0.0 110.335 179.614 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 18.9 t0 -63.82 -46.64 84.19 Favored 'General case' 0 N--CA 1.455 -0.178 0 N-CA-C 109.855 -0.424 . . . . 0.0 109.855 177.697 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 54.8 mt -56.37 -35.81 44.72 Favored 'Isoleucine or valine' 0 C--O 1.235 0.296 0 N-CA-C 110.257 -0.275 . . . . 0.0 110.257 179.931 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 131' ' ' TRP . . . . . . . . . . . . . 47.6 m0 . . . . . 0 N--CA 1.45 -0.462 0 N-CA-C 112.635 0.606 . . . . 0.0 112.635 -179.536 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 31.3 p-10 . . . . . 0 N--CA 1.454 -0.256 0 N-CA-C 110.283 -0.265 . . . . 0.0 110.283 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 7' ' ' PHE . . . . . 0.514 ' CD1' ' HD3' ' A' ' 45' ' ' LYS . 1.3 t80 -57.28 -41.84 80.53 Favored 'General case' 0 N--CA 1.451 -0.376 0 C-N-CA 123.496 0.718 . . . . 0.0 111.714 -179.658 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 46.1 tp60 -53.73 -33.94 57.27 Favored 'General case' 0 N--CA 1.456 -0.127 0 C-N-CA 122.777 0.431 . . . . 0.0 111.653 -176.537 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 18.8 m-80 -70.92 -31.12 67.63 Favored 'General case' 0 N--CA 1.451 -0.398 0 N-CA-C 109.944 -0.391 . . . . 0.0 109.944 -179.964 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 10' ' ' PHE . . . . . 0.467 ' CE2' ' HB2' ' A' ' 32' ' ' LEU . 10.9 t80 -71.54 -39.02 70.97 Favored 'General case' 0 N--CA 1.452 -0.343 0 N-CA-C 109.419 -0.586 . . . . 0.0 109.419 176.189 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 57.5 t -63.15 -55.83 21.01 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.359 0 N-CA-C 109.18 -0.674 . . . . 0.0 109.18 179.059 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -60.24 -29.22 68.62 Favored 'General case' 0 N--CA 1.453 -0.291 0 C-N-CA 123.277 0.631 . . . . 0.0 112.161 -179.922 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 99.9 m -72.62 -39.74 67.02 Favored 'General case' 0 CA--C 1.53 0.211 0 CA-C-N 118.904 0.775 . . . . 0.0 109.403 177.268 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.485 ' HA ' ' CD1' ' A' ' 17' ' ' PHE . 14.2 tp -65.23 -46.71 79.51 Favored 'General case' 0 N--CA 1.454 -0.233 0 CA-C-O 121.644 0.735 . . . . 0.0 109.467 178.192 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 69.0 mm-40 -63.4 -29.58 70.85 Favored 'General case' 0 N--CA 1.45 -0.443 0 C-N-CA 124.136 0.974 . . . . 0.0 110.048 178.898 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 42.3 t -69.46 -32.24 71.04 Favored 'General case' 0 N--CA 1.452 -0.336 0 N-CA-C 109.679 -0.489 . . . . 0.0 109.679 177.375 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 17' ' ' PHE . . . . . 0.485 ' CD1' ' HA ' ' A' ' 14' ' ' LEU . 19.7 m-85 -63.61 -42.05 98.25 Favored 'General case' 0 N--CA 1.454 -0.25 0 C-N-CA 119.388 -0.925 . . . . 0.0 109.604 172.559 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 67.1 mttt -61.82 -28.54 69.55 Favored 'General case' 0 C--N 1.341 0.2 0 O-C-N 122.985 0.178 . . . . 0.0 110.833 -178.776 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 54.5 t0 -73.95 -43.62 57.63 Favored 'General case' 0 N--CA 1.455 -0.177 0 O-C-N 123.48 0.488 . . . . 0.0 111.019 178.829 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 20' ' ' LEU . . . . . 0.442 HD12 ' HB2' ' A' ' 25' ' ' SER . 63.6 mt -57.82 144.13 39.75 Favored 'General case' 0 N--CA 1.454 -0.228 0 O-C-N 122.048 -0.408 . . . . 0.0 111.073 -177.157 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -83.7 -22.86 31.92 Favored 'General case' 0 N--CA 1.453 -0.323 0 N-CA-C 109.652 -0.499 . . . . 0.0 109.652 177.001 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 22' ' ' SER . . . . . 0.418 ' C ' ' H ' ' A' ' 24' ' ' ILE . 68.8 m -75.36 -24.09 57.26 Favored 'General case' 0 N--CA 1.456 -0.148 0 N-CA-C 109.832 -0.433 . . . . 0.0 109.832 170.335 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 70.64 -31.69 0.48 Allowed Glycine 0 CA--C 1.527 0.799 0 C-N-CA 124.883 1.23 . . . . 0.0 112.103 179.689 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 24' ' ' ILE . . . . . 0.418 ' H ' ' C ' ' A' ' 22' ' ' SER . 47.2 mt -87.23 154.95 3.28 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.523 0 C-N-CA 123.801 0.841 . . . . 0.0 109.143 173.881 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 25' ' ' SER . . . . . 0.442 ' HB2' HD12 ' A' ' 20' ' ' LEU . 32.7 t -158.29 81.46 0.83 Allowed 'General case' 0 CA--C 1.517 -0.319 0 N-CA-C 109.886 -0.413 . . . . 0.0 109.886 177.82 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -50.58 -33.01 25.13 Favored Glycine 0 CA--C 1.529 0.927 0 CA-C-O 119.499 -0.612 . . . . 0.0 112.43 -175.442 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 40.3 t -73.13 -52.39 14.38 Favored 'General case' 0 N--CA 1.453 -0.298 0 CA-C-N 118.205 1.003 . . . . 0.0 110.771 -179.709 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 82.6 mtt85 -69.88 -31.74 69.71 Favored 'General case' 0 C--N 1.34 0.189 0 CA-C-N 117.544 0.156 . . . . 0.0 110.681 -177.491 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 53.0 mt -59.77 -45.81 94.28 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.724 0 N-CA-C 108.164 -1.05 . . . . 0.0 108.164 174.423 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 33.5 mtmm -68.22 -23.32 64.8 Favored 'General case' 0 N--CA 1.454 -0.234 0 CA-C-O 118.606 -0.711 . . . . 0.0 111.869 177.06 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 31' ' ' LYS . . . . . 0.413 ' HA ' ' HE3' ' A' ' 31' ' ' LYS . 0.0 OUTLIER -65.04 -59.4 4.19 Favored 'General case' 0 C--N 1.341 0.197 0 CA-C-N 119.341 0.973 . . . . 0.0 110.281 177.777 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.487 HD12 ' N ' ' A' ' 33' ' ' THR . 1.2 pp -75.29 -17.94 60.17 Favored 'General case' 0 CA--C 1.531 0.245 0 C-N-CA 119.47 -0.892 . . . . 0.0 112.068 -177.271 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 33' ' ' THR . . . . . 0.487 ' N ' HD12 ' A' ' 32' ' ' LEU . 55.2 m -72.66 -38.75 67.55 Favored 'General case' 0 N--CA 1.457 -0.123 0 N-CA-C 108.898 -0.779 . . . . 0.0 108.898 175.684 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 98.8 m -70.4 -37.4 74.46 Favored 'General case' 0 N--CA 1.453 -0.321 0 N-CA-C 109.861 -0.422 . . . . 0.0 109.861 179.995 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 19.8 t80 -61.64 -38.26 87.05 Favored 'General case' 0 C--N 1.34 0.159 0 N-CA-C 109.962 -0.385 . . . . 0.0 109.962 175.359 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -68.07 -37.54 81.38 Favored 'General case' 0 N--CA 1.447 -0.621 0 CA-C-N 116.791 -0.186 . . . . 0.0 110.945 -179.331 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 3.2 mm? -71.05 -35.97 72.15 Favored 'General case' 0 CA--C 1.522 -0.114 0 C-N-CA 122.096 0.158 . . . . 0.0 110.948 -179.369 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 41.5 t0 -72.86 -14.62 61.53 Favored 'General case' 0 N--CA 1.452 -0.337 0 C-N-CA 122.472 0.309 . . . . 0.0 110.588 177.238 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 96.6 m-70 -151.52 88.99 1.45 Allowed 'General case' 0 CA--C 1.53 0.192 0 C-N-CA 122.935 0.494 . . . . 0.0 111.411 -173.897 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -75.42 -12.71 14.88 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.232 0 O-C-N 122.023 -0.423 . . . . 0.0 111.024 175.707 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -57.24 -24.38 54.33 Favored 'General case' 0 C--O 1.228 -0.045 0 C-N-CA 123.34 0.656 . . . . 0.0 111.762 -176.404 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -106.98 18.63 5.77 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.24 0 C-N-CA 123.291 0.637 . . . . 0.0 112.58 178.768 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 3.0 pp20? -54.0 -28.61 39.03 Favored 'General case' 0 CA--C 1.528 0.129 0 CA-C-N 118.723 0.692 . . . . 0.0 111.7 177.848 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 29.6 t -65.39 -46.14 81.27 Favored 'General case' 0 N--CA 1.452 -0.335 0 O-C-N 122.384 -0.198 . . . . 0.0 110.936 -176.199 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 45' ' ' LYS . . . . . 0.514 ' HD3' ' CD1' ' A' ' 7' ' ' PHE . 19.2 ptpt -74.69 -26.9 60.15 Favored 'General case' 0 C--N 1.339 0.13 0 N-CA-C 109.566 -0.531 . . . . 0.0 109.566 177.908 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 61.0 mt -68.63 -48.8 69.88 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.228 0 N-CA-C 109.823 -0.436 . . . . 0.0 109.823 -179.036 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 47' ' ' ILE . . . . . 0.435 HD13 HD11 ' A' ' 50' ' ' ILE . 35.4 mm -63.84 -38.25 81.86 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.249 0 N-CA-C 109.065 -0.717 . . . . 0.0 109.065 176.944 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 49.8 m -63.33 -42.64 98.99 Favored 'General case' 0 CA--C 1.531 0.23 0 C-N-CA 120.82 -0.352 . . . . 0.0 111.5 -178.345 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 6.9 mp -73.51 -36.35 65.72 Favored 'General case' 0 N--CA 1.453 -0.276 0 N-CA-C 112.652 0.612 . . . . 0.0 112.652 -176.332 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 50' ' ' ILE . . . . . 0.468 HD12 HG12 ' A' ' 69' ' ' ILE . 5.5 pt -71.63 -44.4 69.76 Favored 'Isoleucine or valine' 0 C--N 1.34 0.169 0 CA-C-N 119.352 0.978 . . . . 0.0 110.846 -178.55 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 51' ' ' ILE . . . . . 0.526 HG22 HD11 ' A' ' 108' ' ' LEU . 16.2 pt -66.12 -38.04 81.1 Favored 'Isoleucine or valine' 0 C--N 1.335 -0.055 0 C-N-CA 120.192 -0.603 . . . . 0.0 110.785 -179.783 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 90.7 m-20 -70.86 -41.07 71.9 Favored 'General case' 0 N--CA 1.454 -0.274 0 CA-C-N 118.107 0.412 . . . . 0.0 111.756 178.365 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 18.8 t80 -63.61 -41.3 98.32 Favored 'General case' 0 N--CA 1.455 -0.182 0 N-CA-C 109.081 -0.711 . . . . 0.0 109.081 175.93 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 23.3 t -62.25 -38.91 91.05 Favored 'General case' 0 N--CA 1.45 -0.462 0 C-N-CA 122.437 0.295 . . . . 0.0 111.435 -176.64 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 55.6 mtm180 -75.12 -40.88 59.47 Favored 'General case' 0 N--CA 1.456 -0.156 0 N-CA-C 111.913 0.338 . . . . 0.0 111.913 -177.239 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 48.7 mt -80.46 -44.52 19.1 Favored 'General case' 0 N--CA 1.455 -0.206 0 N-CA-C 113.221 0.823 . . . . 0.0 113.221 -176.023 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 14.5 p -62.68 159.45 43.58 Favored Pre-proline 0 CA--C 1.535 0.382 0 N-CA-C 114.241 1.2 . . . . 0.0 114.241 -170.701 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 35.9 Cg_exo -58.79 -179.51 0.15 Allowed 'Trans proline' 0 N--CA 1.454 -0.822 1 C-N-CA 125.758 4.306 . . . . 0.0 113.746 174.423 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 42.3 p-10 -66.4 -42.65 87.52 Favored 'General case' 0 CA--C 1.533 0.298 0 C-N-CA 124.534 1.134 . . . . 0.0 113.364 -175.013 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 39.8 m -72.75 -37.03 67.81 Favored 'General case' 0 N--CA 1.455 -0.189 0 O-C-N 121.773 -0.58 . . . . 0.0 109.762 179.74 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 55.4 m80 -69.02 -27.87 66.06 Favored 'General case' 0 N--CA 1.45 -0.425 0 CA-C-N 116.176 -0.465 . . . . 0.0 109.867 176.025 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 62' ' ' LYS . . . . . 0.487 ' HE3' ' HB2' ' A' ' 112' ' ' ALA . 56.4 tptt -65.88 -45.39 82.24 Favored 'General case' 0 C--N 1.338 0.108 0 C-N-CA 122.623 0.369 . . . . 0.0 110.025 177.877 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 63' ' ' LEU . . . . . 0.515 HD12 ' CD2' ' A' ' 120' ' ' HIS . 0.3 OUTLIER -61.29 -41.94 97.82 Favored 'General case' 0 N--CA 1.455 -0.213 0 N-CA-C 108.458 -0.941 . . . . 0.0 108.458 177.641 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -65.22 -29.26 74.87 Favored Glycine 0 CA--C 1.527 0.791 0 N-CA-C 111.964 -0.454 . . . . 0.0 111.964 178.554 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 37.0 p -68.7 -37.1 79.26 Favored 'General case' 0 N--CA 1.451 -0.375 0 CA-C-N 117.931 0.866 . . . . 0.0 110.062 178.462 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 95.1 mt -75.32 -24.81 57.47 Favored 'General case' 0 N--CA 1.452 -0.338 0 CA-C-N 116.596 -0.275 . . . . 0.0 110.726 178.98 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 9.6 m-30 -70.69 -36.01 73.08 Favored 'General case' 0 CA--C 1.515 -0.374 0 CA-C-N 118.338 0.517 . . . . 0.0 110.422 174.007 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 68' ' ' ILE . . . . . 0.472 HD11 ' CE1' ' A' ' 17' ' ' PHE . 22.0 mt -68.29 -54.3 22.76 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.621 0 N-CA-C 107.448 -1.315 . . . . 0.0 107.448 177.69 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 69' ' ' ILE . . . . . 0.468 HG12 HD12 ' A' ' 50' ' ' ILE . 65.5 mt -50.39 -37.14 14.28 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.174 0 C-N-CA 123.885 0.874 . . . . 0.0 111.802 175.021 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 8.8 t70 -71.06 -54.85 9.71 Favored 'General case' 0 CA--C 1.521 -0.147 0 CA-C-N 118.819 0.736 . . . . 0.0 111.487 -179.737 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 53.6 p -66.87 -44.26 81.4 Favored 'General case' 0 N--CA 1.452 -0.373 0 O-C-N 123.161 0.288 . . . . 0.0 110.499 -175.25 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -75.13 -36.65 38.22 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.246 0 N-CA-C 109.629 -0.508 . . . . 0.0 109.629 179.731 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -67.09 -46.15 75.32 Favored Glycine 0 C--N 1.337 0.622 0 N-CA-C 111.417 -0.673 . . . . 0.0 111.417 -175.351 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 39.0 mtm105 -69.81 -42.61 73.47 Favored 'General case' 0 CA--C 1.517 -0.309 0 CA-C-N 117.37 0.585 . . . . 0.0 109.906 177.913 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -64.83 -33.88 77.05 Favored 'General case' 0 N--CA 1.45 -0.432 0 CA-C-O 119.335 -0.364 . . . . 0.0 110.918 -178.191 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 1.0 OUTLIER -68.18 -45.45 73.4 Favored 'General case' 0 CA--C 1.519 -0.241 0 CA-C-N 118.571 0.623 . . . . 0.0 110.929 177.076 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 77' ' ' LEU . . . . . 0.436 ' HA ' ' SG ' ' A' ' 94' ' ' CYS . 6.5 tt -66.62 -48.17 70.33 Favored 'General case' 0 N--CA 1.447 -0.596 0 C-N-CA 118.249 -1.381 . . . . 0.0 108.24 -178.266 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 90.4 m-20 -54.19 -44.96 72.0 Favored 'General case' 0 C--O 1.228 -0.079 0 N-CA-C 112.864 0.69 . . . . 0.0 112.864 177.979 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 15.5 tm-20 -61.53 -50.2 73.64 Favored 'General case' 0 N--CA 1.448 -0.548 0 CA-C-N 117.878 0.308 . . . . 0.0 111.117 -177.752 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 80' ' ' THR . . . . . 0.625 HG21 ' HB3' ' A' ' 94' ' ' CYS . 31.6 p -72.82 -26.88 61.65 Favored 'General case' 0 N--CA 1.453 -0.276 0 C-N-CA 120.477 -0.489 . . . . 0.0 110.412 -178.12 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 33.2 ttp180 -70.4 -23.7 62.8 Favored 'General case' 0 N--CA 1.45 -0.448 0 C-N-CA 123.676 0.79 . . . . 0.0 111.061 175.022 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 34.0 t . . . . . 0 N--CA 1.454 -0.262 0 N-CA-C 113.14 0.793 . . . . 0.0 113.14 -179.13 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 31.5 Cg_exo . . . . . 0 N--CA 1.447 -1.211 0 N-CA-C 108.209 -1.496 . . . . 0.0 108.209 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 90.68 16.57 54.6 Favored Glycine 0 CA--C 1.526 0.766 0 CA-C-O 119.369 -0.684 . . . . 0.0 112.28 -176.756 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 78.0 p -151.2 172.17 16.25 Favored 'General case' 0 N--CA 1.455 -0.213 0 CA-C-N 118.05 0.925 . . . . 0.0 111.349 176.307 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 94' ' ' CYS . . . . . 0.625 ' HB3' HG21 ' A' ' 80' ' ' THR . 5.3 t -57.03 -27.21 61.44 Favored 'General case' 0 N--CA 1.451 -0.422 0 CA-C-N 115.196 -0.911 . . . . 0.0 109.91 173.376 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -56.11 -59.25 5.19 Favored 'General case' 0 N--CA 1.446 -0.653 0 N-CA-C 109.384 -0.599 . . . . 0.0 109.384 -176.189 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 73.6 t60 -74.59 -34.44 62.87 Favored 'General case' 0 N--CA 1.45 -0.472 0 CA-C-N 116.36 -0.382 . . . . 0.0 111.419 -179.152 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -64.93 -50.67 65.55 Favored 'General case' 0 N--CA 1.454 -0.261 0 O-C-N 122.969 0.168 . . . . 0.0 111.356 -177.145 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 98' ' ' ILE . . . . . 0.593 HD13 ' SG ' ' A' ' 94' ' ' CYS . 1.7 mp -73.61 -32.31 35.31 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.207 0 N-CA-C 110.033 -0.358 . . . . 0.0 110.033 -178.32 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 30.2 m-20 -67.11 -45.24 77.79 Favored 'General case' 0 N--CA 1.453 -0.306 0 CA-C-N 118.062 0.392 . . . . 0.0 111.101 176.838 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 95.9 m -70.67 -33.64 71.16 Favored 'General case' 0 N--CA 1.457 -0.12 0 CA-C-N 117.947 0.339 . . . . 0.0 110.497 -177.109 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 68.4 tp -73.58 -30.39 62.99 Favored 'General case' 0 N--CA 1.451 -0.408 0 C-N-CA 122.661 0.385 . . . . 0.0 110.946 -179.104 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -70.09 -19.84 75.91 Favored Glycine 0 CA--C 1.529 0.922 0 CA-C-O 119.555 -0.581 . . . . 0.0 112.828 -176.998 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 14.6 mm-40 -80.23 -39.46 29.01 Favored 'General case' 0 C--O 1.231 0.125 0 CA-C-N 118.008 0.904 . . . . 0.0 111.381 179.998 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 30.3 m -97.87 -8.87 9.09 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.158 0 N-CA-C 113.177 0.806 . . . . 0.0 113.177 -173.868 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 105' ' ' ILE . . . . . . . . . . . . . 10.6 tp -57.15 -26.78 26.09 Favored 'Isoleucine or valine' 0 CA--C 1.528 0.124 0 CA-C-N 119.162 0.892 . . . . 0.0 111.655 -176.716 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 25.4 pt20 -67.48 -30.04 69.64 Favored 'General case' 0 N--CA 1.454 -0.267 0 O-C-N 122.182 -0.324 . . . . 0.0 110.523 178.852 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 66.5 mt-10 -73.98 -41.6 61.68 Favored 'General case' 0 N--CA 1.455 -0.201 0 N-CA-C 108.795 -0.817 . . . . 0.0 108.795 177.315 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 108' ' ' LEU . . . . . 0.526 HD11 HG22 ' A' ' 51' ' ' ILE . 41.1 mt -68.65 -42.73 77.53 Favored 'General case' 0 N--CA 1.449 -0.505 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.573 -174.348 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 95.9 mt -72.61 -47.1 50.58 Favored 'General case' 0 N--CA 1.451 -0.416 0 CA-C-O 119.01 -0.519 . . . . 0.0 111.319 -179.033 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 44.6 t -61.89 -41.19 97.58 Favored 'General case' 0 C--O 1.233 0.204 0 CA-C-N 118.849 0.75 . . . . 0.0 110.684 -179.295 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 22.6 t0 -59.25 -40.26 85.43 Favored 'General case' 0 N--CA 1.453 -0.289 0 N-CA-C 108.469 -0.937 . . . . 0.0 108.469 174.7 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 112' ' ' ALA . . . . . 0.487 ' HB2' ' HE3' ' A' ' 62' ' ' LYS . . . -69.33 -38.75 78.32 Favored 'General case' 0 N--CA 1.443 -0.779 0 C-N-CA 120.603 -0.439 . . . . 0.0 111.138 -175.768 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 113' ' ' ILE . . . . . 0.45 ' O ' ' HE2' ' A' ' 121' ' ' LYS . 36.6 mm -66.21 -42.37 90.92 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.473 0 C-N-CA 118.809 -1.156 . . . . 0.0 109.739 -178.276 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -71.96 -46.86 55.9 Favored 'General case' 0 N--CA 1.451 -0.422 0 N-CA-C 111.555 0.205 . . . . 0.0 111.555 -178.899 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 33.1 ttpt -76.77 -37.25 56.22 Favored 'General case' 0 N--CA 1.451 -0.384 0 N-CA-C 113.497 0.925 . . . . 0.0 113.497 -175.405 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 116' ' ' SER . . . . . 0.488 ' HB2' ' CB ' ' A' ' 120' ' ' HIS . 24.4 p -76.54 159.82 30.0 Favored 'General case' 0 CA--C 1.527 0.095 0 N-CA-C 112.605 0.595 . . . . 0.0 112.605 -170.678 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 11.6 m120 -76.68 168.4 20.15 Favored 'General case' 0 CA--C 1.519 -0.236 0 C-N-CA 123.227 0.611 . . . . 0.0 111.851 -179.719 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 118' ' ' GLN . . . . . . . . . . . . . 12.7 mm100 -53.75 -42.23 67.96 Favored 'General case' 0 C--O 1.233 0.216 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.559 -178.394 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 18.4 t0 -66.67 -32.73 74.23 Favored 'General case' 0 N--CA 1.456 -0.164 0 N-CA-C 109.303 -0.628 . . . . 0.0 109.303 -179.622 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 120' ' ' HIS . . . . . 0.515 ' CD2' HD12 ' A' ' 63' ' ' LEU . 20.8 m170 -76.05 -40.38 53.48 Favored 'General case' 0 N--CA 1.449 -0.491 0 CA-C-N 116.002 -0.544 . . . . 0.0 110.073 -178.859 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 121' ' ' LYS . . . . . 0.45 ' HE2' ' O ' ' A' ' 113' ' ' ILE . 96.0 mttt -54.98 -41.04 70.69 Favored 'General case' 0 C--N 1.339 0.118 0 N-CA-C 108.222 -1.029 . . . . 0.0 108.222 177.932 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 46.0 tp10 -70.63 -39.31 73.79 Favored 'General case' 0 CA--C 1.53 0.178 0 N-CA-C 111.467 0.173 . . . . 0.0 111.467 178.222 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 92.0 mttt -71.36 -26.43 62.8 Favored 'General case' 0 N--CA 1.452 -0.335 0 O-C-N 121.835 -0.541 . . . . 0.0 110.827 -179.266 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 124' ' ' ILE . . . . . . . . . . . . . 69.1 mt -69.99 -40.25 78.37 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.244 0 N-CA-C 108.653 -0.869 . . . . 0.0 108.653 174.233 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 125' ' ' ARG . . . . . 0.446 HH11 ' HA ' ' A' ' 125' ' ' ARG . 6.6 mmm180 -61.28 -48.41 81.53 Favored 'General case' 0 N--CA 1.45 -0.433 0 CA-C-O 118.899 -0.572 . . . . 0.0 111.518 179.269 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 126' ' ' MET . . . . . . . . . . . . . 28.7 ptm -62.96 -30.11 71.33 Favored 'General case' 0 N--CA 1.453 -0.284 0 C-N-CA 119.183 -1.007 . . . . 0.0 109.299 179.217 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 1.2 mp -62.44 -39.29 92.86 Favored 'General case' 0 C--N 1.339 0.146 0 CA-C-N 118.187 0.449 . . . . 0.0 111.037 175.957 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 80.8 mt -72.72 -36.76 67.87 Favored 'General case' 0 N--CA 1.455 -0.223 0 CA-C-N 118.488 0.586 . . . . 0.0 110.127 179.614 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 15.1 m-20 -65.71 -35.84 81.91 Favored 'General case' 0 N--CA 1.454 -0.274 0 N-CA-C 109.351 -0.611 . . . . 0.0 109.351 176.624 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 35.7 mt -63.62 -36.43 76.41 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.229 0 C-N-CA 122.487 0.315 . . . . 0.0 110.212 176.423 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 131' ' ' TRP . . . . . . . . . . . . . 46.4 m0 . . . . . 0 N--CA 1.449 -0.481 0 N-CA-C 112.899 0.703 . . . . 0.0 112.899 179.54 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 22.4 p-10 . . . . . 0 N--CA 1.457 -0.076 0 CA-C-O 121.275 0.559 . . . . 0.0 109.602 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 7' ' ' PHE . . . . . 0.499 ' CE1' ' HD3' ' A' ' 45' ' ' LYS . 1.4 t80 -55.28 -34.72 64.34 Favored 'General case' 0 N--CA 1.447 -0.59 0 C-N-CA 125.007 1.323 . . . . 0.0 111.022 -178.314 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 50.8 tp60 -53.68 -34.82 59.99 Favored 'General case' 0 N--CA 1.454 -0.262 0 C-N-CA 123.448 0.699 . . . . 0.0 112.059 -177.189 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 27.9 m-80 -72.3 -33.36 67.34 Favored 'General case' 0 N--CA 1.453 -0.311 0 N-CA-C 110.052 -0.351 . . . . 0.0 110.052 -179.529 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 10' ' ' PHE . . . . . 0.512 ' CZ ' HG12 ' A' ' 46' ' ' ILE . 6.4 t80 -70.19 -39.39 75.23 Favored 'General case' 0 N--CA 1.45 -0.439 0 N-CA-C 108.794 -0.817 . . . . 0.0 108.794 176.18 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 88.3 t -65.89 -53.38 38.62 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.271 0 N-CA-C 109.163 -0.68 . . . . 0.0 109.163 179.054 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -58.2 -30.62 66.61 Favored 'General case' 0 N--CA 1.455 -0.221 0 C-N-CA 122.716 0.406 . . . . 0.0 111.305 -179.312 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 91.4 m -71.13 -40.36 71.44 Favored 'General case' 0 N--CA 1.453 -0.325 0 N-CA-C 109.131 -0.692 . . . . 0.0 109.131 176.213 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.46 ' HA ' ' CD1' ' A' ' 17' ' ' PHE . 8.2 tp -65.9 -41.55 91.33 Favored 'General case' 0 N--CA 1.449 -0.476 0 CA-C-O 121.416 0.627 . . . . 0.0 109.869 179.473 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 73.2 mm-40 -63.81 -27.96 69.54 Favored 'General case' 0 N--CA 1.448 -0.545 0 C-N-CA 124.133 0.973 . . . . 0.0 109.949 177.931 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 51.0 m -69.78 -30.65 68.27 Favored 'General case' 0 N--CA 1.453 -0.29 0 N-CA-C 109.74 -0.467 . . . . 0.0 109.74 176.474 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 17' ' ' PHE . . . . . 0.557 ' CD1' HD11 ' A' ' 68' ' ' ILE . 33.6 m-85 -69.98 -33.16 71.69 Favored 'General case' 0 C--N 1.339 0.137 0 C-N-CA 119.469 -0.892 . . . . 0.0 111.065 171.982 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 18' ' ' LYS . . . . . 0.475 ' HG2' ' CE1' ' A' ' 53' ' ' TYR . 70.0 mttt -67.37 -24.18 65.67 Favored 'General case' 0 N--CA 1.462 0.152 0 CA-C-O 120.918 0.389 . . . . 0.0 110.496 174.739 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 31.2 t0 -79.37 -46.35 17.8 Favored 'General case' 0 C--N 1.334 -0.075 0 CA-C-N 116.521 -0.309 . . . . 0.0 110.653 175.469 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 20' ' ' LEU . . . . . 0.43 HD12 ' HA ' ' A' ' 17' ' ' PHE . 13.5 mt -54.63 126.67 24.77 Favored 'General case' 0 N--CA 1.457 -0.112 0 CA-C-O 120.894 0.378 . . . . 0.0 111.556 -176.666 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 1.2 mppt? -74.06 -23.28 59.35 Favored 'General case' 0 N--CA 1.456 -0.168 0 N-CA-C 108.988 -0.745 . . . . 0.0 108.988 175.194 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 34.6 m -82.67 -20.89 35.32 Favored 'General case' 0 N--CA 1.455 -0.184 0 C-N-CA 122.923 0.489 . . . . 0.0 110.637 174.916 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 72.21 -42.52 0.8 Allowed Glycine 0 CA--C 1.527 0.829 0 C-N-CA 124.982 1.277 . . . . 0.0 111.831 -177.168 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 84.1 mt -75.52 149.43 6.95 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.392 0 C-N-CA 123.995 0.918 . . . . 0.0 111.109 177.911 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 31.2 t -167.18 93.31 0.43 Allowed 'General case' 0 CA--C 1.518 -0.281 0 N-CA-C 108.847 -0.797 . . . . 0.0 108.847 169.791 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 26' ' ' GLY . . . . . 0.42 ' O ' ' HE2' ' A' ' 30' ' ' LYS . . . -55.23 -35.51 60.43 Favored Glycine 0 C--N 1.332 0.349 0 N-CA-C 110.709 -0.956 . . . . 0.0 110.709 -176.834 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 30.3 t -61.83 -53.15 59.85 Favored 'General case' 0 N--CA 1.449 -0.494 0 N-CA-C 109.752 -0.462 . . . . 0.0 109.752 -179.153 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 82.5 mmt-85 -68.87 -40.6 79.2 Favored 'General case' 0 C--O 1.231 0.123 0 C-N-CA 122.941 0.496 . . . . 0.0 110.417 -179.446 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 65.6 mt -57.37 -45.13 85.32 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.657 0 N-CA-C 108.559 -0.904 . . . . 0.0 108.559 177.931 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 30' ' ' LYS . . . . . 0.42 ' HE2' ' O ' ' A' ' 26' ' ' GLY . 51.0 mtmt -68.52 -27.27 65.96 Favored 'General case' 0 N--CA 1.456 -0.132 0 CA-C-O 118.65 -0.691 . . . . 0.0 111.51 179.531 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 31' ' ' LYS . . . . . 0.425 ' HA ' ' HE3' ' A' ' 31' ' ' LYS . 0.0 OUTLIER -63.59 -59.61 4.4 Favored 'General case' 0 C--N 1.341 0.232 0 CA-C-N 119.131 0.878 . . . . 0.0 110.163 177.299 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.503 HD12 ' N ' ' A' ' 33' ' ' THR . 1.6 pp -75.67 -19.22 59.29 Favored 'General case' 0 CA--C 1.532 0.28 0 C-N-CA 119.263 -0.975 . . . . 0.0 111.64 -176.924 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 33' ' ' THR . . . . . 0.503 ' N ' HD12 ' A' ' 32' ' ' LEU . 21.4 m -69.61 -42.93 73.71 Favored 'General case' 0 CA--C 1.52 -0.174 0 N-CA-C 108.845 -0.798 . . . . 0.0 108.845 175.927 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 87.4 m -72.1 -41.54 67.18 Favored 'General case' 0 N--CA 1.448 -0.552 0 CA-C-N 116.482 -0.326 . . . . 0.0 110.374 -175.995 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 58.3 t80 -63.98 -31.34 72.49 Favored 'General case' 0 N--CA 1.456 -0.163 0 C-N-CA 119.946 -0.701 . . . . 0.0 109.842 178.436 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -72.02 -27.66 62.87 Favored 'General case' 0 N--CA 1.447 -0.589 0 CA-C-O 119.385 -0.34 . . . . 0.0 110.682 174.414 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 37' ' ' LEU . . . . . 0.484 HD22 ' HA ' ' A' ' 37' ' ' LEU . 0.6 OUTLIER -76.39 -39.14 54.51 Favored 'General case' 0 CA--C 1.519 -0.229 0 N-CA-C 107.79 -1.189 . . . . 0.0 107.79 -175.89 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 77.0 m-20 -67.4 -15.28 63.59 Favored 'General case' 0 N--CA 1.441 -0.883 0 C-N-CA 124.981 1.312 . . . . 0.0 111.331 176.927 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 97.0 m-70 -153.42 91.55 1.51 Allowed 'General case' 0 N--CA 1.451 -0.415 0 C-N-CA 123.265 0.626 . . . . 0.0 111.137 -175.569 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 40' ' ' ILE . . . . . 0.528 ' H ' HD13 ' A' ' 40' ' ' ILE . 0.0 OUTLIER -70.07 -14.83 18.64 Favored 'Isoleucine or valine' 0 C--O 1.226 -0.176 0 O-C-N 121.788 -0.57 . . . . 0.0 109.789 173.11 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 20.9 m-20 -57.91 -10.49 1.78 Allowed 'General case' 0 CA--C 1.532 0.255 0 C-N-CA 125.248 1.419 . . . . 0.0 113.897 -177.672 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -118.54 9.04 6.85 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.192 0 C-N-CA 124.114 0.966 . . . . 0.0 111.335 179.714 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 3.0 pp20? -47.76 -31.07 4.44 Favored 'General case' 0 C--N 1.331 -0.212 0 O-C-N 121.996 -0.44 . . . . 0.0 112.122 176.638 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 2.5 m -71.58 -39.03 70.83 Favored 'General case' 0 CA--C 1.53 0.211 0 O-C-N 121.794 -0.566 . . . . 0.0 111.234 -175.665 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 45' ' ' LYS . . . . . 0.499 ' HD3' ' CE1' ' A' ' 7' ' ' PHE . 19.1 ptpt -74.16 -24.5 59.41 Favored 'General case' 0 CA--C 1.531 0.24 0 O-C-N 121.637 -0.665 . . . . 0.0 109.719 176.357 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 46' ' ' ILE . . . . . 0.512 HG12 ' CZ ' ' A' ' 10' ' ' PHE . 97.7 mt -72.75 -47.37 50.2 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.237 0 C-N-CA 122.514 0.326 . . . . 0.0 110.206 -179.642 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 33.6 mm -62.79 -36.59 76.11 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.181 0 N-CA-C 109.183 -0.673 . . . . 0.0 109.183 177.454 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 47.1 m -62.84 -38.4 90.64 Favored 'General case' 0 N--CA 1.455 -0.202 0 C-N-CA 120.978 -0.289 . . . . 0.0 111.228 179.213 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 18.6 mt -74.68 -35.17 62.77 Favored 'General case' 0 N--CA 1.451 -0.413 0 N-CA-C 113.176 0.806 . . . . 0.0 113.176 -178.278 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 19.4 pt -69.59 -39.99 79.0 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.181 0 CA-C-N 118.925 0.784 . . . . 0.0 110.258 -178.893 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 36.0 pt -67.21 -42.79 88.38 Favored 'Isoleucine or valine' 0 C--N 1.338 0.092 0 C-N-CA 119.701 -0.799 . . . . 0.0 110.246 178.514 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 85.3 m-20 -63.96 -46.4 84.81 Favored 'General case' 0 N--CA 1.455 -0.208 0 CA-C-N 118.117 0.417 . . . . 0.0 110.886 -179.806 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 53' ' ' TYR . . . . . 0.475 ' CE1' ' HG2' ' A' ' 18' ' ' LYS . 12.1 t80 -63.59 -43.02 98.19 Favored 'General case' 0 N--CA 1.453 -0.314 0 N-CA-C 109.925 -0.398 . . . . 0.0 109.925 -179.819 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 24.2 m -66.0 -30.17 70.68 Favored 'General case' 0 N--CA 1.454 -0.24 0 CA-C-N 118.024 0.375 . . . . 0.0 111.757 -175.923 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 83.0 mtt-85 -76.62 -54.46 6.64 Favored 'General case' 0 N--CA 1.454 -0.251 0 CA-C-N 118.053 0.388 . . . . 0.0 111.523 -177.938 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 56' ' ' LEU . . . . . 0.424 ' CD2' ' N ' ' A' ' 56' ' ' LEU . 2.8 mm? -75.42 -20.16 59.05 Favored 'General case' 0 N--CA 1.455 -0.204 0 N-CA-C 113.863 1.06 . . . . 0.0 113.863 -174.084 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 57' ' ' CYS . . . . . 0.407 ' HB2' ' CB ' ' A' ' 61' ' ' HIS . 8.5 p -83.82 157.22 63.92 Favored Pre-proline 0 CA--C 1.537 0.465 0 N-CA-C 113.611 0.967 . . . . 0.0 113.611 -172.634 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 75.9 Cg_endo -75.4 -174.2 1.9 Allowed 'Trans proline' 0 N--CA 1.459 -0.507 1 C-N-CA 125.644 4.229 . . . . 0.0 111.82 174.358 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 59' ' ' ASP . . . . . 0.407 ' HB2' ' HA ' ' A' ' 116' ' ' SER . 38.5 p-10 -57.76 -50.22 73.97 Favored 'General case' 0 CA--C 1.529 0.155 0 C-N-CA 125.022 1.329 . . . . 0.0 114.407 -171.868 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 39.9 m -71.52 -32.21 67.92 Favored 'General case' 0 C--N 1.333 -0.134 0 O-C-N 122.074 -0.392 . . . . 0.0 110.428 -174.863 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 61' ' ' HIS . . . . . 0.407 ' CB ' ' HB2' ' A' ' 57' ' ' CYS . 61.5 m170 -75.39 -27.83 59.23 Favored 'General case' 0 N--CA 1.451 -0.414 0 C-N-CA 122.608 0.363 . . . . 0.0 110.207 176.464 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 45.6 tptt -68.97 -40.22 78.97 Favored 'General case' 0 N--CA 1.451 -0.425 0 N-CA-C 109.664 -0.495 . . . . 0.0 109.664 177.812 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 63' ' ' LEU . . . . . 0.472 HD23 HG13 ' A' ' 124' ' ' ILE . 1.8 tm? -73.21 -35.43 66.32 Favored 'General case' 0 N--CA 1.454 -0.241 0 N-CA-C 109.537 -0.542 . . . . 0.0 109.537 178.6 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -69.39 -29.35 71.79 Favored Glycine 0 CA--C 1.525 0.718 0 N-CA-C 110.646 -0.982 . . . . 0.0 110.646 175.765 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 43.9 t -71.11 -42.74 68.89 Favored 'General case' 0 N--CA 1.454 -0.241 0 CA-C-N 117.566 0.683 . . . . 0.0 110.133 176.797 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 72.3 mt -68.01 -24.46 65.12 Favored 'General case' 0 N--CA 1.452 -0.358 0 N-CA-C 110.151 -0.314 . . . . 0.0 110.151 179.104 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 2.0 m-85 -70.04 -39.62 75.63 Favored 'General case' 0 N--CA 1.454 -0.274 0 C-N-CA 122.288 0.235 . . . . 0.0 110.815 172.802 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 68' ' ' ILE . . . . . 0.557 HD11 ' CD1' ' A' ' 17' ' ' PHE . 20.3 mt -67.07 -46.6 84.16 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.381 0 N-CA-C 108.728 -0.841 . . . . 0.0 108.728 177.994 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 97.3 mt -57.24 -36.48 52.23 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.121 0 C-N-CA 123.366 0.666 . . . . 0.0 111.028 175.729 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 22.2 t70 -70.18 -43.59 70.49 Favored 'General case' 0 N--CA 1.455 -0.223 0 CA-C-N 117.883 0.31 . . . . 0.0 110.912 178.437 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 30.1 t -67.25 -53.39 30.5 Favored 'General case' 0 N--CA 1.452 -0.351 0 CA-C-N 116.553 -0.294 . . . . 0.0 110.759 -177.458 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -75.13 -33.34 28.53 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.304 0 N-CA-C 109.911 -0.403 . . . . 0.0 109.911 -177.532 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -68.62 -45.33 67.08 Favored Glycine 0 C--N 1.338 0.67 0 CA-C-O 119.703 -0.498 . . . . 0.0 112.074 -176.155 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 33.4 mtm105 -71.01 -40.9 71.54 Favored 'General case' 0 N--CA 1.452 -0.329 0 CA-C-N 117.651 0.726 . . . . 0.0 109.695 177.143 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -61.22 -37.15 81.98 Favored 'General case' 0 N--CA 1.453 -0.297 0 C-N-CA 120.871 -0.332 . . . . 0.0 110.442 -178.673 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 2.4 m-30 -70.19 -47.5 61.25 Favored 'General case' 0 N--CA 1.453 -0.299 0 CA-C-N 118.033 0.379 . . . . 0.0 111.112 178.235 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -65.86 -38.27 88.38 Favored 'General case' 0 N--CA 1.444 -0.761 0 C-N-CA 118.935 -1.106 . . . . 0.0 108.675 -176.98 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 95.5 m-20 -63.49 -45.04 92.57 Favored 'General case' 0 N--CA 1.455 -0.188 0 N-CA-C 111.792 0.293 . . . . 0.0 111.792 177.255 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 14.5 tm-20 -63.54 -46.86 84.03 Favored 'General case' 0 N--CA 1.447 -0.579 0 CA-C-N 117.679 0.218 . . . . 0.0 111.215 -177.698 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 80' ' ' THR . . . . . 0.577 HG21 ' HB3' ' A' ' 94' ' ' CYS . 52.7 p -73.79 -18.53 60.95 Favored 'General case' 0 N--CA 1.453 -0.301 0 N-CA-C 112.068 0.396 . . . . 0.0 112.068 179.611 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 20.3 ttm105 -75.77 -37.13 59.52 Favored 'General case' 0 N--CA 1.455 -0.182 0 CA-C-N 118.161 0.437 . . . . 0.0 109.881 171.425 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 30.9 t . . . . . 0 N--CA 1.456 -0.17 0 C-N-CA 122.997 0.519 . . . . 0.0 112.385 -179.331 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 91' ' ' PRO . . . . . 0.407 ' HA ' ' HB3' ' A' ' 96' ' ' HIS . 85.9 Cg_endo . . . . . 0 N--CA 1.453 -0.885 0 N-CA-C 109.746 -0.905 . . . . 0.0 109.746 . . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 80.61 17.89 72.09 Favored Glycine 0 CA--C 1.525 0.663 0 N-CA-C 111.489 -0.644 . . . . 0.0 111.489 179.306 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -156.78 166.68 32.68 Favored 'General case' 0 N--CA 1.455 -0.208 0 C-N-CA 124.811 1.244 . . . . 0.0 108.918 -178.809 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 94' ' ' CYS . . . . . 0.577 ' HB3' HG21 ' A' ' 80' ' ' THR . 30.5 p -59.47 -18.59 40.99 Favored 'General case' 0 N--CA 1.451 -0.424 0 C-N-CA 122.358 0.263 . . . . 0.0 110.535 178.382 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -56.55 -63.09 1.31 Allowed 'General case' 0 N--CA 1.449 -0.48 0 C-N-CA 122.333 0.253 . . . . 0.0 110.62 -177.658 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 96' ' ' HIS . . . . . 0.407 ' HB3' ' HA ' ' A' ' 91' ' ' PRO . 76.0 t60 -72.25 -33.54 67.58 Favored 'General case' 0 N--CA 1.449 -0.515 0 CA-C-N 116.949 -0.114 . . . . 0.0 110.739 -179.556 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -63.48 -54.1 41.63 Favored 'General case' 0 N--CA 1.452 -0.347 0 O-C-N 123.021 0.201 . . . . 0.0 111.375 -177.333 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 98' ' ' ILE . . . . . 0.444 HD13 ' HB2' ' A' ' 94' ' ' CYS . 1.7 mp -70.13 -36.7 69.24 Favored 'Isoleucine or valine' 0 C--N 1.337 0.05 0 CA-C-N 117.778 0.263 . . . . 0.0 110.428 -179.505 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 35.9 m-20 -67.69 -45.22 75.77 Favored 'General case' 0 N--CA 1.454 -0.27 0 CA-C-N 117.916 0.325 . . . . 0.0 111.316 -178.512 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 98.1 m -70.27 -31.7 69.19 Favored 'General case' 0 N--CA 1.453 -0.308 0 N-CA-C 110.125 -0.324 . . . . 0.0 110.125 -177.797 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 53.7 tp -74.06 -38.34 63.98 Favored 'General case' 0 N--CA 1.449 -0.476 0 CA-C-O 119.626 -0.226 . . . . 0.0 111.058 179.439 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -65.96 -22.64 70.59 Favored Glycine 0 CA--C 1.53 1.009 0 CA-C-O 119.811 -0.438 . . . . 0.0 113.216 -174.562 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 17.3 mm-40 -78.84 -36.4 42.55 Favored 'General case' 0 N--CA 1.456 -0.127 0 CA-C-N 117.877 0.839 . . . . 0.0 111.455 179.186 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 19.6 m -105.02 -8.4 9.84 Favored 'Isoleucine or valine' 0 CA--C 1.527 0.089 0 N-CA-C 112.895 0.702 . . . . 0.0 112.895 -174.492 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 105' ' ' ILE . . . . . . . . . . . . . 10.6 tp -59.59 -26.79 35.78 Favored 'Isoleucine or valine' 0 C--N 1.337 0.062 0 CA-C-N 119.484 1.038 . . . . 0.0 110.587 -179.32 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 27.7 pt20 -66.97 -29.05 68.79 Favored 'General case' 0 N--CA 1.45 -0.432 0 N-CA-C 110.325 -0.25 . . . . 0.0 110.325 177.434 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 60.7 mt-10 -75.96 -36.44 59.3 Favored 'General case' 0 CA--C 1.529 0.153 0 N-CA-C 109.94 -0.393 . . . . 0.0 109.94 177.137 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 10.7 mp -71.69 -41.3 68.83 Favored 'General case' 0 N--CA 1.448 -0.543 0 N-CA-C 109.892 -0.41 . . . . 0.0 109.892 179.847 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 91.5 mt -70.72 -53.14 16.75 Favored 'General case' 0 N--CA 1.455 -0.183 0 CA-C-O 119.526 -0.273 . . . . 0.0 111.176 -179.581 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 9.8 p -47.14 -55.79 7.79 Favored 'General case' 0 C--N 1.34 0.162 0 C-N-CA 122.664 0.386 . . . . 0.0 111.067 177.474 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 18.5 t0 -59.76 -37.71 79.76 Favored 'General case' 0 N--CA 1.446 -0.665 0 N-CA-C 109.475 -0.565 . . . . 0.0 109.475 -179.808 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -68.65 -37.61 79.8 Favored 'General case' 0 N--CA 1.444 -0.761 0 C-N-CA 119.862 -0.735 . . . . 0.0 110.814 -176.504 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 113' ' ' ILE . . . . . . . . . . . . . 27.5 mm -67.71 -39.38 81.98 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.288 0 C-N-CA 119.331 -0.948 . . . . 0.0 110.211 -178.16 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -75.2 -43.57 51.23 Favored 'General case' 0 CA--C 1.53 0.201 0 N-CA-C 112.073 0.397 . . . . 0.0 112.073 179.265 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 39.4 ttmt -75.73 -38.31 58.59 Favored 'General case' 0 C--N 1.338 0.079 0 C-N-CA 123.486 0.714 . . . . 0.0 112.538 -175.263 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 116' ' ' SER . . . . . 0.421 ' HB2' ' HB2' ' A' ' 120' ' ' HIS . 54.9 p -74.66 154.09 38.64 Favored 'General case' 0 N--CA 1.453 -0.294 0 N-CA-C 112.692 0.627 . . . . 0.0 112.692 -170.735 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 21.5 t-20 -75.76 163.81 26.89 Favored 'General case' 0 N--CA 1.454 -0.267 0 N-CA-C 108.84 -0.8 . . . . 0.0 108.84 178.131 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 118' ' ' GLN . . . . . . . . . . . . . 26.5 mm100 -49.59 -51.91 33.99 Favored 'General case' 0 N--CA 1.457 -0.079 0 C-N-CA 123.117 0.567 . . . . 0.0 111.726 -171.61 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 16.0 t0 -57.16 -41.59 79.46 Favored 'General case' 0 C--O 1.23 0.04 0 N-CA-C 109.859 -0.422 . . . . 0.0 109.859 -179.761 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 120' ' ' HIS . . . . . 0.421 ' HB2' ' HB2' ' A' ' 116' ' ' SER . 68.3 m-70 -68.84 -34.4 75.42 Favored 'General case' 0 N--CA 1.447 -0.597 0 CA-C-O 118.981 -0.533 . . . . 0.0 110.603 -179.709 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 60.5 mttm -57.64 -42.81 84.17 Favored 'General case' 0 N--CA 1.464 0.267 0 CA-C-N 118.958 0.799 . . . . 0.0 109.845 177.319 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 29.6 mm-40 -75.62 -32.83 60.42 Favored 'General case' 0 N--CA 1.449 -0.478 0 N-CA-C 112.282 0.475 . . . . 0.0 112.282 -178.002 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 46.4 mtmt -67.5 -28.98 68.3 Favored 'General case' 0 C--N 1.332 -0.193 0 C-N-CA 120.046 -0.662 . . . . 0.0 109.427 176.791 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 124' ' ' ILE . . . . . 0.472 HG13 HD23 ' A' ' 63' ' ' LEU . 62.2 mt -69.89 -38.79 76.57 Favored 'Isoleucine or valine' 0 C--O 1.226 -0.143 0 N-CA-C 109.463 -0.569 . . . . 0.0 109.463 171.812 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -56.39 -49.05 75.6 Favored 'General case' 0 C--N 1.341 0.219 0 O-C-N 122.185 -0.322 . . . . 0.0 110.468 179.818 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 126' ' ' MET . . . . . . . . . . . . . 27.8 ptm -69.41 -31.28 69.54 Favored 'General case' 0 N--CA 1.454 -0.243 0 C-N-CA 120.508 -0.477 . . . . 0.0 110.402 -179.582 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 2.1 mp -62.85 -32.77 74.07 Favored 'General case' 0 N--CA 1.456 -0.144 0 CA-C-N 118.568 0.622 . . . . 0.0 110.547 176.107 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 96.4 mt -72.43 -38.14 68.42 Favored 'General case' 0 N--CA 1.456 -0.162 0 CA-C-N 118.777 0.717 . . . . 0.0 109.927 177.291 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 50.9 m-20 -63.4 -36.34 83.39 Favored 'General case' 0 N--CA 1.456 -0.174 0 N-CA-C 109.796 -0.446 . . . . 0.0 109.796 175.375 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 55.0 mt -69.02 -31.97 52.51 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.278 0 C-N-CA 122.59 0.356 . . . . 0.0 110.615 179.404 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 131' ' ' TRP . . . . . . . . . . . . . 47.9 m0 . . . . . 0 N--CA 1.452 -0.361 0 C-N-CA 120.12 -0.632 . . . . 0.0 111.651 175.303 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 22.0 m-20 . . . . . 0 N--CA 1.456 -0.174 0 N-CA-C 108.85 -0.796 . . . . 0.0 108.85 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 7' ' ' PHE . . . . . 0.513 ' CD1' ' HD3' ' A' ' 45' ' ' LYS . 1.4 t80 -58.26 -34.51 70.56 Favored 'General case' 0 N--CA 1.449 -0.497 0 C-N-CA 123.29 0.636 . . . . 0.0 109.779 179.55 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 51.0 tp60 -51.69 -36.75 47.81 Favored 'General case' 0 N--CA 1.456 -0.145 0 C-N-CA 124.545 1.138 . . . . 0.0 111.829 -177.668 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 26.5 m-80 -71.43 -34.85 70.66 Favored 'General case' 0 N--CA 1.454 -0.272 0 N-CA-C 109.821 -0.437 . . . . 0.0 109.821 -179.379 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 10' ' ' PHE . . . . . 0.477 ' CZ ' HG12 ' A' ' 46' ' ' ILE . 2.1 t80 -71.45 -38.2 71.33 Favored 'General case' 0 N--CA 1.45 -0.439 0 N-CA-C 109.078 -0.712 . . . . 0.0 109.078 178.24 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 86.8 t -66.48 -55.36 18.82 Favored 'Isoleucine or valine' 0 CA--C 1.52 -0.181 0 N-CA-C 109.106 -0.702 . . . . 0.0 109.106 178.448 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -58.01 -29.75 65.54 Favored 'General case' 0 N--CA 1.456 -0.13 0 C-N-CA 122.704 0.402 . . . . 0.0 111.996 -179.107 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 92.3 m -71.93 -39.77 69.22 Favored 'General case' 0 CA--C 1.53 0.209 0 N-CA-C 109.214 -0.661 . . . . 0.0 109.214 176.18 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.422 ' HA ' ' CD1' ' A' ' 17' ' ' PHE . 0.1 OUTLIER -64.28 -45.45 87.97 Favored 'General case' 0 N--CA 1.45 -0.439 0 N-CA-C 109.076 -0.713 . . . . 0.0 109.076 177.145 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 72.5 mm-40 -64.91 -29.75 70.71 Favored 'General case' 0 N--CA 1.454 -0.267 0 C-N-CA 124.004 0.922 . . . . 0.0 110.264 179.798 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 70.5 m -67.18 -34.76 78.21 Favored 'General case' 0 N--CA 1.452 -0.348 0 N-CA-C 109.464 -0.569 . . . . 0.0 109.464 175.646 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 17' ' ' PHE . . . . . 0.469 ' CE1' HD11 ' A' ' 68' ' ' ILE . 15.4 m-85 -63.77 -39.98 95.59 Favored 'General case' 0 C--N 1.34 0.186 0 C-N-CA 120.176 -0.61 . . . . 0.0 109.821 174.657 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 18' ' ' LYS . . . . . 0.474 ' HG2' ' CE1' ' A' ' 53' ' ' TYR . 59.0 mttt -65.92 -29.45 69.87 Favored 'General case' 0 C--N 1.338 0.071 0 CA-C-N 117.625 0.193 . . . . 0.0 110.993 -179.122 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 60.6 t0 -75.16 -42.05 56.88 Favored 'General case' 0 N--CA 1.454 -0.242 0 O-C-N 123.374 0.421 . . . . 0.0 111.073 -179.189 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 14.1 mt -57.99 140.79 51.58 Favored 'General case' 0 N--CA 1.451 -0.396 0 C-N-CA 120.181 -0.608 . . . . 0.0 111.069 -176.483 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 1.1 mppt? -79.84 -21.42 44.19 Favored 'General case' 0 N--CA 1.454 -0.254 0 N-CA-C 109.319 -0.623 . . . . 0.0 109.319 176.543 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 22' ' ' SER . . . . . 0.402 ' C ' ' H ' ' A' ' 24' ' ' ILE . 85.8 p -76.75 -24.95 52.96 Favored 'General case' 0 CA--C 1.53 0.205 0 N-CA-C 109.557 -0.535 . . . . 0.0 109.557 169.82 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 71.7 -29.03 0.61 Allowed Glycine 0 CA--C 1.527 0.807 0 C-N-CA 125.294 1.426 . . . . 0.0 112.683 177.3 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 24' ' ' ILE . . . . . 0.402 ' H ' ' C ' ' A' ' 22' ' ' SER . 35.9 mt -89.73 155.07 3.12 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.557 0 N-CA-C 108.433 -0.951 . . . . 0.0 108.433 173.327 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 4.0 t -158.48 76.27 0.75 Allowed 'General case' 0 C--O 1.225 -0.199 0 CA-C-N 118.665 0.666 . . . . 0.0 110.518 -177.498 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -48.03 -49.86 22.91 Favored Glycine 0 CA--C 1.53 1.01 0 CA-C-O 118.592 -1.116 . . . . 0.0 115.403 -170.036 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 60.1 p -71.7 -35.96 70.4 Favored 'General case' 0 C--N 1.34 0.19 0 CA-C-N 120.173 1.987 . . . . 0.0 110.871 -176.182 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 75.2 mtt85 -70.94 -37.91 72.87 Favored 'General case' 0 C--N 1.341 0.237 0 CA-C-N 118.236 0.471 . . . . 0.0 110.183 178.027 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 41.3 mt -56.45 -45.03 81.73 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.446 0 N-CA-C 107.811 -1.181 . . . . 0.0 107.811 174.159 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 52.8 mtmt -68.36 -23.73 64.72 Favored 'General case' 0 N--CA 1.454 -0.225 0 CA-C-O 118.458 -0.782 . . . . 0.0 112.341 177.544 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 31' ' ' LYS . . . . . 0.539 ' HE3' ' HA ' ' A' ' 31' ' ' LYS . 0.0 OUTLIER -66.1 -59.28 3.93 Favored 'General case' 0 C--N 1.344 0.331 0 CA-C-N 119.629 1.104 . . . . 0.0 110.35 177.345 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.452 HD12 ' N ' ' A' ' 33' ' ' THR . 1.4 pp -74.17 -17.97 60.84 Favored 'General case' 0 N--CA 1.455 -0.176 0 C-N-CA 119.267 -0.973 . . . . 0.0 111.695 -177.024 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 33' ' ' THR . . . . . 0.452 ' N ' HD12 ' A' ' 32' ' ' LEU . 39.7 m -73.54 -37.04 65.73 Favored 'General case' 0 N--CA 1.457 -0.12 0 N-CA-C 109.621 -0.511 . . . . 0.0 109.621 176.18 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 97.6 m -74.05 -37.27 64.33 Favored 'General case' 0 N--CA 1.453 -0.301 0 N-CA-C 110.231 -0.285 . . . . 0.0 110.231 -179.297 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 71.7 t80 -67.55 -33.32 74.81 Favored 'General case' 0 N--CA 1.454 -0.229 0 N-CA-C 109.718 -0.475 . . . . 0.0 109.718 176.727 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -71.14 -31.01 67.19 Favored 'General case' 0 N--CA 1.451 -0.386 0 CA-C-O 119.722 -0.18 . . . . 0.0 111.2 177.595 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 13.1 mt -71.92 -40.88 68.48 Favored 'General case' 0 N--CA 1.454 -0.23 0 C-N-CA 122.349 0.26 . . . . 0.0 111.123 178.101 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 41.8 t0 -67.6 -21.51 65.41 Favored 'General case' 0 CA--C 1.532 0.28 0 N-CA-C 110.504 -0.184 . . . . 0.0 110.504 178.613 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 74.6 m80 -146.39 92.0 2.12 Favored 'General case' 0 N--CA 1.453 -0.314 0 CA-C-O 120.88 0.372 . . . . 0.0 111.197 -177.662 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 40' ' ' ILE . . . . . 0.615 ' H ' HD13 ' A' ' 40' ' ' ILE . 0.0 OUTLIER -72.63 -16.99 18.3 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.54 0 CA-C-O 118.965 -0.54 . . . . 0.0 110.816 176.8 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 3.8 m-20 -57.68 -22.7 47.55 Favored 'General case' 0 N--CA 1.456 -0.16 0 N-CA-C 112.864 0.69 . . . . 0.0 112.864 -176.264 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -102.57 14.79 5.94 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.159 0 C-N-CA 122.636 0.374 . . . . 0.0 111.876 177.098 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 2.8 pp20? -51.51 -34.02 34.2 Favored 'General case' 0 C--O 1.226 -0.153 0 O-C-N 121.475 -0.765 . . . . 0.0 111.23 178.042 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 30.9 t -58.39 -49.88 75.67 Favored 'General case' 0 CA--C 1.531 0.225 0 N-CA-C 112.279 0.474 . . . . 0.0 112.279 -176.853 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 45' ' ' LYS . . . . . 0.513 ' HD3' ' CD1' ' A' ' 7' ' ' PHE . 19.4 ptpt -71.13 -23.22 62.04 Favored 'General case' 0 CA--C 1.529 0.153 0 O-C-N 121.959 -0.463 . . . . 0.0 110.326 -179.913 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 46' ' ' ILE . . . . . 0.477 HG12 ' CZ ' ' A' ' 10' ' ' PHE . 94.4 mt -75.2 -41.72 44.28 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.256 0 C-N-CA 122.888 0.475 . . . . 0.0 109.899 179.979 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 32.1 mm -62.61 -35.47 70.47 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.212 0 N-CA-C 109.185 -0.672 . . . . 0.0 109.185 175.672 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 17.9 t -63.59 -47.78 80.07 Favored 'General case' 0 N--CA 1.456 -0.152 0 C-N-CA 119.872 -0.731 . . . . 0.0 110.454 177.443 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 20.6 mt -64.5 -33.54 76.12 Favored 'General case' 0 N--CA 1.449 -0.496 0 CA-C-O 118.708 -0.663 . . . . 0.0 112.451 -175.788 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 24.6 pt -70.18 -42.71 79.12 Favored 'Isoleucine or valine' 0 C--O 1.226 -0.17 0 C-N-CA 119.366 -0.933 . . . . 0.0 110.669 178.554 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 43.3 pt -70.92 -39.96 75.85 Favored 'Isoleucine or valine' 0 C--N 1.342 0.264 0 CA-C-N 118.916 0.78 . . . . 0.0 110.68 179.756 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 76.3 m-20 -63.31 -48.86 76.29 Favored 'General case' 0 N--CA 1.454 -0.265 0 CA-C-N 117.783 0.265 . . . . 0.0 110.8 -179.987 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 53' ' ' TYR . . . . . 0.474 ' CE1' ' HG2' ' A' ' 18' ' ' LYS . 16.9 t80 -66.13 -47.14 75.08 Favored 'General case' 0 N--CA 1.454 -0.255 0 CA-C-O 119.443 -0.313 . . . . 0.0 110.41 -179.538 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 19.4 t -65.0 -27.91 69.15 Favored 'General case' 0 N--CA 1.454 -0.272 0 O-C-N 123.205 0.316 . . . . 0.0 111.796 -173.968 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 55' ' ' ARG . . . . . 0.43 HH22 ' CD ' ' A' ' 107' ' ' GLU . 90.2 mtt-85 -75.49 -51.29 13.34 Favored 'General case' 0 N--CA 1.455 -0.205 0 O-C-N 122.211 -0.306 . . . . 0.0 110.996 178.057 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 44.0 mt -75.17 -43.53 51.71 Favored 'General case' 0 N--CA 1.457 -0.112 0 N-CA-C 113.034 0.753 . . . . 0.0 113.034 -172.884 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 57' ' ' CYS . . . . . 0.461 ' O ' ' HE2' ' A' ' 62' ' ' LYS . 12.6 p -65.39 154.07 88.55 Favored Pre-proline 0 CA--C 1.538 0.483 0 N-CA-C 112.985 0.735 . . . . 0.0 112.985 -173.633 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 45.6 Cg_endo -80.23 -175.53 2.75 Favored 'Trans proline' 0 N--CA 1.458 -0.612 1 C-N-CA 125.381 4.054 . . . . 0.0 112.371 -179.557 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 59' ' ' ASP . . . . . 0.403 ' CG ' ' HA ' ' A' ' 116' ' ' SER . 35.4 t0 -36.86 -73.29 0.05 OUTLIER 'General case' 0 C--N 1.341 0.206 0 C-N-CA 126.422 1.889 . . . . 0.0 114.357 -174.134 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 19.7 m -61.88 -29.43 70.19 Favored 'General case' 0 C--O 1.232 0.138 0 O-C-N 122.079 -0.388 . . . . 0.0 111.544 -171.643 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 60.2 m80 -75.66 -29.2 59.0 Favored 'General case' 0 N--CA 1.45 -0.444 0 C-N-CA 122.467 0.307 . . . . 0.0 110.62 178.516 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 62' ' ' LYS . . . . . 0.461 ' HE2' ' O ' ' A' ' 57' ' ' CYS . 66.4 mttm -68.33 -37.85 80.96 Favored 'General case' 0 C--N 1.34 0.182 0 N-CA-C 109.092 -0.707 . . . . 0.0 109.092 174.241 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -61.61 -44.66 96.59 Favored 'General case' 0 C--N 1.341 0.213 0 N-CA-C 108.437 -0.949 . . . . 0.0 108.437 177.321 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -68.76 -28.31 73.2 Favored Glycine 0 CA--C 1.526 0.733 0 N-CA-C 111.609 -0.596 . . . . 0.0 111.609 -179.539 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 37.0 p -67.73 -36.94 81.49 Favored 'General case' 0 N--CA 1.452 -0.326 0 CA-C-N 117.965 0.883 . . . . 0.0 109.497 177.71 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 79.0 mt -75.47 -26.81 58.54 Favored 'General case' 0 N--CA 1.449 -0.5 0 CA-C-N 116.506 -0.315 . . . . 0.0 110.935 179.573 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 10.0 m-30 -69.29 -37.72 77.97 Favored 'General case' 0 CA--C 1.513 -0.476 0 CA-C-N 118.367 0.531 . . . . 0.0 110.97 174.231 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 68' ' ' ILE . . . . . 0.469 HD11 ' CE1' ' A' ' 17' ' ' PHE . 18.2 mt -63.87 -47.83 88.99 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.764 0 N-CA-C 107.501 -1.296 . . . . 0.0 107.501 178.907 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 97.0 mt -59.4 -32.56 48.93 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.155 0 C-N-CA 123.832 0.853 . . . . 0.0 111.34 177.056 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 15.2 t70 -68.89 -54.9 12.99 Favored 'General case' 0 CA--C 1.52 -0.196 0 CA-C-N 118.26 0.482 . . . . 0.0 111.134 179.183 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 32.3 t -70.02 -42.33 73.11 Favored 'General case' 0 N--CA 1.452 -0.342 0 C-N-CA 120.829 -0.348 . . . . 0.0 110.795 -174.353 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -74.99 -34.89 33.67 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.233 0 N-CA-C 109.583 -0.525 . . . . 0.0 109.583 179.851 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -70.15 -52.0 20.25 Favored Glycine 0 C--N 1.338 0.667 0 N-CA-C 111.619 -0.592 . . . . 0.0 111.619 -176.531 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 38.6 mtm180 -65.95 -41.79 90.83 Favored 'General case' 0 N--CA 1.45 -0.466 0 C-N-CA 120.306 -0.558 . . . . 0.0 109.608 178.839 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -67.44 -31.29 71.36 Favored 'General case' 0 N--CA 1.45 -0.442 0 C-N-CA 119.703 -0.799 . . . . 0.0 110.865 -177.645 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 1.4 m-30 -66.52 -44.84 81.38 Favored 'General case' 0 CA--C 1.52 -0.199 0 CA-C-N 118.801 0.728 . . . . 0.0 110.348 177.368 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 42.9 tp -70.62 -45.74 64.65 Favored 'General case' 0 N--CA 1.447 -0.6 0 C-N-CA 117.914 -1.514 . . . . 0.0 109.281 179.387 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 83.1 m-20 -56.91 -45.91 82.31 Favored 'General case' 0 CA--C 1.531 0.247 0 N-CA-C 113.164 0.802 . . . . 0.0 113.164 179.017 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 4.7 tm-20 -64.79 -48.62 73.78 Favored 'General case' 0 N--CA 1.453 -0.323 0 CA-C-N 119.115 0.87 . . . . 0.0 110.994 -179.66 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 68.9 p -67.41 -25.91 66.17 Favored 'General case' 0 CA--C 1.528 0.125 0 O-C-N 122.219 -0.301 . . . . 0.0 110.694 179.133 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 35.3 ttp180 -75.93 -20.36 58.04 Favored 'General case' 0 N--CA 1.452 -0.361 0 C-N-CA 124.155 0.982 . . . . 0.0 111.757 171.98 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 53.4 m . . . . . 0 CA--C 1.529 0.135 0 CA-C-O 119.364 -0.35 . . . . 0.0 111.77 -179.4 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 58.3 Cg_endo . . . . . 0 N--CA 1.453 -0.906 0 N-CA-C 108.647 -1.328 . . . . 0.0 108.647 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 96.1 19.56 28.19 Favored Glycine 0 CA--C 1.525 0.683 0 CA-C-O 119.466 -0.63 . . . . 0.0 112.569 -176.841 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 37.3 p -151.62 171.33 17.79 Favored 'General case' 0 CA--C 1.521 -0.17 0 CA-C-N 118.327 1.064 . . . . 0.0 110.922 178.595 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 94' ' ' CYS . . . . . 0.451 ' HB2' HD13 ' A' ' 98' ' ' ILE . 29.6 p -59.23 -24.79 63.47 Favored 'General case' 0 N--CA 1.451 -0.394 0 CA-C-N 115.404 -0.816 . . . . 0.0 109.287 175.133 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -60.69 -57.99 10.37 Favored 'General case' 0 N--CA 1.446 -0.675 0 N-CA-C 109.381 -0.6 . . . . 0.0 109.381 -176.814 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 63.0 t60 -75.4 -30.18 60.01 Favored 'General case' 0 N--CA 1.451 -0.406 0 N-CA-C 111.603 0.223 . . . . 0.0 111.603 -179.03 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -68.53 -51.36 43.84 Favored 'General case' 0 N--CA 1.448 -0.539 0 O-C-N 123.029 0.206 . . . . 0.0 111.127 -178.473 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 98' ' ' ILE . . . . . 0.451 HD13 ' HB2' ' A' ' 94' ' ' CYS . 2.0 mp -72.01 -29.62 33.66 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.198 0 C-N-CA 120.785 -0.366 . . . . 0.0 110.323 179.874 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 76.0 m-20 -64.65 -48.78 73.56 Favored 'General case' 0 N--CA 1.455 -0.19 0 CA-C-N 118.373 0.533 . . . . 0.0 110.322 175.663 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 43.9 m -71.79 -33.94 69.0 Favored 'General case' 0 N--CA 1.456 -0.126 0 O-C-N 122.322 -0.236 . . . . 0.0 110.61 -175.717 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -71.04 -40.85 71.45 Favored 'General case' 0 N--CA 1.447 -0.578 0 N-CA-C 110.225 -0.287 . . . . 0.0 110.225 -179.794 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -64.27 -22.54 67.38 Favored Glycine 0 CA--C 1.528 0.906 0 CA-C-O 119.185 -0.786 . . . . 0.0 114.045 -172.333 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 16.0 mt-10 -95.16 -13.8 24.7 Favored 'General case' 0 C--O 1.231 0.116 0 CA-C-N 118.649 1.225 . . . . 0.0 112.015 -178.492 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 48.2 t -113.18 -23.45 4.34 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.198 0 CA-C-N 116.691 -0.231 . . . . 0.0 111.289 -173.543 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 105' ' ' ILE . . . . . . . . . . . . . 10.0 tp -59.98 -23.3 26.52 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.146 0 C-N-CA 122.922 0.489 . . . . 0.0 111.369 -178.34 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 26.5 pt20 -65.58 -29.53 70.14 Favored 'General case' 0 N--CA 1.452 -0.373 0 N-CA-C 110.288 -0.264 . . . . 0.0 110.288 179.351 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 107' ' ' GLU . . . . . 0.43 ' CD ' HH22 ' A' ' 55' ' ' ARG . 37.8 mt-10 -75.88 -39.91 55.54 Favored 'General case' 0 N--CA 1.455 -0.19 0 CA-C-N 118.079 0.4 . . . . 0.0 110.164 177.445 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 9.8 mp -67.95 -42.37 81.07 Favored 'General case' 0 N--CA 1.453 -0.314 0 N-CA-C 110.066 -0.346 . . . . 0.0 110.066 -178.462 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 90.2 mt -69.52 -59.17 3.15 Favored 'General case' 0 N--CA 1.454 -0.27 0 CA-C-O 119.113 -0.47 . . . . 0.0 110.583 -179.285 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 12.1 p -45.5 -52.74 9.88 Favored 'General case' 0 C--O 1.232 0.17 0 CA-C-N 118.163 0.438 . . . . 0.0 111.806 -179.696 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 34.2 t0 -64.34 -38.93 92.76 Favored 'General case' 0 N--CA 1.445 -0.706 0 N-CA-C 110.099 -0.334 . . . . 0.0 110.099 -178.271 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -70.41 -32.98 70.82 Favored 'General case' 0 N--CA 1.448 -0.568 0 CA-C-O 119.244 -0.407 . . . . 0.0 110.671 -177.914 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 113' ' ' ILE . . . . . . . . . . . . . 46.1 mm -65.23 -41.3 91.21 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.133 0 N-CA-C 108.525 -0.917 . . . . 0.0 108.525 178.175 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -74.6 -38.46 62.6 Favored 'General case' 0 N--CA 1.454 -0.27 0 N-CA-C 112.13 0.418 . . . . 0.0 112.13 179.89 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -75.5 -34.17 60.82 Favored 'General case' 0 C--N 1.339 0.138 0 N-CA-C 112.784 0.661 . . . . 0.0 112.784 -176.53 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 116' ' ' SER . . . . . 0.479 ' HB2' ' HB2' ' A' ' 120' ' ' HIS . 86.5 p -82.13 154.08 25.71 Favored 'General case' 0 N--CA 1.452 -0.352 0 N-CA-C 113.739 1.014 . . . . 0.0 113.739 -168.718 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 48.8 t30 -72.01 165.46 24.2 Favored 'General case' 0 CA--C 1.533 0.296 0 C-N-CA 124.036 0.935 . . . . 0.0 110.329 176.27 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 118' ' ' GLN . . . . . . . . . . . . . 25.6 mm100 -52.71 -40.78 63.31 Favored 'General case' 0 N--CA 1.456 -0.141 0 N-CA-C 113.239 0.829 . . . . 0.0 113.239 -171.633 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 20.4 p-10 -72.44 -41.06 66.56 Favored 'General case' 0 N--CA 1.456 -0.151 0 C-N-CA 120.606 -0.437 . . . . 0.0 109.828 -179.613 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 120' ' ' HIS . . . . . 0.479 ' HB2' ' HB2' ' A' ' 116' ' ' SER . 14.6 m-70 -65.22 -34.83 79.3 Favored 'General case' 0 N--CA 1.452 -0.334 0 C-N-CA 123.11 0.564 . . . . 0.0 110.366 178.226 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 55.8 mttm -61.15 -46.26 91.26 Favored 'General case' 0 C--N 1.341 0.208 0 N-CA-C 108.638 -0.875 . . . . 0.0 108.638 175.062 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 40.7 tp10 -67.39 -36.79 82.02 Favored 'General case' 0 N--CA 1.452 -0.336 0 CA-C-N 116.513 -0.312 . . . . 0.0 111.108 -176.313 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 34.1 mtmt -64.36 -31.68 72.98 Favored 'General case' 0 N--CA 1.452 -0.332 0 N-CA-C 109.61 -0.515 . . . . 0.0 109.61 176.912 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 124' ' ' ILE . . . . . . . . . . . . . 53.7 mt -74.0 -35.86 43.13 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.319 0 O-C-N 121.642 -0.661 . . . . 0.0 109.785 175.696 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 11.7 mmm180 -63.79 -39.74 94.97 Favored 'General case' 0 C--N 1.34 0.174 0 CA-C-N 118.522 0.601 . . . . 0.0 110.353 -179.778 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 126' ' ' MET . . . . . . . . . . . . . 18.6 ptp -68.9 -32.26 71.77 Favored 'General case' 0 N--CA 1.455 -0.189 0 C-N-CA 119.623 -0.831 . . . . 0.0 109.354 176.736 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 2.0 mp -60.52 -33.06 72.09 Favored 'General case' 0 CA--C 1.531 0.221 0 CA-C-N 118.647 0.658 . . . . 0.0 110.277 175.787 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 128' ' ' LEU . . . . . 0.435 ' HA ' HD13 ' A' ' 128' ' ' LEU . 3.1 mm? -70.27 -42.11 72.56 Favored 'General case' 0 CA--C 1.523 -0.064 0 CA-C-N 118.701 0.682 . . . . 0.0 109.992 177.196 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 15.6 t0 -61.0 -45.03 96.49 Favored 'General case' 0 N--CA 1.455 -0.211 0 CA-C-O 121.085 0.469 . . . . 0.0 109.797 177.124 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 53.6 mt -61.05 -36.89 75.6 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.348 0 C-N-CA 123.575 0.75 . . . . 0.0 110.511 -178.29 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 131' ' ' TRP . . . . . . . . . . . . . 51.3 m0 . . . . . 0 N--CA 1.451 -0.383 0 N-CA-C 112.897 0.703 . . . . 0.0 112.897 -179.834 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 18.8 p-10 . . . . . 0 N--CA 1.453 -0.32 0 N-CA-C 107.443 -1.317 . . . . 0.0 107.443 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER -62.34 -34.42 76.6 Favored 'General case' 0 N--CA 1.443 -0.816 0 C-N-CA 125.515 1.526 . . . . 0.0 111.174 -176.427 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 17.4 tp60 -50.56 -36.2 33.38 Favored 'General case' 0 N--CA 1.456 -0.135 0 C-N-CA 123.141 0.576 . . . . 0.0 111.325 -178.455 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 26.5 m-80 -70.99 -39.69 72.31 Favored 'General case' 0 N--CA 1.454 -0.248 0 N-CA-C 110.194 -0.298 . . . . 0.0 110.194 -179.389 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 10' ' ' PHE . . . . . 0.526 ' CE2' ' HB2' ' A' ' 32' ' ' LEU . 3.7 t80 -68.56 -37.51 79.96 Favored 'General case' 0 N--CA 1.451 -0.408 0 C-N-CA 123.476 0.71 . . . . 0.0 109.873 178.089 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 94.7 t -66.28 -51.19 61.67 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.219 0 N-CA-C 108.221 -1.029 . . . . 0.0 108.221 178.601 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -61.64 -25.76 67.57 Favored 'General case' 0 N--CA 1.452 -0.344 0 C-N-CA 122.844 0.458 . . . . 0.0 111.717 179.789 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 59.3 m -74.61 -37.02 62.96 Favored 'General case' 0 N--CA 1.456 -0.155 0 N-CA-C 108.972 -0.751 . . . . 0.0 108.972 175.613 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -66.49 -44.25 83.16 Favored 'General case' 0 N--CA 1.448 -0.54 0 N-CA-C 108.617 -0.883 . . . . 0.0 108.617 177.088 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 68.2 mm-40 -66.53 -27.03 67.44 Favored 'General case' 0 N--CA 1.451 -0.41 0 C-N-CA 123.952 0.901 . . . . 0.0 110.001 177.864 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 22.0 t -67.93 -35.16 77.97 Favored 'General case' 0 N--CA 1.451 -0.379 0 N-CA-C 109.316 -0.624 . . . . 0.0 109.316 177.521 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 17' ' ' PHE . . . . . 0.519 ' HA ' HD12 ' A' ' 20' ' ' LEU . 46.6 m-85 -67.9 -39.32 83.64 Favored 'General case' 0 CA--C 1.518 -0.267 0 C-N-CA 120.304 -0.558 . . . . 0.0 110.439 173.977 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 72.1 mttt -58.7 -32.81 69.5 Favored 'General case' 0 C--N 1.339 0.11 0 C-N-CA 120.46 -0.496 . . . . 0.0 109.714 178.849 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 24.9 t0 -76.33 -45.73 30.84 Favored 'General case' 0 N--CA 1.456 -0.151 0 C-N-CA 123.27 0.628 . . . . 0.0 111.05 176.292 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 20' ' ' LEU . . . . . 0.519 HD12 ' HA ' ' A' ' 17' ' ' PHE . 3.8 mt -46.99 136.49 8.38 Favored 'General case' 0 N--CA 1.454 -0.231 0 C-N-CA 123.224 0.61 . . . . 0.0 112.073 -173.473 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.49 -13.0 60.26 Favored 'General case' 0 CA--C 1.53 0.205 0 CA-C-N 115.252 -0.886 . . . . 0.0 111.88 -174.621 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 22' ' ' SER . . . . . 0.418 ' C ' ' H ' ' A' ' 24' ' ' ILE . 67.3 m -120.96 -10.85 9.02 Favored 'General case' 0 CA--C 1.528 0.122 0 C-N-CA 123.692 0.797 . . . . 0.0 112.005 -178.397 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 74.39 -21.66 1.43 Allowed Glycine 0 CA--C 1.531 1.059 0 N-CA-C 111.344 -0.702 . . . . 0.0 111.344 -174.824 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 24' ' ' ILE . . . . . 0.418 ' H ' ' C ' ' A' ' 22' ' ' SER . 81.0 mt -94.19 154.22 3.34 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.136 0 C-N-CA 124.498 1.119 . . . . 0.0 109.604 174.301 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 25' ' ' SER . . . . . 0.507 ' HB2' HD13 ' A' ' 20' ' ' LEU . 30.3 t -168.44 107.38 0.49 Allowed 'General case' 0 CA--C 1.517 -0.306 0 CA-C-O 119.451 -0.309 . . . . 0.0 110.289 168.933 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 26' ' ' GLY . . . . . 0.421 ' O ' ' HE2' ' A' ' 30' ' ' LYS . . . -54.61 -39.57 67.13 Favored Glycine 0 CA--C 1.524 0.634 0 C-N-CA 120.091 -1.052 . . . . 0.0 110.618 179.924 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 29.0 t -63.08 -52.31 63.21 Favored 'General case' 0 N--CA 1.455 -0.193 0 CA-C-N 117.866 0.833 . . . . 0.0 110.745 -178.075 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 74.2 mmt-85 -68.17 -39.46 82.56 Favored 'General case' 0 C--O 1.231 0.129 0 O-C-N 122.103 -0.373 . . . . 0.0 110.265 -178.971 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 72.9 mt -61.01 -47.59 92.89 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.511 0 N-CA-C 109.595 -0.52 . . . . 0.0 109.595 178.789 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 30' ' ' LYS . . . . . 0.421 ' HE2' ' O ' ' A' ' 26' ' ' GLY . 51.2 mtmt -64.75 -28.97 69.94 Favored 'General case' 0 C--N 1.341 0.2 0 CA-C-O 119.289 -0.386 . . . . 0.0 111.151 -179.782 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 31' ' ' LYS . . . . . 0.434 ' HA ' ' HE2' ' A' ' 31' ' ' LYS . 4.6 mmpt? -65.63 -58.74 5.01 Favored 'General case' 0 C--O 1.231 0.085 0 CA-C-N 118.362 0.528 . . . . 0.0 110.839 179.547 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.556 HD12 ' N ' ' A' ' 33' ' ' THR . 1.6 pp -72.21 -20.97 61.48 Favored 'General case' 0 CA--C 1.528 0.115 0 C-N-CA 118.967 -1.093 . . . . 0.0 111.249 -177.642 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 33' ' ' THR . . . . . 0.556 ' N ' HD12 ' A' ' 32' ' ' LEU . 55.2 m -72.51 -40.7 66.65 Favored 'General case' 0 N--CA 1.455 -0.215 0 N-CA-C 109.364 -0.606 . . . . 0.0 109.364 178.169 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 99.9 m -69.31 -38.29 78.17 Favored 'General case' 0 N--CA 1.451 -0.389 0 C-N-CA 121.008 -0.277 . . . . 0.0 110.392 -177.671 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 42.9 t80 -66.44 -34.33 77.7 Favored 'General case' 0 N--CA 1.455 -0.223 0 C-N-CA 119.821 -0.752 . . . . 0.0 110.047 176.547 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -71.49 -32.18 67.95 Favored 'General case' 0 N--CA 1.452 -0.347 0 CA-C-O 119.376 -0.345 . . . . 0.0 111.477 179.094 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -75.07 -34.1 61.77 Favored 'General case' 0 N--CA 1.457 -0.103 0 CA-C-N 118.129 0.422 . . . . 0.0 110.544 179.003 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 44.1 t0 -67.71 -22.74 65.24 Favored 'General case' 0 N--CA 1.455 -0.212 0 N-CA-C 110.403 -0.221 . . . . 0.0 110.403 175.86 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 98.1 m-70 -151.44 99.01 2.59 Favored 'General case' 0 C--N 1.342 0.263 0 C-N-CA 122.871 0.468 . . . . 0.0 111.461 -175.157 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 40' ' ' ILE . . . . . 0.505 ' H ' HD13 ' A' ' 40' ' ' ILE . 0.0 OUTLIER -75.91 -14.59 15.2 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.322 0 CA-C-O 119.268 -0.396 . . . . 0.0 110.478 175.14 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 89.4 m-20 -58.58 -16.88 17.76 Favored 'General case' 0 CA--C 1.531 0.232 0 N-CA-C 112.723 0.638 . . . . 0.0 112.723 -178.204 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -106.71 13.19 8.33 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.159 0 C-N-CA 122.803 0.441 . . . . 0.0 111.859 177.473 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 3.0 pp20? -52.49 -30.07 28.24 Favored 'General case' 0 CA--C 1.527 0.085 0 O-C-N 121.755 -0.591 . . . . 0.0 111.557 177.532 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 40.3 t -62.4 -48.19 80.79 Favored 'General case' 0 CA--C 1.53 0.209 0 N-CA-C 112.299 0.481 . . . . 0.0 112.299 -179.326 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 18.2 ptpt -71.93 -25.58 61.95 Favored 'General case' 0 C--N 1.339 0.139 0 N-CA-C 109.494 -0.558 . . . . 0.0 109.494 179.32 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 46' ' ' ILE . . . . . 0.467 HG12 ' CZ ' ' A' ' 10' ' ' PHE . 88.7 mt -71.01 -50.38 42.93 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.297 0 C-N-CA 122.798 0.439 . . . . 0.0 110.064 -178.96 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 35.5 mm -63.75 -35.03 71.58 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.169 0 N-CA-C 109.402 -0.592 . . . . 0.0 109.402 179.237 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 50.1 m -63.68 -39.4 94.22 Favored 'General case' 0 N--CA 1.452 -0.332 0 O-C-N 122.429 -0.17 . . . . 0.0 111.073 -179.192 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -78.46 -30.58 47.5 Favored 'General case' 0 N--CA 1.456 -0.163 0 N-CA-C 113.465 0.913 . . . . 0.0 113.465 -178.728 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 13.5 pt -70.15 -40.32 78.08 Favored 'Isoleucine or valine' 0 C--N 1.34 0.161 0 CA-C-N 119.963 1.256 . . . . 0.0 110.259 177.994 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 22.1 pt -69.11 -39.91 80.01 Favored 'Isoleucine or valine' 0 C--N 1.338 0.103 0 C-N-CA 120.138 -0.625 . . . . 0.0 110.315 179.584 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 44.4 t0 -65.42 -49.34 69.58 Favored 'General case' 0 N--CA 1.456 -0.174 0 CA-C-N 117.906 0.321 . . . . 0.0 110.841 178.492 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 44.5 t80 -62.74 -43.22 99.36 Favored 'General case' 0 N--CA 1.453 -0.31 0 N-CA-C 109.538 -0.542 . . . . 0.0 109.538 179.671 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 34.7 t -62.49 -30.83 71.55 Favored 'General case' 0 N--CA 1.454 -0.237 0 CA-C-N 118.175 0.443 . . . . 0.0 111.492 -177.786 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 7.1 tpt180 -81.34 -44.53 17.49 Favored 'General case' 0 N--CA 1.454 -0.25 0 CA-C-N 118.126 0.421 . . . . 0.0 111.271 -178.942 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 95.0 mt -77.37 -47.51 19.69 Favored 'General case' 0 N--CA 1.456 -0.146 0 N-CA-C 114.032 1.123 . . . . 0.0 114.032 -175.56 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 57' ' ' CYS . . . . . 0.425 ' HA ' ' HD3' ' A' ' 58' ' ' PRO . 13.5 p -61.39 158.46 38.09 Favored Pre-proline 0 CA--C 1.536 0.408 0 N-CA-C 113.957 1.095 . . . . 0.0 113.957 -169.718 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 58' ' ' PRO . . . . . 0.425 ' HD3' ' HA ' ' A' ' 57' ' ' CYS . 31.7 Cg_exo -59.12 174.05 1.09 Allowed 'Trans proline' 0 N--CA 1.455 -0.774 1 C-N-CA 125.801 4.334 . . . . 0.0 113.439 176.442 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 27.3 p30 -58.48 -47.75 83.06 Favored 'General case' 0 CA--C 1.531 0.225 0 CA-C-N 115.179 -0.919 . . . . 0.0 112.624 -173.695 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 34.3 m -70.66 -29.77 66.2 Favored 'General case' 0 N--CA 1.453 -0.299 0 CA-C-O 120.927 0.394 . . . . 0.0 110.18 -179.0 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 62.9 m80 -75.34 -27.16 59.1 Favored 'General case' 0 N--CA 1.45 -0.468 0 C-N-CA 122.812 0.445 . . . . 0.0 110.313 177.701 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 62' ' ' LYS . . . . . 0.416 ' HE2' ' O ' ' A' ' 57' ' ' CYS . 64.1 mttm -67.79 -37.46 82.05 Favored 'General case' 0 N--CA 1.457 -0.084 0 N-CA-C 109.668 -0.493 . . . . 0.0 109.668 171.613 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -62.79 -42.84 99.88 Favored 'General case' 0 CA--C 1.53 0.199 0 N-CA-C 108.045 -1.095 . . . . 0.0 108.045 173.341 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -66.83 -30.99 76.99 Favored Glycine 0 C--N 1.34 0.75 0 N-CA-C 111.811 -0.515 . . . . 0.0 111.811 -179.423 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 30.0 t -68.62 -40.45 80.37 Favored 'General case' 0 N--CA 1.45 -0.443 0 CA-C-N 117.665 0.732 . . . . 0.0 109.884 178.317 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 77.0 mt -70.99 -24.12 62.32 Favored 'General case' 0 N--CA 1.45 -0.438 0 N-CA-C 109.767 -0.457 . . . . 0.0 109.767 178.922 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -73.49 -38.85 65.25 Favored 'General case' 0 N--CA 1.456 -0.169 0 C-N-CA 122.822 0.449 . . . . 0.0 110.698 174.765 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 68' ' ' ILE . . . . . 0.443 HD11 ' CD1' ' A' ' 17' ' ' PHE . 19.6 mt -65.59 -51.06 67.61 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.295 0 N-CA-C 108.594 -0.891 . . . . 0.0 108.594 175.211 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 86.0 mt -55.89 -32.01 31.63 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.303 0 C-N-CA 123.662 0.785 . . . . 0.0 111.4 176.588 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 15.0 t70 -69.31 -51.41 37.43 Favored 'General case' 0 N--CA 1.454 -0.264 0 O-C-N 121.757 -0.589 . . . . 0.0 111.157 178.757 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 90.2 p -67.64 -48.06 67.79 Favored 'General case' 0 N--CA 1.452 -0.368 0 O-C-N 122.987 0.18 . . . . 0.0 111.059 -175.128 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -75.72 -34.79 29.32 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.168 0 N-CA-C 109.818 -0.438 . . . . 0.0 109.818 -179.672 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -67.82 -48.21 56.48 Favored Glycine 0 C--N 1.336 0.569 0 N-CA-C 110.811 -0.916 . . . . 0.0 110.811 -176.376 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 39.5 mtm180 -68.41 -42.9 78.33 Favored 'General case' 0 N--CA 1.448 -0.526 0 CA-C-N 117.408 0.604 . . . . 0.0 109.899 178.394 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -62.38 -31.31 71.96 Favored 'General case' 0 N--CA 1.449 -0.498 0 C-N-CA 120.302 -0.559 . . . . 0.0 110.498 -178.462 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 1.9 m-30 -70.86 -51.97 23.14 Favored 'General case' 0 N--CA 1.456 -0.169 0 CA-C-N 118.46 0.573 . . . . 0.0 110.934 176.413 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 43.6 tp -68.34 -36.92 79.96 Favored 'General case' 0 N--CA 1.449 -0.493 0 C-N-CA 118.212 -1.395 . . . . 0.0 110.092 -176.952 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 83.8 m-20 -64.89 -45.41 86.07 Favored 'General case' 0 N--CA 1.454 -0.274 0 CA-C-O 119.645 -0.217 . . . . 0.0 111.507 179.052 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 16.0 tm-20 -64.92 -49.04 71.95 Favored 'General case' 0 N--CA 1.446 -0.661 0 CA-C-N 118.17 0.441 . . . . 0.0 111.575 179.378 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 80' ' ' THR . . . . . 0.541 HG21 ' CB ' ' A' ' 94' ' ' CYS . 79.9 p -68.32 -25.45 65.12 Favored 'General case' 0 CA--C 1.531 0.243 0 CA-C-N 117.933 0.333 . . . . 0.0 110.577 -178.538 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 37.3 ttp-105 -74.73 -30.7 61.6 Favored 'General case' 0 CA--C 1.53 0.2 0 C-N-CA 122.813 0.445 . . . . 0.0 111.42 173.023 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 58.0 m . . . . . 0 N--CA 1.458 -0.063 0 N-CA-C 112.65 0.611 . . . . 0.0 112.65 -175.839 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 55.4 Cg_endo . . . . . 0 N--CA 1.454 -0.833 0 N-CA-C 108.352 -1.441 . . . . 0.0 108.352 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 95.76 15.53 42.51 Favored Glycine 0 CA--C 1.524 0.645 0 CA-C-O 119.464 -0.631 . . . . 0.0 112.314 -177.165 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 42.0 p -150.33 168.65 23.47 Favored 'General case' 0 C--N 1.34 0.157 0 CA-C-N 118.446 1.123 . . . . 0.0 111.436 177.825 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 94' ' ' CYS . . . . . 0.657 ' SG ' HD13 ' A' ' 98' ' ' ILE . 7.5 t -54.96 -28.12 48.99 Favored 'General case' 0 N--CA 1.449 -0.48 0 CA-C-N 115.021 -0.991 . . . . 0.0 109.653 173.262 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -57.84 -57.32 13.29 Favored 'General case' 0 N--CA 1.445 -0.71 0 N-CA-C 109.244 -0.65 . . . . 0.0 109.244 -178.324 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 61.0 t60 -75.64 -31.69 59.93 Favored 'General case' 0 N--CA 1.452 -0.35 0 C-N-CA 121.103 -0.239 . . . . 0.0 111.598 -179.193 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -67.4 -48.69 66.62 Favored 'General case' 0 N--CA 1.451 -0.422 0 O-C-N 122.92 0.138 . . . . 0.0 111.039 -177.255 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 98' ' ' ILE . . . . . 0.657 HD13 ' SG ' ' A' ' 94' ' ' CYS . 1.7 mp -73.69 -30.74 29.85 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.208 0 N-CA-C 109.903 -0.406 . . . . 0.0 109.903 179.998 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 62.3 m-20 -64.68 -47.93 76.58 Favored 'General case' 0 N--CA 1.457 -0.09 0 CA-C-N 118.423 0.556 . . . . 0.0 110.942 175.104 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 47.5 m -72.39 -25.96 61.7 Favored 'General case' 0 N--CA 1.456 -0.157 0 C-N-CA 122.334 0.254 . . . . 0.0 110.563 -175.259 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 57.5 tp -80.33 -37.5 32.42 Favored 'General case' 0 N--CA 1.447 -0.595 0 C-N-CA 122.794 0.438 . . . . 0.0 110.867 178.876 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -75.02 -24.84 70.61 Favored Glycine 0 CA--C 1.527 0.809 0 CA-C-O 119.485 -0.619 . . . . 0.0 112.74 -175.954 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 24.1 pt-20 -78.14 -2.48 37.71 Favored 'General case' 0 CA--C 1.532 0.27 0 CA-C-N 117.98 0.89 . . . . 0.0 111.604 -179.928 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 36.0 m -138.47 9.56 0.69 Allowed 'Isoleucine or valine' 0 CA--C 1.529 0.167 0 N-CA-C 111.996 0.369 . . . . 0.0 111.996 176.288 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 105' ' ' ILE . . . . . . . . . . . . . 11.2 tp -62.28 -26.18 39.63 Favored 'Isoleucine or valine' 0 N--CA 1.458 -0.065 0 CA-C-N 118.697 0.681 . . . . 0.0 111.408 -175.367 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 10.2 pt20 -67.9 -28.47 67.53 Favored 'General case' 0 N--CA 1.453 -0.287 0 N-CA-C 110.154 -0.313 . . . . 0.0 110.154 178.617 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 74.6 mm-40 -75.55 -42.8 51.45 Favored 'General case' 0 N--CA 1.453 -0.283 0 N-CA-C 110.007 -0.368 . . . . 0.0 110.007 -178.017 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 7.3 mp -69.83 -43.77 71.3 Favored 'General case' 0 N--CA 1.448 -0.525 0 N-CA-C 109.703 -0.48 . . . . 0.0 109.703 -179.119 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 96.2 mt -66.72 -64.14 0.92 Allowed 'General case' 0 N--CA 1.452 -0.348 0 C-N-CA 120.592 -0.443 . . . . 0.0 110.261 178.788 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 21.1 t -50.86 -39.82 54.69 Favored 'General case' 0 C--O 1.233 0.199 0 N-CA-C 112.535 0.569 . . . . 0.0 112.535 -173.593 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 49.7 t0 -68.4 -43.8 76.44 Favored 'General case' 0 N--CA 1.456 -0.146 0 N-CA-C 110.206 -0.294 . . . . 0.0 110.206 178.914 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -69.21 -34.68 75.26 Favored 'General case' 0 N--CA 1.448 -0.569 0 CA-C-N 116.836 -0.166 . . . . 0.0 110.744 -178.137 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 113' ' ' ILE . . . . . . . . . . . . . 46.7 mm -66.96 -36.06 76.23 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.333 0 N-CA-C 109.334 -0.617 . . . . 0.0 109.334 179.204 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -74.81 -42.28 58.34 Favored 'General case' 0 N--CA 1.453 -0.31 0 N-CA-C 111.828 0.307 . . . . 0.0 111.828 178.03 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -78.14 -35.73 48.61 Favored 'General case' 0 N--CA 1.456 -0.163 0 N-CA-C 112.514 0.561 . . . . 0.0 112.514 -174.964 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 116' ' ' SER . . . . . 0.483 ' HB2' ' CB ' ' A' ' 120' ' ' HIS . 54.3 p -81.84 157.13 24.53 Favored 'General case' 0 N--CA 1.456 -0.172 0 N-CA-C 112.892 0.701 . . . . 0.0 112.892 -171.15 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 53.1 t30 -77.03 166.35 23.43 Favored 'General case' 0 C--O 1.226 -0.146 0 C-N-CA 123.203 0.601 . . . . 0.0 110.564 -178.563 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 118' ' ' GLN . . . . . . . . . . . . . 12.8 mt-30 -54.71 -36.54 64.83 Favored 'General case' 0 CA--C 1.531 0.221 0 N-CA-C 112.649 0.611 . . . . 0.0 112.649 -172.663 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 11.2 p-10 -70.99 -39.12 72.65 Favored 'General case' 0 C--O 1.226 -0.144 0 CA-C-O 121.099 0.476 . . . . 0.0 109.877 178.767 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 120' ' ' HIS . . . . . 0.483 ' CB ' ' HB2' ' A' ' 116' ' ' SER . 36.9 m170 -64.74 -38.89 92.53 Favored 'General case' 0 N--CA 1.45 -0.43 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.223 176.473 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 46.2 mttm -58.95 -43.4 91.23 Favored 'General case' 0 C--N 1.342 0.274 0 N-CA-C 108.719 -0.845 . . . . 0.0 108.719 177.196 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 41.6 tp10 -66.34 -38.73 88.3 Favored 'General case' 0 N--CA 1.454 -0.25 0 CA-C-O 119.459 -0.305 . . . . 0.0 111.358 -176.982 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 53.2 mtpt -65.74 -28.88 69.36 Favored 'General case' 0 N--CA 1.452 -0.341 0 CA-C-N 118.511 0.596 . . . . 0.0 110.225 177.729 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 124' ' ' ILE . . . . . . . . . . . . . 61.6 mt -74.44 -37.18 44.03 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.24 0 N-CA-C 109.544 -0.539 . . . . 0.0 109.544 176.822 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 55.8 mmm-85 -65.53 -42.81 91.57 Favored 'General case' 0 C--O 1.23 0.076 0 O-C-N 122.215 -0.303 . . . . 0.0 110.969 179.851 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 126' ' ' MET . . . . . . . . . . . . . 28.6 ptm -67.57 -29.54 68.93 Favored 'General case' 0 N--CA 1.454 -0.273 0 C-N-CA 119.747 -0.781 . . . . 0.0 109.237 176.563 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 1.7 mp -63.15 -29.61 70.93 Favored 'General case' 0 N--CA 1.455 -0.208 0 CA-C-O 118.993 -0.527 . . . . 0.0 110.29 172.849 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 76.0 mt -69.16 -43.2 74.76 Favored 'General case' 0 C--N 1.34 0.163 0 CA-C-N 119.23 0.923 . . . . 0.0 109.935 175.691 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 67.0 m-20 -60.17 -39.37 86.2 Favored 'General case' 0 N--CA 1.463 0.18 0 CA-C-N 118.331 0.514 . . . . 0.0 110.041 176.514 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 62.7 mt -66.15 -36.66 77.96 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.401 0 C-N-CA 122.911 0.484 . . . . 0.0 110.063 179.118 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 131' ' ' TRP . . . . . . . . . . . . . 49.4 m0 . . . . . 0 N--CA 1.455 -0.197 0 N-CA-C 112.56 0.578 . . . . 0.0 112.56 177.9 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 36.2 p-10 . . . . . 0 N--CA 1.453 -0.283 0 N-CA-C 108.788 -0.819 . . . . 0.0 108.788 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 7' ' ' PHE . . . . . 0.522 ' CE1' ' HD3' ' A' ' 45' ' ' LYS . 1.6 t80 -51.12 -37.31 45.3 Favored 'General case' 0 N--CA 1.448 -0.54 0 C-N-CA 124.375 1.07 . . . . 0.0 110.71 177.36 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 51.1 tp60 -53.64 -34.64 59.26 Favored 'General case' 0 N--CA 1.454 -0.268 0 C-N-CA 123.281 0.632 . . . . 0.0 111.579 -178.515 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 32.0 m-80 -72.49 -31.46 65.39 Favored 'General case' 0 N--CA 1.448 -0.528 0 N-CA-C 109.992 -0.373 . . . . 0.0 109.992 -179.587 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 10' ' ' PHE . . . . . 0.452 ' CE2' ' HB2' ' A' ' 32' ' ' LEU . 13.0 t80 -69.44 -40.94 76.89 Favored 'General case' 0 N--CA 1.449 -0.519 0 N-CA-C 108.986 -0.746 . . . . 0.0 108.986 175.412 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 62.6 t -64.35 -53.62 40.86 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.23 0 N-CA-C 108.657 -0.868 . . . . 0.0 108.657 179.467 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -59.84 -26.88 66.17 Favored 'General case' 0 N--CA 1.453 -0.279 0 C-N-CA 122.597 0.359 . . . . 0.0 111.808 179.534 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 91.2 m -74.25 -39.46 63.02 Favored 'General case' 0 CA--C 1.529 0.166 0 N-CA-C 109.077 -0.712 . . . . 0.0 109.077 176.703 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.495 ' HA ' ' CD1' ' A' ' 17' ' ' PHE . 10.9 tp -64.42 -45.31 88.09 Favored 'General case' 0 N--CA 1.452 -0.367 0 CA-C-O 121.374 0.607 . . . . 0.0 109.371 177.402 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 68.6 mm-40 -63.85 -28.28 69.74 Favored 'General case' 0 N--CA 1.453 -0.312 0 C-N-CA 124.069 0.948 . . . . 0.0 110.005 178.393 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 74.5 m -70.62 -28.19 64.66 Favored 'General case' 0 N--CA 1.453 -0.325 0 N-CA-C 109.616 -0.513 . . . . 0.0 109.616 177.281 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 17' ' ' PHE . . . . . 0.515 ' CE1' HD11 ' A' ' 68' ' ' ILE . 16.6 m-85 -69.74 -40.94 75.87 Favored 'General case' 0 N--CA 1.454 -0.243 0 C-N-CA 119.648 -0.821 . . . . 0.0 110.267 171.554 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 81.0 mttt -61.96 -28.51 69.6 Favored 'General case' 0 C--N 1.34 0.18 0 CA-C-O 120.617 0.246 . . . . 0.0 110.691 -178.575 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 46.3 t0 -71.42 -27.12 63.07 Favored 'General case' 0 CA--C 1.532 0.281 0 CA-C-N 115.826 -0.625 . . . . 0.0 112.192 -179.407 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 97.4 mt -74.02 152.92 39.89 Favored 'General case' 0 N--CA 1.455 -0.176 0 O-C-N 122.055 -0.403 . . . . 0.0 110.78 -177.563 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 21' ' ' LYS . . . . . 0.47 ' HE3' ' CA ' ' A' ' 21' ' ' LYS . 0.0 OUTLIER -77.13 -30.89 55.35 Favored 'General case' 0 C--N 1.339 0.135 0 N-CA-C 110.261 -0.274 . . . . 0.0 110.261 176.3 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 99.0 p -88.33 -22.47 23.82 Favored 'General case' 0 N--CA 1.457 -0.114 0 C-N-CA 122.983 0.513 . . . . 0.0 110.931 179.568 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 73.08 -22.04 0.98 Allowed Glycine 0 CA--C 1.527 0.801 0 C-N-CA 123.532 0.586 . . . . 0.0 112.752 178.919 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 24' ' ' ILE . . . . . 0.409 HD11 HD12 ' A' ' 63' ' ' LEU . 53.5 mt -78.93 149.38 5.57 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.212 0 N-CA-C 108.775 -0.824 . . . . 0.0 108.775 172.137 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 47.7 t -157.61 83.0 0.89 Allowed 'General case' 0 CA--C 1.517 -0.311 0 N-CA-C 110.146 -0.316 . . . . 0.0 110.146 177.355 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 26' ' ' GLY . . . . . 0.505 ' O ' ' HE2' ' A' ' 30' ' ' LYS . . . -48.58 -33.85 13.03 Favored Glycine 0 CA--C 1.526 0.741 0 N-CA-C 110.826 -0.91 . . . . 0.0 110.826 -178.89 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 4.7 t -67.76 -61.59 1.81 Allowed 'General case' 0 N--CA 1.452 -0.347 0 CA-C-N 117.407 0.604 . . . . 0.0 111.331 -178.084 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -72.68 -25.85 61.4 Favored 'General case' 0 N--CA 1.454 -0.256 0 CA-C-O 119.424 -0.322 . . . . 0.0 110.749 -175.615 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 56.7 mt -61.12 -46.51 96.49 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.332 0 N-CA-C 108.292 -1.003 . . . . 0.0 108.292 173.713 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 30' ' ' LYS . . . . . 0.505 ' HE2' ' O ' ' A' ' 26' ' ' GLY . 51.2 mtmt -64.74 -31.16 72.26 Favored 'General case' 0 C--N 1.34 0.154 0 CA-C-N 118.155 0.434 . . . . 0.0 111.258 178.268 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 31' ' ' LYS . . . . . 0.486 ' HE2' ' HA ' ' A' ' 31' ' ' LYS . 6.2 mmpt? -63.85 -59.93 3.92 Favored 'General case' 0 C--N 1.338 0.098 0 CA-C-O 119.215 -0.421 . . . . 0.0 111.61 -178.811 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.458 HD12 ' N ' ' A' ' 33' ' ' THR . 1.2 pp -75.51 -16.71 60.26 Favored 'General case' 0 CA--C 1.534 0.343 0 C-N-CA 119.539 -0.865 . . . . 0.0 111.942 -178.182 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 33' ' ' THR . . . . . 0.458 ' N ' HD12 ' A' ' 32' ' ' LEU . 43.5 m -72.47 -38.36 68.23 Favored 'General case' 0 C--N 1.341 0.216 0 N-CA-C 108.656 -0.868 . . . . 0.0 108.656 174.58 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 80.4 m -70.03 -36.5 75.1 Favored 'General case' 0 N--CA 1.452 -0.371 0 N-CA-C 110.168 -0.308 . . . . 0.0 110.168 179.575 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 31.5 t80 -64.8 -36.11 83.26 Favored 'General case' 0 N--CA 1.456 -0.154 0 N-CA-C 109.791 -0.448 . . . . 0.0 109.791 176.045 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -71.36 -35.46 71.12 Favored 'General case' 0 N--CA 1.45 -0.451 0 CA-C-O 119.648 -0.215 . . . . 0.0 111.422 179.253 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 2.3 mm? -69.56 -32.37 71.12 Favored 'General case' 0 N--CA 1.455 -0.182 0 CA-C-O 119.74 -0.172 . . . . 0.0 110.578 179.858 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 40.2 t0 -69.44 -22.87 63.62 Favored 'General case' 0 N--CA 1.454 -0.246 0 O-C-N 122.9 0.125 . . . . 0.0 110.745 176.283 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 77.8 m80 -150.65 101.8 2.96 Favored 'General case' 0 N--CA 1.453 -0.305 0 N-CA-C 112.583 0.586 . . . . 0.0 112.583 -174.931 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 40' ' ' ILE . . . . . 0.606 ' H ' HD13 ' A' ' 40' ' ' ILE . 0.0 OUTLIER -74.56 -9.54 12.96 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.247 0 N-CA-C 109.701 -0.481 . . . . 0.0 109.701 170.865 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 34.0 m-20 -56.72 -17.64 9.69 Favored 'General case' 0 N--CA 1.457 -0.08 0 C-N-CA 124.3 1.04 . . . . 0.0 112.541 -178.92 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -120.08 17.96 6.37 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.267 0 C-N-CA 123.825 0.85 . . . . 0.0 111.461 -178.435 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 2.9 pp20? -52.64 -32.88 44.18 Favored 'General case' 0 CA--C 1.532 0.254 0 O-C-N 121.823 -0.548 . . . . 0.0 111.103 178.159 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 40.3 t -61.16 -46.66 89.6 Favored 'General case' 0 CA--C 1.531 0.242 0 N-CA-C 112.318 0.488 . . . . 0.0 112.318 -178.958 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 45' ' ' LYS . . . . . 0.522 ' HD3' ' CE1' ' A' ' 7' ' ' PHE . 19.1 ptpt -73.84 -24.13 59.73 Favored 'General case' 0 C--N 1.343 0.299 0 O-C-N 121.577 -0.702 . . . . 0.0 110.153 179.897 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 64.1 mt -71.65 -48.98 49.22 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.278 0 N-CA-C 109.733 -0.469 . . . . 0.0 109.733 -179.676 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 47' ' ' ILE . . . . . 0.455 HD13 HD11 ' A' ' 50' ' ' ILE . 39.4 mm -63.76 -35.93 74.8 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.237 0 N-CA-C 109.626 -0.509 . . . . 0.0 109.626 178.28 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 40.3 t -63.78 -43.48 96.24 Favored 'General case' 0 N--CA 1.455 -0.18 0 O-C-N 122.263 -0.273 . . . . 0.0 111.626 -178.985 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 33.3 mt -75.43 -33.22 60.89 Favored 'General case' 0 N--CA 1.449 -0.498 0 N-CA-C 113.23 0.826 . . . . 0.0 113.23 -176.286 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 50' ' ' ILE . . . . . 0.455 HD11 HD13 ' A' ' 47' ' ' ILE . 5.1 pt -72.65 -43.97 61.03 Favored 'Isoleucine or valine' 0 C--O 1.23 0.075 0 CA-C-N 119.284 0.947 . . . . 0.0 110.787 179.702 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 21.3 pt -62.21 -40.29 87.13 Favored 'Isoleucine or valine' 0 C--N 1.339 0.145 0 C-N-CA 119.628 -0.829 . . . . 0.0 109.962 178.366 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 94.0 m-20 -70.8 -33.62 70.91 Favored 'General case' 0 N--CA 1.455 -0.18 0 CA-C-N 118.061 0.392 . . . . 0.0 111.78 177.787 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 53' ' ' TYR . . . . . 0.455 ' CD2' ' HB2' ' A' ' 65' ' ' SER . 20.8 t80 -67.67 -34.26 76.57 Favored 'General case' 0 N--CA 1.454 -0.248 0 CA-C-N 118.535 0.607 . . . . 0.0 109.667 177.017 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 35.6 t -81.76 -18.26 44.84 Favored 'General case' 0 C--N 1.338 0.075 0 N-CA-C 111.882 0.327 . . . . 0.0 111.882 178.011 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 32.0 ttp180 -93.89 -42.86 8.86 Favored 'General case' 0 N--CA 1.453 -0.314 0 N-CA-C 112.797 0.666 . . . . 0.0 112.797 -178.19 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 41.8 mt -86.3 -49.37 7.72 Favored 'General case' 0 C--N 1.338 0.093 0 N-CA-C 113.407 0.892 . . . . 0.0 113.407 -175.222 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 57' ' ' CYS . . . . . 0.41 ' HB3' ' CD ' ' A' ' 58' ' ' PRO . 84.2 m -72.34 166.72 39.01 Favored Pre-proline 0 CA--C 1.533 0.326 0 N-CA-C 113.248 0.832 . . . . 0.0 113.248 -170.996 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 58' ' ' PRO . . . . . 0.41 ' CD ' ' HB3' ' A' ' 57' ' ' CYS . 35.6 Cg_exo -61.38 166.46 11.22 Favored 'Trans proline' 0 N--CA 1.453 -0.909 1 C-N-CA 125.816 4.344 . . . . 0.0 113.404 -175.178 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 31.8 p-10 -53.86 -44.66 70.56 Favored 'General case' 0 C--N 1.329 -0.314 0 C-N-CA 125.146 1.378 . . . . 0.0 113.618 -171.328 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 9.3 t -71.73 -29.13 64.19 Favored 'General case' 0 N--CA 1.452 -0.354 0 O-C-N 122.049 -0.407 . . . . 0.0 110.151 -179.623 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 52.8 m80 -75.82 -29.47 58.68 Favored 'General case' 0 N--CA 1.452 -0.361 0 C-N-CA 122.692 0.397 . . . . 0.0 109.965 176.104 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 59.1 mttm -61.93 -41.81 98.38 Favored 'General case' 0 C--N 1.341 0.197 0 N-CA-C 109.559 -0.534 . . . . 0.0 109.559 173.164 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 63' ' ' LEU . . . . . 0.466 HD23 HG13 ' A' ' 124' ' ' ILE . 3.0 tm? -63.03 -45.5 92.0 Favored 'General case' 0 N--CA 1.455 -0.222 0 N-CA-C 109.024 -0.732 . . . . 0.0 109.024 177.227 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -61.53 -27.17 67.55 Favored Glycine 0 C--N 1.339 0.729 0 N-CA-C 112.108 -0.397 . . . . 0.0 112.108 -178.95 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 65' ' ' SER . . . . . 0.455 ' HB2' ' CD2' ' A' ' 53' ' ' TYR . 30.1 t -74.66 -39.02 62.29 Favored 'General case' 0 N--CA 1.451 -0.397 0 CA-C-N 117.694 0.747 . . . . 0.0 110.561 176.795 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 82.9 mt -66.21 -23.49 66.44 Favored 'General case' 0 N--CA 1.452 -0.365 0 N-CA-C 109.721 -0.474 . . . . 0.0 109.721 177.546 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 2.3 m-30 -73.69 -39.33 64.44 Favored 'General case' 0 C--O 1.233 0.226 0 C-N-CA 122.397 0.279 . . . . 0.0 110.428 173.926 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 68' ' ' ILE . . . . . 0.515 HD11 ' CE1' ' A' ' 17' ' ' PHE . 31.5 mt -64.88 -51.19 70.0 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.543 0 N-CA-C 107.51 -1.293 . . . . 0.0 107.51 177.055 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 69' ' ' ILE . . . . . 0.451 HG12 HD12 ' A' ' 50' ' ' ILE . 43.5 mt -50.26 -36.84 13.45 Favored 'Isoleucine or valine' 0 CA--C 1.528 0.133 0 C-N-CA 124.21 1.004 . . . . 0.0 111.778 174.828 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 16.6 t70 -69.87 -53.86 16.1 Favored 'General case' 0 N--CA 1.455 -0.193 0 CA-C-N 118.774 0.715 . . . . 0.0 111.116 180.0 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 79.2 p -67.89 -46.72 70.83 Favored 'General case' 0 N--CA 1.451 -0.42 0 CA-C-N 116.717 -0.22 . . . . 0.0 110.772 -174.96 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -74.84 -35.03 35.1 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.133 0 N-CA-C 109.359 -0.608 . . . . 0.0 109.359 -179.172 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -65.82 -50.76 51.41 Favored Glycine 0 C--N 1.339 0.724 0 N-CA-C 111.58 -0.608 . . . . 0.0 111.58 -175.836 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 41.7 mtm105 -69.73 -38.56 76.91 Favored 'General case' 0 N--CA 1.451 -0.4 0 CA-C-N 117.267 0.533 . . . . 0.0 110.227 179.061 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -66.57 -32.68 74.17 Favored 'General case' 0 N--CA 1.451 -0.391 0 C-N-CA 120.714 -0.395 . . . . 0.0 110.743 -179.101 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 1.0 OUTLIER -68.72 -43.52 75.79 Favored 'General case' 0 CA--C 1.518 -0.28 0 CA-C-N 118.527 0.603 . . . . 0.0 110.297 176.091 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 77' ' ' LEU . . . . . 0.427 ' C ' HD13 ' A' ' 77' ' ' LEU . 3.0 tm? -64.89 -47.72 76.81 Favored 'General case' 0 N--CA 1.448 -0.534 0 C-N-CA 118.359 -1.336 . . . . 0.0 108.049 178.978 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 46.9 m-20 -58.25 -43.65 87.95 Favored 'General case' 0 C--O 1.23 0.065 0 N-CA-C 112.38 0.511 . . . . 0.0 112.38 -178.063 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 10.4 tm-20 -63.96 -45.06 90.78 Favored 'General case' 0 N--CA 1.447 -0.583 0 CA-C-N 118.186 0.448 . . . . 0.0 110.623 -177.81 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 61.2 p -69.8 -37.62 76.37 Favored 'General case' 0 N--CA 1.453 -0.321 0 CA-C-O 118.927 -0.559 . . . . 0.0 111.1 -177.136 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 7.4 ppt_? -75.85 -16.55 60.05 Favored 'General case' 0 C--N 1.341 0.211 0 CA-C-N 118.823 0.738 . . . . 0.0 111.627 178.05 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 36.9 m . . . . . 0 N--CA 1.456 -0.145 0 N-CA-C 112.353 0.501 . . . . 0.0 112.353 179.132 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_endo . . . . . 0 N--CA 1.453 -0.875 0 N-CA-C 110.384 -0.66 . . . . 0.0 110.384 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 96.04 17.29 35.41 Favored Glycine 0 CA--C 1.523 0.586 0 CA-C-O 119.363 -0.687 . . . . 0.0 112.908 177.071 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 35.2 p -151.77 169.24 22.7 Favored 'General case' 0 CA--C 1.518 -0.266 0 C-N-CA 123.907 0.883 . . . . 0.0 109.227 175.974 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 94' ' ' CYS . . . . . 0.432 ' HA ' ' HB3' ' A' ' 97' ' ' ALA . 1.8 p -67.16 -16.95 64.63 Favored 'General case' 0 N--CA 1.447 -0.612 0 N-CA-C 109.692 -0.485 . . . . 0.0 109.692 178.599 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -62.91 -57.24 11.46 Favored 'General case' 0 N--CA 1.449 -0.5 0 N-CA-C 109.833 -0.432 . . . . 0.0 109.833 -177.104 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 72.9 t60 -72.39 -31.25 65.4 Favored 'General case' 0 N--CA 1.451 -0.408 0 N-CA-C 110.208 -0.293 . . . . 0.0 110.208 179.243 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 97' ' ' ALA . . . . . 0.432 ' HB3' ' HA ' ' A' ' 94' ' ' CYS . . . -65.67 -56.56 11.5 Favored 'General case' 0 N--CA 1.451 -0.417 0 O-C-N 123.274 0.359 . . . . 0.0 111.517 -178.32 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 2.1 mp -67.72 -34.62 68.95 Favored 'Isoleucine or valine' 0 C--N 1.34 0.195 0 C-N-CA 120.494 -0.483 . . . . 0.0 110.456 -179.13 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 69.2 m-20 -66.71 -45.1 79.82 Favored 'General case' 0 N--CA 1.45 -0.448 0 CA-C-N 118.157 0.435 . . . . 0.0 111.509 179.534 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 98.3 m -69.12 -29.62 67.72 Favored 'General case' 0 C--N 1.338 0.088 0 CA-C-N 117.976 0.353 . . . . 0.0 110.455 -177.227 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 62.2 tp -74.11 -33.98 63.77 Favored 'General case' 0 N--CA 1.447 -0.607 0 C-N-CA 122.758 0.423 . . . . 0.0 110.431 179.558 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -67.59 -17.4 68.86 Favored Glycine 0 CA--C 1.526 0.774 0 CA-C-O 119.636 -0.536 . . . . 0.0 112.845 -177.232 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 25.5 mt-10 -79.5 -25.93 41.7 Favored 'General case' 0 C--N 1.338 0.096 0 CA-C-N 118.004 0.902 . . . . 0.0 111.316 -179.696 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 25.3 m -116.92 -6.67 11.91 Favored 'Isoleucine or valine' 0 C--O 1.23 0.061 0 N-CA-C 112.924 0.713 . . . . 0.0 112.924 -174.687 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 105' ' ' ILE . . . . . . . . . . . . . 17.5 tt -60.09 -23.07 26.17 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.25 0 CA-C-N 118.979 0.809 . . . . 0.0 111.635 -179.694 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 25.7 pt20 -61.6 -35.0 76.62 Favored 'General case' 0 N--CA 1.45 -0.447 0 C-N-CA 122.867 0.467 . . . . 0.0 110.19 175.906 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 49.2 mt-10 -71.95 -40.88 68.39 Favored 'General case' 0 N--CA 1.454 -0.232 0 N-CA-C 109.454 -0.573 . . . . 0.0 109.454 -179.828 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 20.2 mt -73.0 -40.87 64.84 Favored 'General case' 0 N--CA 1.449 -0.512 0 CA-C-N 115.899 -0.592 . . . . 0.0 110.706 -173.283 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 84.7 mt -68.56 -63.17 1.11 Allowed 'General case' 0 N--CA 1.448 -0.539 0 N-CA-C 109.626 -0.509 . . . . 0.0 109.626 178.517 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 24.4 p -46.0 -48.37 16.63 Favored 'General case' 0 CA--C 1.52 -0.183 0 C-N-CA 122.613 0.365 . . . . 0.0 111.976 -177.329 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 39.3 t0 -70.66 -35.99 73.14 Favored 'General case' 0 N--CA 1.447 -0.579 0 CA-C-N 116.882 -0.144 . . . . 0.0 110.977 -176.148 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -72.88 -31.54 64.77 Favored 'General case' 0 N--CA 1.448 -0.528 0 C-N-CA 120.882 -0.327 . . . . 0.0 110.735 -178.487 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 113' ' ' ILE . . . . . . . . . . . . . 45.4 mm -68.33 -40.86 83.12 Favored 'Isoleucine or valine' 0 C--N 1.339 0.111 0 N-CA-C 108.892 -0.781 . . . . 0.0 108.892 176.316 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -72.78 -38.3 67.33 Favored 'General case' 0 N--CA 1.45 -0.441 0 CA-C-N 115.697 -0.683 . . . . 0.0 111.926 -177.562 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -90.46 -33.53 15.95 Favored 'General case' 0 N--CA 1.453 -0.283 0 N-CA-C 113.844 1.053 . . . . 0.0 113.844 -174.968 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 116' ' ' SER . . . . . 0.525 ' O ' ' HE3' ' A' ' 121' ' ' LYS . 1.0 OUTLIER -89.4 160.47 16.8 Favored 'General case' 0 C--N 1.339 0.111 0 N-CA-C 113.45 0.907 . . . . 0.0 113.45 -167.886 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 46.4 t30 -75.51 169.69 17.6 Favored 'General case' 0 C--O 1.226 -0.164 0 C-N-CA 123.983 0.913 . . . . 0.0 111.872 -173.941 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 118' ' ' GLN . . . . . . . . . . . . . 14.8 mm100 -54.37 -37.23 64.74 Favored 'General case' 0 C--N 1.338 0.094 0 C-N-CA 124.03 0.932 . . . . 0.0 112.954 -173.456 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 16.7 p-10 -69.28 -43.3 74.16 Favored 'General case' 0 N--CA 1.453 -0.301 0 N-CA-C 109.393 -0.595 . . . . 0.0 109.393 179.401 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 78.8 m-70 -69.22 -36.12 76.9 Favored 'General case' 0 N--CA 1.45 -0.444 0 CA-C-O 119.311 -0.376 . . . . 0.0 110.939 177.949 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 121' ' ' LYS . . . . . 0.525 ' HE3' ' O ' ' A' ' 116' ' ' SER . 89.8 mttt -58.49 -40.91 84.08 Favored 'General case' 0 C--O 1.231 0.129 0 N-CA-C 108.793 -0.817 . . . . 0.0 108.793 176.063 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 38.3 tp10 -73.99 -35.13 64.41 Favored 'General case' 0 N--CA 1.451 -0.378 0 C-N-CA 122.32 0.248 . . . . 0.0 110.93 179.849 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 84.9 mttt -63.95 -37.65 88.2 Favored 'General case' 0 N--CA 1.453 -0.296 0 N-CA-C 109.546 -0.538 . . . . 0.0 109.546 177.572 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 124' ' ' ILE . . . . . 0.466 HG13 HD23 ' A' ' 63' ' ' LEU . 56.4 mt -66.05 -38.92 83.11 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.182 0 N-CA-C 110.032 -0.359 . . . . 0.0 110.032 174.737 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 17.5 mtp180 -66.43 -42.31 87.91 Favored 'General case' 0 C--N 1.34 0.158 0 C-N-CA 122.404 0.282 . . . . 0.0 111.398 -177.356 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 126' ' ' MET . . . . . . . . . . . . . 17.8 ptp -68.42 -31.55 70.96 Favored 'General case' 0 N--CA 1.452 -0.325 0 C-N-CA 119.613 -0.835 . . . . 0.0 109.424 176.482 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 2.2 mp -63.25 -35.39 80.18 Favored 'General case' 0 N--CA 1.454 -0.267 0 N-CA-C 109.695 -0.483 . . . . 0.0 109.695 177.245 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 99.2 mt -68.34 -38.15 81.22 Favored 'General case' 0 N--CA 1.454 -0.256 0 CA-C-N 118.471 0.578 . . . . 0.0 110.049 177.687 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 14.9 t0 -65.49 -45.63 82.84 Favored 'General case' 0 CA--C 1.531 0.212 0 CA-C-N 118.055 0.389 . . . . 0.0 110.052 175.567 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 51.5 mt -61.11 -34.11 58.86 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.296 0 C-N-CA 123.031 0.532 . . . . 0.0 110.202 -178.721 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 131' ' ' TRP . . . . . . . . . . . . . 50.5 m0 . . . . . 0 N--CA 1.452 -0.371 0 N-CA-C 112.928 0.714 . . . . 0.0 112.928 179.271 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 21.2 p-10 . . . . . 0 N--CA 1.457 -0.111 0 N-CA-C 108.032 -1.099 . . . . 0.0 108.032 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 7' ' ' PHE . . . . . 0.498 ' CD1' ' HD3' ' A' ' 45' ' ' LYS . 1.2 t80 -55.03 -30.47 59.62 Favored 'General case' 0 N--CA 1.445 -0.695 0 C-N-CA 126.09 1.756 . . . . 0.0 111.213 -178.02 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 52.1 tp60 -50.48 -36.51 33.97 Favored 'General case' 0 N--CA 1.455 -0.218 0 C-N-CA 124.125 0.97 . . . . 0.0 111.878 -177.679 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 33.8 m-80 -72.36 -36.36 68.75 Favored 'General case' 0 N--CA 1.454 -0.251 0 CA-C-N 117.939 0.336 . . . . 0.0 110.294 -179.195 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 1.9 t80 -70.84 -39.27 73.08 Favored 'General case' 0 N--CA 1.452 -0.336 0 C-N-CA 123.519 0.728 . . . . 0.0 109.044 178.008 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 76.6 t -66.59 -53.02 39.58 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.385 0 N-CA-C 108.776 -0.824 . . . . 0.0 108.776 179.446 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -60.07 -31.25 69.83 Favored 'General case' 0 N--CA 1.454 -0.267 0 C-N-CA 122.759 0.424 . . . . 0.0 111.839 -178.517 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 86.6 m -67.53 -43.78 79.95 Favored 'General case' 0 CA--C 1.531 0.241 0 N-CA-C 108.691 -0.855 . . . . 0.0 108.691 176.488 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.443 HD22 ' HG ' ' A' ' 49' ' ' LEU . 5.5 tp -69.36 -39.56 78.02 Favored 'General case' 0 N--CA 1.452 -0.356 0 CA-C-N 116.418 -0.355 . . . . 0.0 111.278 -179.559 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 69.4 mm-40 -62.73 -33.76 75.8 Favored 'General case' 0 N--CA 1.451 -0.421 0 C-N-CA 123.596 0.758 . . . . 0.0 109.206 178.226 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 49.5 m -66.21 -32.89 74.59 Favored 'General case' 0 N--CA 1.451 -0.412 0 N-CA-C 108.881 -0.785 . . . . 0.0 108.881 176.774 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 17' ' ' PHE . . . . . 0.467 ' CE2' ' HB3' ' A' ' 25' ' ' SER . 14.8 m-30 -69.83 -33.82 72.83 Favored 'General case' 0 C--N 1.339 0.126 0 N-CA-C 112.2 0.444 . . . . 0.0 112.2 174.904 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 70.5 mttt -64.54 -27.08 68.72 Favored 'General case' 0 C--N 1.339 0.134 0 N-CA-C 109.243 -0.651 . . . . 0.0 109.243 174.944 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 43.8 t0 -79.41 -22.24 44.54 Favored 'General case' 0 CA--C 1.535 0.368 0 CA-C-N 115.701 -0.681 . . . . 0.0 111.898 177.009 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 81.1 mt -72.65 148.54 44.69 Favored 'General case' 0 N--CA 1.457 -0.11 0 O-C-N 121.152 -0.968 . . . . 0.0 110.674 179.649 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 1.6 mppt? -86.73 20.31 2.6 Favored 'General case' 0 CA--C 1.534 0.351 0 CA-C-N 115.653 -0.703 . . . . 0.0 109.33 175.713 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 79.9 p -147.46 -32.51 0.29 Allowed 'General case' 0 CA--C 1.53 0.198 0 C-N-CA 123.953 0.901 . . . . 0.0 111.237 -176.803 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 80.07 -19.91 6.17 Favored Glycine 0 CA--C 1.527 0.841 0 CA-C-O 119.601 -0.555 . . . . 0.0 113.63 176.194 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 96.3 mt -89.86 145.88 6.86 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.128 0 CA-C-N 118.059 0.93 . . . . 0.0 109.549 176.188 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 25' ' ' SER . . . . . 0.467 ' HB3' ' CE2' ' A' ' 17' ' ' PHE . 33.4 t -166.71 88.53 0.34 Allowed 'General case' 0 N--CA 1.455 -0.225 0 CA-C-N 117.679 0.218 . . . . 0.0 110.813 176.517 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -47.58 -56.55 8.27 Favored Glycine 0 CA--C 1.528 0.861 0 CA-C-O 119.111 -0.827 . . . . 0.0 114.623 -170.753 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 27' ' ' SER . . . . . 0.588 ' HA ' ' HE3' ' A' ' 30' ' ' LYS . 38.9 m -63.55 -36.25 83.17 Favored 'General case' 0 CA--C 1.524 -0.027 0 CA-C-N 119.2 1.5 . . . . 0.0 112.026 -176.328 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -75.76 -37.54 59.17 Favored 'General case' 0 CA--C 1.529 0.172 0 N-CA-C 109.846 -0.427 . . . . 0.0 109.846 179.079 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 60.6 mt -58.03 -42.82 83.72 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.501 0 N-CA-C 108.237 -1.023 . . . . 0.0 108.237 172.163 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 30' ' ' LYS . . . . . 0.588 ' HE3' ' HA ' ' A' ' 27' ' ' SER . 45.2 mtmt -69.1 -23.36 63.99 Favored 'General case' 0 N--CA 1.454 -0.226 0 CA-C-O 118.846 -0.597 . . . . 0.0 111.497 178.777 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 31' ' ' LYS . . . . . 0.469 ' CE ' ' HA ' ' A' ' 31' ' ' LYS . 3.9 mmpt? -67.64 -51.59 48.18 Favored 'General case' 0 C--N 1.34 0.183 0 CA-C-N 118.904 0.775 . . . . 0.0 110.314 175.405 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 4.2 pp -75.0 -23.25 58.21 Favored 'General case' 0 CA--C 1.531 0.227 0 C-N-CA 119.943 -0.703 . . . . 0.0 110.671 179.431 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 33' ' ' THR . . . . . 0.402 ' HB ' ' HA ' ' A' ' 30' ' ' LYS . 51.9 m -71.54 -39.34 70.76 Favored 'General case' 0 CA--C 1.523 -0.095 0 N-CA-C 109.678 -0.489 . . . . 0.0 109.678 177.125 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 99.7 m -70.61 -41.46 72.22 Favored 'General case' 0 N--CA 1.45 -0.47 0 N-CA-C 109.685 -0.487 . . . . 0.0 109.685 -177.881 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 29.1 t80 -66.07 -30.29 70.78 Favored 'General case' 0 N--CA 1.453 -0.282 0 C-N-CA 119.772 -0.771 . . . . 0.0 109.815 178.206 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -71.03 -27.86 63.97 Favored 'General case' 0 N--CA 1.449 -0.489 0 CA-C-O 119.492 -0.289 . . . . 0.0 111.375 176.102 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 37' ' ' LEU . . . . . 0.405 HD23 ' HA ' ' A' ' 37' ' ' LEU . 11.4 mt -81.18 -39.63 25.17 Favored 'General case' 0 CA--C 1.519 -0.242 0 N-CA-C 108.926 -0.768 . . . . 0.0 108.926 -179.943 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 86.1 m-20 -58.65 -30.79 67.58 Favored 'General case' 0 N--CA 1.44 -0.949 0 C-N-CA 123.843 0.857 . . . . 0.0 110.633 175.076 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 78.4 m80 -149.93 103.3 3.2 Favored 'General case' 0 N--CA 1.453 -0.306 0 C-N-CA 122.885 0.474 . . . . 0.0 111.299 179.147 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 40' ' ' ILE . . . . . 0.638 ' H ' HD13 ' A' ' 40' ' ' ILE . 0.0 OUTLIER -75.72 -9.92 13.1 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.449 0 N-CA-C 109.136 -0.69 . . . . 0.0 109.136 172.672 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 4.6 m-20 -55.21 -25.11 30.95 Favored 'General case' 0 N--CA 1.455 -0.224 0 C-N-CA 124.026 0.931 . . . . 0.0 111.58 -177.744 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -105.62 16.33 6.45 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.328 0 C-N-CA 123.454 0.701 . . . . 0.0 112.105 -179.656 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 2.7 pp20? -52.31 -31.31 32.48 Favored 'General case' 0 CA--C 1.529 0.135 0 CA-C-N 118.641 0.655 . . . . 0.0 111.051 178.583 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 40.8 t -62.27 -46.85 86.95 Favored 'General case' 0 CA--C 1.531 0.238 0 N-CA-C 112.265 0.469 . . . . 0.0 112.265 -177.879 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 45' ' ' LYS . . . . . 0.498 ' HD3' ' CD1' ' A' ' 7' ' ' PHE . 14.6 ptpt -74.34 -23.49 59.05 Favored 'General case' 0 C--N 1.341 0.219 0 O-C-N 121.892 -0.505 . . . . 0.0 110.149 179.21 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 85.5 mt -73.74 -47.81 42.45 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.307 0 N-CA-C 110.059 -0.348 . . . . 0.0 110.059 -178.697 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 40.7 mm -66.93 -38.28 81.08 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.13 0 N-CA-C 109.781 -0.452 . . . . 0.0 109.781 179.415 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 27.8 t -64.78 -34.25 77.91 Favored 'General case' 0 N--CA 1.454 -0.258 0 C-N-CA 121.103 -0.239 . . . . 0.0 110.459 178.14 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 49' ' ' LEU . . . . . 0.454 HD22 ' CE1' ' A' ' 7' ' ' PHE . 40.9 tp -75.15 -34.51 61.63 Favored 'General case' 0 N--CA 1.452 -0.353 0 N-CA-C 112.673 0.62 . . . . 0.0 112.673 -176.605 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 11.4 pt -71.23 -43.21 74.73 Favored 'Isoleucine or valine' 0 C--N 1.339 0.151 0 CA-C-N 118.459 0.572 . . . . 0.0 110.162 178.574 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 35.4 pt -65.29 -39.77 86.41 Favored 'Isoleucine or valine' 0 C--O 1.231 0.103 0 C-N-CA 119.87 -0.732 . . . . 0.0 110.842 -178.516 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 78.3 m-20 -65.11 -51.46 61.14 Favored 'General case' 0 N--CA 1.454 -0.254 0 CA-C-N 117.462 0.119 . . . . 0.0 111.214 179.04 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 53' ' ' TYR . . . . . 0.421 ' CB ' HD21 ' A' ' 14' ' ' LEU . 15.9 t80 -63.95 -45.54 88.72 Favored 'General case' 0 N--CA 1.453 -0.306 0 N-CA-C 110.1 -0.334 . . . . 0.0 110.1 -179.293 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 31.7 t -65.2 -29.9 70.75 Favored 'General case' 0 N--CA 1.455 -0.216 0 N-CA-C 112.646 0.61 . . . . 0.0 112.646 -175.204 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 17.0 tpt85 -82.14 -36.67 27.2 Favored 'General case' 0 N--CA 1.454 -0.235 0 C-N-CA 119.697 -0.801 . . . . 0.0 111.193 -178.492 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 57.7 mt -80.98 -43.26 19.93 Favored 'General case' 0 C--O 1.227 -0.111 0 N-CA-C 112.764 0.654 . . . . 0.0 112.764 -178.482 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 57' ' ' CYS . . . . . 0.466 ' HB2' ' HD2' ' A' ' 58' ' ' PRO . 13.3 p -62.06 159.78 35.09 Favored Pre-proline 0 CA--C 1.536 0.419 0 N-CA-C 112.875 0.695 . . . . 0.0 112.875 -173.93 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 58' ' ' PRO . . . . . 0.466 ' HD2' ' HB2' ' A' ' 57' ' ' CYS . 84.3 Cg_endo -74.7 169.94 21.45 Favored 'Trans proline' 0 N--CA 1.451 -1.014 0 C-N-CA 124.209 3.272 . . . . 0.0 110.183 179.4 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -50.5 -47.04 57.45 Favored 'General case' 0 N--CA 1.457 -0.124 0 N-CA-C 114.287 1.218 . . . . 0.0 114.287 -170.795 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 16.6 t -66.79 -32.1 73.16 Favored 'General case' 0 N--CA 1.455 -0.198 0 C-N-CA 119.539 -0.864 . . . . 0.0 110.038 -177.323 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 54.8 m170 -76.03 -27.55 57.36 Favored 'General case' 0 N--CA 1.453 -0.276 0 N-CA-C 109.973 -0.38 . . . . 0.0 109.973 177.221 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 68.0 mttm -65.73 -39.87 91.58 Favored 'General case' 0 C--N 1.343 0.305 0 N-CA-C 109.106 -0.702 . . . . 0.0 109.106 174.074 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -63.08 -41.64 99.46 Favored 'General case' 0 N--CA 1.452 -0.374 0 N-CA-C 108.283 -1.006 . . . . 0.0 108.283 176.702 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -67.63 -31.56 76.51 Favored Glycine 0 CA--C 1.525 0.704 0 CA-C-O 119.713 -0.493 . . . . 0.0 112.271 -179.197 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 22.6 t -74.28 -32.75 63.02 Favored 'General case' 0 N--CA 1.453 -0.277 0 CA-C-N 118.118 0.959 . . . . 0.0 110.566 178.157 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 69.1 mt -71.99 -24.86 61.64 Favored 'General case' 0 N--CA 1.452 -0.328 0 N-CA-C 109.336 -0.616 . . . . 0.0 109.336 176.037 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -72.47 -36.88 68.59 Favored 'General case' 0 N--CA 1.455 -0.19 0 N-CA-C 110.333 -0.247 . . . . 0.0 110.333 174.533 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 68' ' ' ILE . . . . . . . . . . . . . 27.1 mt -66.65 -49.58 73.53 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.356 0 N-CA-C 108.811 -0.811 . . . . 0.0 108.811 174.886 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 67.1 mt -54.14 -34.68 27.43 Favored 'Isoleucine or valine' 0 C--O 1.226 -0.177 0 C-N-CA 123.085 0.554 . . . . 0.0 111.702 175.78 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 28.9 t70 -68.3 -44.58 75.11 Favored 'General case' 0 N--CA 1.452 -0.331 0 CA-C-N 119.112 0.869 . . . . 0.0 110.651 176.538 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 31.9 t -67.45 -57.22 6.93 Favored 'General case' 0 N--CA 1.451 -0.382 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.926 -176.804 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 72' ' ' ILE . . . . . 0.408 HD11 ' CZ ' ' A' ' 76' ' ' TYR . 0.0 OUTLIER -75.12 -30.58 23.38 Favored 'Isoleucine or valine' 0 CA--C 1.523 -0.075 0 N-CA-C 110.465 -0.198 . . . . 0.0 110.465 -177.469 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -68.49 -54.3 16.64 Favored Glycine 0 C--N 1.336 0.545 0 N-CA-C 111.582 -0.607 . . . . 0.0 111.582 -175.774 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 44.3 mtm105 -69.75 -37.34 76.4 Favored 'General case' 0 N--CA 1.452 -0.327 0 C-N-CA 120.273 -0.571 . . . . 0.0 109.737 179.294 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -60.29 -37.02 79.22 Favored 'General case' 0 N--CA 1.45 -0.456 0 C-N-CA 120.299 -0.56 . . . . 0.0 110.323 179.486 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 76' ' ' TYR . . . . . 0.408 ' CZ ' HD11 ' A' ' 72' ' ' ILE . 2.1 m-30 -68.05 -54.08 20.94 Favored 'General case' 0 N--CA 1.451 -0.378 0 CA-C-N 118.075 0.398 . . . . 0.0 111.045 178.765 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 1.5 tt -67.84 -42.27 81.66 Favored 'General case' 0 N--CA 1.448 -0.531 0 C-N-CA 118.813 -1.155 . . . . 0.0 109.003 -174.837 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 79.6 m-20 -61.72 -49.45 76.4 Favored 'General case' 0 CA--C 1.531 0.235 0 N-CA-C 112.946 0.721 . . . . 0.0 112.946 179.07 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 65.5 mm-40 -66.32 -42.96 87.5 Favored 'General case' 0 C--N 1.34 0.158 0 CA-C-N 119.452 1.024 . . . . 0.0 111.688 -178.279 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 42.6 p -65.03 -35.34 80.87 Favored 'General case' 0 N--CA 1.45 -0.432 0 N-CA-C 109.737 -0.468 . . . . 0.0 109.737 178.15 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 33.1 ttp180 -69.16 -43.22 74.71 Favored 'General case' 0 N--CA 1.45 -0.432 0 C-N-CA 123.613 0.765 . . . . 0.0 111.792 179.259 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 42.0 t . . . . . 0 N--CA 1.454 -0.254 0 N-CA-C 113.568 0.951 . . . . 0.0 113.568 -176.56 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 70.5 Cg_exo . . . . . 0 N--CA 1.45 -1.075 0 N-CA-C 109.727 -0.913 . . . . 0.0 109.727 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 92.69 20.27 34.86 Favored Glycine 0 CA--C 1.528 0.851 0 CA-C-O 119.21 -0.772 . . . . 0.0 112.487 -178.246 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 60.6 p -151.67 167.61 27.61 Favored 'General case' 0 CA--C 1.522 -0.119 0 CA-C-N 118.11 0.955 . . . . 0.0 110.26 176.118 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 94' ' ' CYS . . . . . 0.461 ' HB2' HD13 ' A' ' 98' ' ' ILE . 17.2 p -59.51 -24.69 63.85 Favored 'General case' 0 N--CA 1.449 -0.512 0 CA-C-N 115.623 -0.717 . . . . 0.0 109.779 175.794 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -63.4 -57.65 9.61 Favored 'General case' 0 N--CA 1.446 -0.656 0 N-CA-C 109.376 -0.601 . . . . 0.0 109.376 -173.59 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 66.5 t60 -74.78 -29.28 61.06 Favored 'General case' 0 N--CA 1.449 -0.524 0 CA-C-N 116.553 -0.294 . . . . 0.0 110.631 -179.464 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -67.41 -54.52 19.7 Favored 'General case' 0 N--CA 1.452 -0.336 0 N-CA-C 111.643 0.238 . . . . 0.0 111.643 -179.125 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 98' ' ' ILE . . . . . 0.461 HD13 ' HB2' ' A' ' 94' ' ' CYS . 2.5 mp -70.0 -31.51 48.05 Favored 'Isoleucine or valine' 0 C--N 1.341 0.202 0 C-N-CA 120.817 -0.353 . . . . 0.0 110.504 -179.577 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 77.0 m-20 -68.65 -38.25 80.32 Favored 'General case' 0 N--CA 1.452 -0.37 0 CA-C-N 118.458 0.572 . . . . 0.0 111.379 176.544 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 58.2 m -73.14 -36.93 66.77 Favored 'General case' 0 N--CA 1.454 -0.228 0 CA-C-N 117.996 0.362 . . . . 0.0 110.378 179.874 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 60.0 tp -74.86 -31.92 61.75 Favored 'General case' 0 N--CA 1.452 -0.372 0 C-N-CA 121.394 -0.122 . . . . 0.0 111.089 179.137 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -62.91 -20.86 62.76 Favored Glycine 0 CA--C 1.525 0.71 0 CA-C-O 119.614 -0.548 . . . . 0.0 112.465 -176.047 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 6.1 mm-40 -85.92 -32.77 21.43 Favored 'General case' 0 N--CA 1.456 -0.164 0 CA-C-N 118.213 1.006 . . . . 0.0 111.428 177.711 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 43.9 t -96.06 -19.35 6.25 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.221 0 N-CA-C 112.701 0.63 . . . . 0.0 112.701 -175.415 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 105' ' ' ILE . . . . . . . . . . . . . 10.5 tp -57.59 -24.95 23.42 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.229 0 CA-C-N 118.604 0.638 . . . . 0.0 111.8 -177.025 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 27.5 pt20 -68.17 -25.3 65.18 Favored 'General case' 0 N--CA 1.452 -0.368 0 O-C-N 122.1 -0.375 . . . . 0.0 110.325 178.506 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 65.0 mm-40 -75.58 -39.95 57.31 Favored 'General case' 0 N--CA 1.456 -0.13 0 CA-C-N 118.271 0.487 . . . . 0.0 109.913 176.471 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 8.3 mp -70.56 -41.16 72.81 Favored 'General case' 0 N--CA 1.451 -0.376 0 N-CA-C 109.769 -0.456 . . . . 0.0 109.769 -178.583 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 89.1 mt -67.69 -61.45 1.88 Allowed 'General case' 0 N--CA 1.452 -0.337 0 CA-C-O 119.351 -0.357 . . . . 0.0 110.246 178.451 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 19.5 p -44.36 -51.24 8.69 Favored 'General case' 0 CA--C 1.52 -0.205 0 C-N-CA 122.993 0.517 . . . . 0.0 112.238 -178.076 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 62.3 t0 -63.69 -42.01 98.05 Favored 'General case' 0 N--CA 1.448 -0.539 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.438 -178.047 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -72.42 -35.75 68.44 Favored 'General case' 0 N--CA 1.447 -0.593 0 C-N-CA 120.762 -0.375 . . . . 0.0 111.268 -178.028 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 113' ' ' ILE . . . . . . . . . . . . . 34.9 mm -68.42 -38.27 79.06 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.185 0 CA-C-N 119.185 0.902 . . . . 0.0 109.569 -177.533 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -75.0 -45.46 41.79 Favored 'General case' 0 N--CA 1.451 -0.396 0 CA-C-N 117.471 0.123 . . . . 0.0 111.242 179.765 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 115' ' ' LYS . . . . . 0.611 ' HE2' ' HA ' ' A' ' 115' ' ' LYS . 0.2 OUTLIER -82.07 -31.16 30.94 Favored 'General case' 0 N--CA 1.455 -0.209 0 N-CA-C 113.869 1.063 . . . . 0.0 113.869 -173.111 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 116' ' ' SER . . . . . 0.464 ' HB2' ' CB ' ' A' ' 120' ' ' HIS . 45.5 p -76.39 156.12 33.48 Favored 'General case' 0 CA--C 1.528 0.13 0 N-CA-C 112.261 0.467 . . . . 0.0 112.261 -172.984 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 53.6 t30 -73.02 165.67 24.57 Favored 'General case' 0 N--CA 1.453 -0.277 0 C-N-CA 123.383 0.673 . . . . 0.0 110.708 -178.863 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 118' ' ' GLN . . . . . . . . . . . . . 20.5 mm100 -53.68 -38.1 63.86 Favored 'General case' 0 CA--C 1.531 0.226 0 N-CA-C 112.908 0.707 . . . . 0.0 112.908 -172.765 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 7.5 p-10 -71.65 -38.42 70.71 Favored 'General case' 0 N--CA 1.454 -0.272 0 N-CA-C 109.899 -0.408 . . . . 0.0 109.899 179.227 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 120' ' ' HIS . . . . . 0.464 ' CB ' ' HB2' ' A' ' 116' ' ' SER . 34.3 m170 -65.3 -40.78 94.26 Favored 'General case' 0 N--CA 1.451 -0.406 0 C-N-CA 122.681 0.392 . . . . 0.0 110.044 176.457 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 56.7 mttm -58.55 -42.94 89.02 Favored 'General case' 0 C--N 1.341 0.231 0 N-CA-C 108.895 -0.779 . . . . 0.0 108.895 178.225 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 43.8 tp10 -73.73 -36.5 65.18 Favored 'General case' 0 N--CA 1.451 -0.417 0 CA-C-N 116.661 -0.245 . . . . 0.0 111.468 -176.863 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 13.0 tppt? -62.41 -36.04 81.1 Favored 'General case' 0 N--CA 1.45 -0.431 0 N-CA-C 109.333 -0.617 . . . . 0.0 109.333 177.828 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 124' ' ' ILE . . . . . . . . . . . . . 61.2 mt -69.37 -36.26 71.14 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.261 0 O-C-N 121.957 -0.464 . . . . 0.0 109.892 177.51 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 13.7 mtp-105 -68.05 -35.34 78.07 Favored 'General case' 0 N--CA 1.457 -0.099 0 CA-C-O 119.468 -0.301 . . . . 0.0 111.511 -178.472 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 126' ' ' MET . . . . . . . . . . . . . 27.2 ptm -72.92 -28.01 62.2 Favored 'General case' 0 N--CA 1.455 -0.177 0 C-N-CA 119.488 -0.885 . . . . 0.0 109.452 174.666 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 4.2 mp -65.77 -31.62 72.69 Favored 'General case' 0 CA--C 1.529 0.163 0 CA-C-N 118.084 0.402 . . . . 0.0 110.134 172.999 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 95.6 mt -70.12 -38.72 75.66 Favored 'General case' 0 C--N 1.34 0.19 0 CA-C-N 118.755 0.707 . . . . 0.0 109.868 176.237 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 10.7 t70 -60.37 -44.02 96.01 Favored 'General case' 0 N--CA 1.454 -0.231 0 N-CA-C 109.182 -0.673 . . . . 0.0 109.182 175.561 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 73.9 mt -61.87 -39.07 82.18 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.417 0 CA-C-N 116.418 -0.355 . . . . 0.0 110.632 -179.532 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 131' ' ' TRP . . . . . . . . . . . . . 48.1 m0 . . . . . 0 N--CA 1.45 -0.43 0 N-CA-C 112.355 0.502 . . . . 0.0 112.355 -179.045 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 26.8 p-10 . . . . . 0 N--CA 1.454 -0.27 0 CA-C-O 120.965 0.412 . . . . 0.0 110.017 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 1.6 t80 -53.83 -37.54 63.7 Favored 'General case' 0 N--CA 1.45 -0.461 0 CA-C-N 115.965 -0.561 . . . . 0.0 109.983 178.966 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 53.3 tp60 -56.58 -32.17 64.95 Favored 'General case' 0 N--CA 1.452 -0.369 0 C-N-CA 123.166 0.586 . . . . 0.0 111.813 -177.017 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 13.7 t-20 -71.45 -34.45 70.25 Favored 'General case' 0 N--CA 1.452 -0.346 0 N-CA-C 109.832 -0.433 . . . . 0.0 109.832 177.964 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 10' ' ' PHE . . . . . 0.464 ' CE2' ' HB2' ' A' ' 32' ' ' LEU . 6.7 t80 -68.97 -38.85 79.61 Favored 'General case' 0 N--CA 1.45 -0.43 0 C-N-CA 123.176 0.591 . . . . 0.0 109.5 176.014 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 87.4 t -64.48 -55.14 23.05 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.316 0 N-CA-C 109.092 -0.707 . . . . 0.0 109.092 178.279 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -59.7 -28.45 67.33 Favored 'General case' 0 N--CA 1.452 -0.334 0 C-N-CA 122.973 0.509 . . . . 0.0 112.1 -178.932 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 90.7 m -74.57 -39.94 61.94 Favored 'General case' 0 N--CA 1.456 -0.174 0 N-CA-C 109.222 -0.659 . . . . 0.0 109.222 176.99 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.466 ' HA ' ' CD1' ' A' ' 17' ' ' PHE . 13.0 tp -65.77 -44.48 85.71 Favored 'General case' 0 N--CA 1.452 -0.367 0 N-CA-C 109.3 -0.63 . . . . 0.0 109.3 179.366 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 67.7 mm-40 -62.48 -29.65 70.69 Favored 'General case' 0 N--CA 1.45 -0.458 0 C-N-CA 124.304 1.042 . . . . 0.0 109.446 177.591 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 40.8 t -69.13 -28.44 66.45 Favored 'General case' 0 N--CA 1.451 -0.392 0 CA-C-O 119.052 -0.499 . . . . 0.0 110.147 177.52 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 17' ' ' PHE . . . . . 0.532 ' CD1' HD11 ' A' ' 68' ' ' ILE . 29.2 m-85 -71.98 -36.67 69.86 Favored 'General case' 0 C--N 1.339 0.115 0 CA-C-N 118.693 0.679 . . . . 0.0 110.824 171.979 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 80.6 mttt -63.25 -24.21 67.77 Favored 'General case' 0 C--N 1.339 0.144 0 N-CA-C 110.169 -0.308 . . . . 0.0 110.169 177.429 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 30.1 t0 -76.59 -16.76 59.5 Favored 'General case' 0 CA--C 1.538 0.505 0 N-CA-C 112.466 0.543 . . . . 0.0 112.466 176.697 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 20' ' ' LEU . . . . . 0.405 ' C ' ' HE3' ' A' ' 21' ' ' LYS . 10.1 mt -85.44 161.08 19.56 Favored 'General case' 0 N--CA 1.457 -0.107 0 CA-C-N 118.728 0.694 . . . . 0.0 111.983 -174.043 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 21' ' ' LYS . . . . . 0.51 ' N ' ' HE3' ' A' ' 21' ' ' LYS . 0.8 OUTLIER -82.64 -36.59 25.9 Favored 'General case' 0 N--CA 1.454 -0.229 0 N-CA-C 108.803 -0.814 . . . . 0.0 108.803 176.797 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 35.9 t -90.16 -24.77 20.96 Favored 'General case' 0 C--N 1.341 0.231 0 C-N-CA 124.034 0.934 . . . . 0.0 111.648 -179.791 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 77.7 -10.52 24.14 Favored Glycine 0 CA--C 1.532 1.146 0 CA-C-O 119.675 -0.514 . . . . 0.0 111.896 -177.372 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 70.0 mt -96.05 148.93 4.93 Favored 'Isoleucine or valine' 0 C--N 1.34 0.188 0 CA-C-N 117.507 0.654 . . . . 0.0 111.155 178.447 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 19.1 t -167.68 100.82 0.48 Allowed 'General case' 0 CA--C 1.518 -0.252 0 N-CA-C 108.777 -0.823 . . . . 0.0 108.777 176.177 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -54.67 -45.62 77.68 Favored Glycine 0 CA--C 1.527 0.8 0 C-N-CA 120.861 -0.685 . . . . 0.0 112.025 -175.106 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 8.9 m -64.51 -42.72 95.64 Favored 'General case' 0 N--CA 1.456 -0.135 0 CA-C-N 118.232 1.016 . . . . 0.0 111.349 -177.327 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 28.7 mtt180 -74.63 -39.12 62.32 Favored 'General case' 0 N--CA 1.453 -0.281 0 CA-C-N 118.231 0.468 . . . . 0.0 110.083 -177.821 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 69.8 mt -58.95 -45.23 92.12 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.607 0 N-CA-C 109.045 -0.724 . . . . 0.0 109.045 174.516 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 50.4 mtmt -69.18 -25.04 64.14 Favored 'General case' 0 C--O 1.231 0.092 0 CA-C-O 119.069 -0.491 . . . . 0.0 111.403 -179.994 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 31' ' ' LYS . . . . . 0.466 ' CE ' ' HA ' ' A' ' 31' ' ' LYS . 3.1 mmpt? -66.22 -55.95 13.71 Favored 'General case' 0 N--CA 1.455 -0.203 0 CA-C-N 118.662 0.665 . . . . 0.0 110.14 177.856 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.473 HD12 ' N ' ' A' ' 33' ' ' THR . 1.6 pp -75.43 -17.64 60.11 Favored 'General case' 0 CA--C 1.53 0.207 0 C-N-CA 119.165 -1.014 . . . . 0.0 111.554 -179.613 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 33' ' ' THR . . . . . 0.473 ' N ' HD12 ' A' ' 32' ' ' LEU . 29.8 m -73.03 -41.6 64.06 Favored 'General case' 0 C--N 1.341 0.201 0 N-CA-C 108.926 -0.768 . . . . 0.0 108.926 176.378 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 97.0 m -69.59 -37.92 77.12 Favored 'General case' 0 N--CA 1.449 -0.499 0 N-CA-C 110.414 -0.217 . . . . 0.0 110.414 -178.36 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 14.8 t80 -62.92 -40.12 96.64 Favored 'General case' 0 N--CA 1.455 -0.216 0 N-CA-C 110.103 -0.332 . . . . 0.0 110.103 175.576 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -70.92 -31.95 68.72 Favored 'General case' 0 N--CA 1.45 -0.455 0 C-N-CA 122.337 0.255 . . . . 0.0 111.148 179.954 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 37' ' ' LEU . . . . . 0.455 HD21 ' HB1' ' A' ' 75' ' ' ALA . 20.1 mt -71.34 -40.08 70.94 Favored 'General case' 0 N--CA 1.453 -0.296 0 C-N-CA 122.618 0.367 . . . . 0.0 110.733 179.844 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 42.6 t0 -65.55 -23.41 66.86 Favored 'General case' 0 N--CA 1.453 -0.285 0 CA-C-N 116.463 -0.335 . . . . 0.0 110.847 177.037 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 98.1 m-70 -149.27 98.39 2.8 Favored 'General case' 0 N--CA 1.452 -0.336 0 CA-C-O 121.071 0.462 . . . . 0.0 111.651 -175.96 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 40' ' ' ILE . . . . . 0.628 ' H ' HD13 ' A' ' 40' ' ' ILE . 0.0 OUTLIER -76.59 -10.54 13.35 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.368 0 C-N-CA 122.847 0.459 . . . . 0.0 110.357 175.385 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 8.0 m-20 -57.42 -23.99 52.83 Favored 'General case' 0 N--CA 1.455 -0.18 0 C-N-CA 123.0 0.52 . . . . 0.0 111.66 -178.322 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 42' ' ' ILE . . . . . 0.479 ' HB ' ' HE2' ' A' ' 45' ' ' LYS . 0.0 OUTLIER -101.92 15.77 5.07 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.244 0 C-N-CA 122.877 0.471 . . . . 0.0 112.163 177.999 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 3.0 pp20? -52.43 -29.64 25.42 Favored 'General case' 0 CA--C 1.531 0.247 0 CA-C-N 119.067 0.849 . . . . 0.0 110.812 179.262 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 39.5 t -62.0 -52.61 63.31 Favored 'General case' 0 C--O 1.234 0.28 0 N-CA-C 112.028 0.381 . . . . 0.0 112.028 -178.706 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 45' ' ' LYS . . . . . 0.479 ' HE2' ' HB ' ' A' ' 42' ' ' ILE . 17.7 pttt -68.43 -25.89 65.25 Favored 'General case' 0 C--N 1.34 0.184 0 CA-C-N 118.245 0.475 . . . . 0.0 109.924 179.897 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 87.0 mt -73.28 -45.8 51.89 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.493 0 C-N-CA 122.649 0.38 . . . . 0.0 110.425 -176.656 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 34.2 mm -64.89 -34.7 72.17 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.215 0 N-CA-C 109.584 -0.525 . . . . 0.0 109.584 177.84 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 23.3 t -63.78 -46.84 83.42 Favored 'General case' 0 C--O 1.227 -0.09 0 C-N-CA 119.968 -0.693 . . . . 0.0 110.367 177.708 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 6.6 mp -66.65 -30.65 70.96 Favored 'General case' 0 N--CA 1.454 -0.273 0 CA-C-O 118.635 -0.698 . . . . 0.0 112.317 -175.135 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 20.3 pt -71.93 -42.76 68.88 Favored 'Isoleucine or valine' 0 C--N 1.34 0.192 0 CA-C-N 119.64 1.109 . . . . 0.0 110.126 176.982 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 38.0 pt -68.94 -42.33 82.27 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.239 0 C-N-CA 119.459 -0.896 . . . . 0.0 110.487 179.395 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 74.3 m-20 -62.54 -37.68 87.07 Favored 'General case' 0 N--CA 1.455 -0.201 0 CA-C-N 117.779 0.263 . . . . 0.0 110.806 179.767 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 26.8 t80 -72.79 -29.75 63.53 Favored 'General case' 0 CA--C 1.528 0.118 0 N-CA-C 110.29 -0.263 . . . . 0.0 110.29 177.211 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 37.7 m -75.28 -21.94 58.15 Favored 'General case' 0 N--CA 1.455 -0.221 0 N-CA-C 111.952 0.353 . . . . 0.0 111.952 179.532 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 22.6 mmm180 -93.95 -53.23 4.07 Favored 'General case' 0 N--CA 1.453 -0.284 0 N-CA-C 112.686 0.624 . . . . 0.0 112.686 -179.569 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 46.6 mt -74.18 -46.11 44.18 Favored 'General case' 0 C--N 1.334 -0.099 0 N-CA-C 112.507 0.558 . . . . 0.0 112.507 -170.188 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 57' ' ' CYS . . . . . 0.469 ' HB3' ' HD2' ' A' ' 58' ' ' PRO . 74.4 m -74.08 158.28 85.87 Favored Pre-proline 0 CA--C 1.535 0.382 0 C-N-CA 122.539 0.336 . . . . 0.0 111.598 -176.209 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 58' ' ' PRO . . . . . 0.469 ' HD2' ' HB3' ' A' ' 57' ' ' CYS . 91.8 Cg_endo -76.89 175.09 11.82 Favored 'Trans proline' 0 N--CA 1.453 -0.894 0 C-N-CA 125.127 3.885 . . . . 0.0 112.009 -169.46 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 35.3 p-10 -46.95 -46.33 21.41 Favored 'General case' 0 CA--C 1.528 0.115 0 C-N-CA 125.182 1.393 . . . . 0.0 113.677 -171.728 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 36.3 m -67.36 -36.3 81.1 Favored 'General case' 0 N--CA 1.453 -0.298 0 N-CA-C 109.992 -0.373 . . . . 0.0 109.992 -177.17 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 61' ' ' HIS . . . . . 0.431 ' ND1' ' HD2' ' A' ' 58' ' ' PRO . 53.6 m170 -75.41 -23.9 57.06 Favored 'General case' 0 N--CA 1.452 -0.366 0 N-CA-C 110.023 -0.362 . . . . 0.0 110.023 178.261 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 57.2 mttm -68.55 -34.42 75.8 Favored 'General case' 0 CA--C 1.528 0.107 0 N-CA-C 109.405 -0.591 . . . . 0.0 109.405 172.978 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -64.64 -44.47 90.37 Favored 'General case' 0 CA--C 1.532 0.261 0 N-CA-C 108.029 -1.1 . . . . 0.0 108.029 174.579 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -66.6 -28.45 73.75 Favored Glycine 0 C--N 1.336 0.576 0 N-CA-C 111.538 -0.625 . . . . 0.0 111.538 -179.749 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 38.7 t -69.88 -44.16 70.34 Favored 'General case' 0 N--CA 1.451 -0.401 0 CA-C-N 117.387 0.594 . . . . 0.0 110.08 177.371 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 60.6 mt -65.7 -25.04 67.14 Favored 'General case' 0 N--CA 1.453 -0.307 0 N-CA-C 109.581 -0.526 . . . . 0.0 109.581 178.781 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 1.2 m-85 -72.24 -37.67 69.08 Favored 'General case' 0 N--CA 1.454 -0.235 0 C-N-CA 122.617 0.367 . . . . 0.0 110.811 174.585 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 68' ' ' ILE . . . . . 0.532 HD11 ' CD1' ' A' ' 17' ' ' PHE . 20.2 mt -69.72 -46.76 73.84 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.317 0 N-CA-C 109.137 -0.69 . . . . 0.0 109.137 176.226 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 93.7 mt -57.6 -34.14 46.51 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.258 0 C-N-CA 123.556 0.742 . . . . 0.0 110.784 176.86 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 18.7 t70 -68.73 -43.68 75.42 Favored 'General case' 0 N--CA 1.451 -0.393 0 CA-C-N 118.123 0.419 . . . . 0.0 110.757 178.165 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 30.3 t -69.31 -56.55 7.2 Favored 'General case' 0 N--CA 1.452 -0.352 0 CA-C-N 116.401 -0.363 . . . . 0.0 110.65 -177.304 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -74.97 -31.34 25.09 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.253 0 N-CA-C 110.177 -0.305 . . . . 0.0 110.177 -176.623 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -66.42 -55.61 17.33 Favored Glycine 0 C--N 1.336 0.561 0 N-CA-C 111.214 -0.754 . . . . 0.0 111.214 -176.523 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 37.6 mtm105 -66.41 -40.84 89.82 Favored 'General case' 0 N--CA 1.452 -0.349 0 C-N-CA 120.489 -0.485 . . . . 0.0 109.934 -179.358 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 75' ' ' ALA . . . . . 0.455 ' HB1' HD21 ' A' ' 37' ' ' LEU . . . -64.48 -30.29 71.32 Favored 'General case' 0 N--CA 1.45 -0.426 0 C-N-CA 120.058 -0.657 . . . . 0.0 110.998 -177.893 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 1.3 m-30 -69.66 -46.66 65.62 Favored 'General case' 0 C--N 1.34 0.191 0 CA-C-N 118.18 0.446 . . . . 0.0 110.858 177.55 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 50.0 tp -71.82 -38.5 70.17 Favored 'General case' 0 N--CA 1.451 -0.419 0 C-N-CA 118.01 -1.476 . . . . 0.0 109.451 -179.611 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 91.1 m-20 -60.98 -47.84 84.6 Favored 'General case' 0 CA--C 1.529 0.156 0 N-CA-C 112.893 0.701 . . . . 0.0 112.893 178.548 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 21.3 mm-40 -66.84 -45.53 77.92 Favored 'General case' 0 CA--C 1.522 -0.098 0 CA-C-N 119.221 0.919 . . . . 0.0 111.342 179.877 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 80' ' ' THR . . . . . 0.416 HG21 ' HB3' ' A' ' 94' ' ' CYS . 60.0 p -65.34 -30.76 71.63 Favored 'General case' 0 N--CA 1.456 -0.142 0 C-N-CA 120.195 -0.602 . . . . 0.0 110.632 179.847 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 38.2 ttp-105 -72.15 -30.86 65.43 Favored 'General case' 0 N--CA 1.454 -0.226 0 CA-C-N 117.98 0.355 . . . . 0.0 111.631 175.415 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 17.2 m . . . . . 0 N--CA 1.457 -0.102 0 N-CA-C 113.495 0.924 . . . . 0.0 113.495 -174.422 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 57.5 Cg_exo . . . . . 0 N--CA 1.452 -0.959 0 N-CA-C 111.154 -0.364 . . . . 0.0 111.154 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 90.52 16.55 54.95 Favored Glycine 0 CA--C 1.523 0.571 0 CA-C-O 119.278 -0.735 . . . . 0.0 112.878 178.539 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 30.9 p -153.04 167.95 27.51 Favored 'General case' 0 CA--C 1.52 -0.202 0 CA-C-N 118.399 1.1 . . . . 0.0 110.591 177.864 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 94' ' ' CYS . . . . . 0.429 ' HB2' HD13 ' A' ' 98' ' ' ILE . 31.1 p -58.34 -24.3 59.33 Favored 'General case' 0 N--CA 1.451 -0.402 0 CA-C-N 115.478 -0.783 . . . . 0.0 110.27 175.561 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -60.9 -59.82 4.77 Favored 'General case' 0 N--CA 1.446 -0.638 0 N-CA-C 109.497 -0.557 . . . . 0.0 109.497 -175.722 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 72.4 t60 -73.56 -32.78 64.35 Favored 'General case' 0 N--CA 1.449 -0.492 0 N-CA-C 110.553 -0.166 . . . . 0.0 110.553 -178.92 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -66.08 -52.53 48.01 Favored 'General case' 0 N--CA 1.453 -0.323 0 N-CA-C 111.836 0.309 . . . . 0.0 111.836 -177.86 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 98' ' ' ILE . . . . . 0.429 HD13 ' HB2' ' A' ' 94' ' ' CYS . 1.8 mp -71.01 -33.87 53.3 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.146 0 O-C-N 121.916 -0.49 . . . . 0.0 109.908 -178.829 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 75.8 m-20 -68.1 -43.37 78.64 Favored 'General case' 0 N--CA 1.45 -0.429 0 CA-C-N 118.242 0.474 . . . . 0.0 111.626 179.34 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 91.3 m -68.32 -37.6 80.75 Favored 'General case' 0 N--CA 1.455 -0.221 0 CA-C-N 117.886 0.312 . . . . 0.0 110.472 -177.579 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 65.2 tp -75.81 -36.73 59.63 Favored 'General case' 0 N--CA 1.451 -0.424 0 CA-C-N 116.661 -0.245 . . . . 0.0 111.283 179.906 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -65.56 -22.78 69.99 Favored Glycine 0 CA--C 1.522 0.527 0 CA-C-O 119.67 -0.517 . . . . 0.0 112.437 -175.187 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 17.6 mm-40 -72.68 -44.89 61.21 Favored 'General case' 0 N--CA 1.452 -0.359 0 CA-C-N 118.201 1.0 . . . . 0.0 111.873 178.138 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 25.0 m -92.1 -1.6 10.27 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.171 0 O-C-N 123.928 0.767 . . . . 0.0 112.369 -174.63 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 105' ' ' ILE . . . . . . . . . . . . . 10.1 tp -66.68 -25.15 34.15 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.167 0 CA-C-N 118.384 0.538 . . . . 0.0 110.954 -176.25 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 15.2 pt20 -71.76 -34.29 69.36 Favored 'General case' 0 N--CA 1.452 -0.345 0 CA-C-O 119.181 -0.438 . . . . 0.0 109.841 -178.631 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 57.9 mp0 -73.69 -37.96 65.05 Favored 'General case' 0 C--N 1.341 0.203 0 CA-C-N 118.929 0.786 . . . . 0.0 110.38 177.001 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 94.1 mt -71.74 -41.36 68.57 Favored 'General case' 0 N--CA 1.452 -0.343 0 CA-C-O 119.186 -0.435 . . . . 0.0 111.053 -177.568 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 81.5 mt -69.66 -55.62 9.5 Favored 'General case' 0 N--CA 1.45 -0.441 0 C-N-CA 120.494 -0.483 . . . . 0.0 110.146 179.156 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 14.2 p -49.18 -51.76 30.65 Favored 'General case' 0 CA--C 1.52 -0.181 0 CA-C-N 118.243 0.474 . . . . 0.0 111.48 -177.506 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 43.2 t0 -69.0 -31.17 69.8 Favored 'General case' 0 N--CA 1.447 -0.585 0 C-N-CA 120.897 -0.321 . . . . 0.0 110.508 -177.14 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -72.52 -31.27 65.19 Favored 'General case' 0 N--CA 1.448 -0.545 0 C-N-CA 120.822 -0.351 . . . . 0.0 110.496 178.902 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 113' ' ' ILE . . . . . . . . . . . . . 36.5 mm -66.31 -36.89 78.46 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.175 0 N-CA-C 108.317 -0.994 . . . . 0.0 108.317 176.375 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -74.56 -40.08 61.9 Favored 'General case' 0 N--CA 1.454 -0.26 0 N-CA-C 112.205 0.446 . . . . 0.0 112.205 177.92 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -77.24 -36.46 54.54 Favored 'General case' 0 C--N 1.339 0.123 0 N-CA-C 112.531 0.567 . . . . 0.0 112.531 -175.536 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 116' ' ' SER . . . . . 0.516 ' HB2' ' CB ' ' A' ' 120' ' ' HIS . 83.8 p -79.38 153.74 29.52 Favored 'General case' 0 N--CA 1.454 -0.246 0 N-CA-C 112.991 0.737 . . . . 0.0 112.991 -170.952 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 47.2 t30 -75.62 167.43 21.9 Favored 'General case' 0 C--O 1.225 -0.22 0 C-N-CA 123.772 0.829 . . . . 0.0 110.251 -178.611 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 118' ' ' GLN . . . . . . . . . . . . . 59.8 mt-30 -45.87 -55.67 6.38 Favored 'General case' 0 C--N 1.34 0.187 0 C-N-CA 123.478 0.711 . . . . 0.0 111.542 -174.438 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 3.9 p30 -63.15 -36.88 85.1 Favored 'General case' 0 C--O 1.232 0.143 0 C-N-CA 122.778 0.431 . . . . 0.0 110.95 -177.341 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 120' ' ' HIS . . . . . 0.516 ' CB ' ' HB2' ' A' ' 116' ' ' SER . 34.0 m170 -64.93 -39.04 92.9 Favored 'General case' 0 N--CA 1.449 -0.501 0 CA-C-O 119.168 -0.444 . . . . 0.0 110.14 176.441 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 57.6 mttm -57.54 -46.88 83.36 Favored 'General case' 0 C--N 1.342 0.271 0 N-CA-C 109.329 -0.619 . . . . 0.0 109.329 179.285 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 40.1 mm-40 -64.22 -40.53 96.23 Favored 'General case' 0 N--CA 1.452 -0.354 0 C-N-CA 122.397 0.279 . . . . 0.0 111.605 -177.022 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 63.5 mttm -64.35 -29.34 70.41 Favored 'General case' 0 N--CA 1.453 -0.277 0 C-N-CA 120.342 -0.543 . . . . 0.0 110.39 179.594 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 124' ' ' ILE . . . . . . . . . . . . . 51.8 mt -75.77 -33.13 25.3 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.218 0 N-CA-C 109.874 -0.417 . . . . 0.0 109.874 176.0 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 11.3 mmm180 -66.44 -39.06 88.67 Favored 'General case' 0 C--N 1.339 0.147 0 CA-C-N 118.135 0.425 . . . . 0.0 110.466 179.676 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 126' ' ' MET . . . . . . . . . . . . . 27.8 ptm -72.43 -33.28 66.98 Favored 'General case' 0 N--CA 1.455 -0.218 0 C-N-CA 120.314 -0.554 . . . . 0.0 109.674 177.793 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 3.3 mp -64.69 -33.96 77.17 Favored 'General case' 0 N--CA 1.455 -0.212 0 N-CA-C 109.644 -0.502 . . . . 0.0 109.644 175.042 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 31.6 tp -66.4 -42.25 88.12 Favored 'General case' 0 N--CA 1.452 -0.329 0 N-CA-C 110.077 -0.342 . . . . 0.0 110.077 179.134 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 18.0 t0 -64.7 -44.72 89.35 Favored 'General case' 0 N--CA 1.455 -0.218 0 N-CA-C 110.243 -0.281 . . . . 0.0 110.243 177.856 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 59.7 mt -58.79 -35.22 54.83 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.203 0 N-CA-C 110.238 -0.282 . . . . 0.0 110.238 -179.176 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 131' ' ' TRP . . . . . . . . . . . . . 45.6 m0 . . . . . 0 N--CA 1.455 -0.182 0 N-CA-C 112.874 0.694 . . . . 0.0 112.874 -179.917 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 21.2 p-10 . . . . . 0 N--CA 1.455 -0.196 0 N-CA-C 108.549 -0.908 . . . . 0.0 108.549 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 7' ' ' PHE . . . . . 0.445 ' CD1' ' HD3' ' A' ' 45' ' ' LYS . 1.0 OUTLIER -55.35 -33.06 63.05 Favored 'General case' 0 N--CA 1.447 -0.606 0 C-N-CA 125.584 1.554 . . . . 0.0 111.462 -177.253 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 51.1 tp60 -51.8 -36.89 49.37 Favored 'General case' 0 N--CA 1.454 -0.272 0 C-N-CA 123.201 0.601 . . . . 0.0 112.21 -176.993 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 27.6 m-80 -71.29 -36.22 71.59 Favored 'General case' 0 N--CA 1.455 -0.223 0 CA-C-O 121.175 0.512 . . . . 0.0 110.016 -179.437 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 10' ' ' PHE . . . . . 0.424 ' CE2' ' HB2' ' A' ' 32' ' ' LEU . 7.1 t80 -69.96 -39.8 75.8 Favored 'General case' 0 N--CA 1.451 -0.408 0 C-N-CA 124.05 0.94 . . . . 0.0 109.349 177.139 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 83.2 t -66.17 -51.72 56.2 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.493 0 N-CA-C 109.042 -0.725 . . . . 0.0 109.042 179.693 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -59.45 -32.12 69.93 Favored 'General case' 0 CA--C 1.53 0.175 0 C-N-CA 122.508 0.323 . . . . 0.0 111.381 -179.422 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 85.5 m -71.55 -39.53 70.62 Favored 'General case' 0 CA--C 1.531 0.246 0 N-CA-C 109.025 -0.732 . . . . 0.0 109.025 176.484 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.552 ' HA ' ' CD1' ' A' ' 17' ' ' PHE . 4.9 tp -64.84 -42.15 95.14 Favored 'General case' 0 N--CA 1.45 -0.471 0 CA-C-O 121.215 0.531 . . . . 0.0 110.208 178.624 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 69.0 mm-40 -63.83 -28.06 69.6 Favored 'General case' 0 N--CA 1.45 -0.469 0 C-N-CA 124.762 1.225 . . . . 0.0 109.337 178.09 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 43.6 t -70.23 -27.35 64.4 Favored 'General case' 0 N--CA 1.449 -0.516 0 N-CA-C 110.417 -0.216 . . . . 0.0 110.417 174.942 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 17' ' ' PHE . . . . . 0.582 ' CE1' HD11 ' A' ' 68' ' ' ILE . 21.8 m-85 -71.42 -41.1 69.95 Favored 'General case' 0 C--N 1.338 0.108 0 C-N-CA 119.335 -0.946 . . . . 0.0 110.879 170.441 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 18' ' ' LYS . . . . . 0.529 ' HG2' ' CE1' ' A' ' 53' ' ' TYR . 65.9 mttt -60.62 -25.55 66.36 Favored 'General case' 0 C--N 1.34 0.19 0 CA-C-N 118.138 0.426 . . . . 0.0 111.008 175.799 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 10.6 t0 -72.47 -47.06 51.78 Favored 'General case' 0 C--N 1.331 -0.22 0 C-N-CA 123.231 0.612 . . . . 0.0 110.26 178.784 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 63.3 mt -66.78 136.31 55.28 Favored 'General case' 0 N--CA 1.453 -0.306 0 CA-C-O 120.967 0.413 . . . . 0.0 110.405 -178.769 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 1.2 mppt? -75.3 -24.24 57.46 Favored 'General case' 0 N--CA 1.454 -0.236 0 N-CA-C 109.105 -0.702 . . . . 0.0 109.105 177.35 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 80.7 p -80.94 -23.4 38.87 Favored 'General case' 0 N--CA 1.457 -0.119 0 C-N-CA 123.773 0.829 . . . . 0.0 110.391 175.845 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 72.35 -33.73 0.67 Allowed Glycine 0 CA--C 1.526 0.728 0 C-N-CA 124.846 1.212 . . . . 0.0 112.938 178.239 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 63.0 mt -76.16 147.38 7.89 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.333 0 CA-C-N 117.528 0.664 . . . . 0.0 110.109 178.112 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 32.9 t -162.37 94.2 0.88 Allowed 'General case' 0 N--CA 1.455 -0.198 0 N-CA-C 109.058 -0.719 . . . . 0.0 109.058 171.67 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 26' ' ' GLY . . . . . 0.429 ' O ' ' HE2' ' A' ' 30' ' ' LYS . . . -55.28 -38.33 67.95 Favored Glycine 0 CA--C 1.524 0.613 0 C-N-CA 121.12 -0.562 . . . . 0.0 111.91 -172.426 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 27' ' ' SER . . . . . 0.432 ' HA ' ' HE3' ' A' ' 30' ' ' LYS . 74.7 p -71.71 -48.66 45.69 Favored 'General case' 0 N--CA 1.452 -0.354 0 CA-C-N 118.21 1.005 . . . . 0.0 110.898 -177.196 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 71.5 mmt-85 -65.53 -38.56 90.0 Favored 'General case' 0 C--O 1.233 0.2 0 N-CA-C 109.617 -0.512 . . . . 0.0 109.617 -179.637 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 47.9 mt -59.96 -44.41 94.49 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.814 0 N-CA-C 108.71 -0.848 . . . . 0.0 108.71 176.06 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 30' ' ' LYS . . . . . 0.432 ' HE3' ' HA ' ' A' ' 27' ' ' SER . 49.2 mtmt -66.17 -25.79 67.12 Favored 'General case' 0 C--N 1.34 0.166 0 CA-C-O 118.727 -0.654 . . . . 0.0 111.562 177.635 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 31' ' ' LYS . . . . . 0.565 ' HE2' ' HA ' ' A' ' 31' ' ' LYS . 8.9 mmpt? -66.88 -57.97 5.93 Favored 'General case' 0 C--N 1.341 0.214 0 CA-C-N 119.433 1.015 . . . . 0.0 109.95 179.435 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.528 HD12 ' N ' ' A' ' 33' ' ' THR . 1.4 pp -75.1 -20.07 59.64 Favored 'General case' 0 CA--C 1.53 0.194 0 C-N-CA 118.929 -1.109 . . . . 0.0 111.917 -176.782 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 33' ' ' THR . . . . . 0.528 ' N ' HD12 ' A' ' 32' ' ' LEU . 54.3 m -71.16 -38.28 72.2 Favored 'General case' 0 N--CA 1.452 -0.366 0 N-CA-C 108.626 -0.879 . . . . 0.0 108.626 175.548 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 63.8 m -69.76 -37.37 76.4 Favored 'General case' 0 N--CA 1.45 -0.431 0 N-CA-C 110.032 -0.358 . . . . 0.0 110.032 -178.949 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 72.8 t80 -67.39 -33.81 75.96 Favored 'General case' 0 N--CA 1.455 -0.18 0 C-N-CA 120.279 -0.569 . . . . 0.0 110.248 177.42 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -69.47 -37.11 77.13 Favored 'General case' 0 N--CA 1.45 -0.472 0 CA-C-N 116.627 -0.261 . . . . 0.0 110.588 178.207 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 2.9 mm? -71.23 -34.5 70.84 Favored 'General case' 0 N--CA 1.456 -0.154 0 C-N-CA 122.478 0.311 . . . . 0.0 110.227 179.781 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 45.5 t0 -67.17 -26.49 66.67 Favored 'General case' 0 N--CA 1.453 -0.297 0 C-N-CA 122.315 0.246 . . . . 0.0 110.475 176.289 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 39' ' ' HIS . . . . . 0.403 ' HB2' HD11 ' A' ' 42' ' ' ILE . 97.1 m-70 -149.0 100.29 3.05 Favored 'General case' 0 C--N 1.341 0.197 0 N-CA-C 111.82 0.304 . . . . 0.0 111.82 -175.737 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 40' ' ' ILE . . . . . 0.621 ' H ' HD13 ' A' ' 40' ' ' ILE . 0.0 OUTLIER -75.65 -13.49 15.06 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.488 0 CA-C-O 119.158 -0.449 . . . . 0.0 110.061 174.116 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 32.6 m-20 -58.15 -16.68 14.29 Favored 'General case' 0 CA--C 1.532 0.286 0 C-N-CA 123.124 0.57 . . . . 0.0 112.11 -176.07 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 42' ' ' ILE . . . . . 0.403 HD11 ' HB2' ' A' ' 39' ' ' HIS . 0.0 OUTLIER -113.65 19.17 7.24 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.177 0 C-N-CA 123.41 0.684 . . . . 0.0 111.834 176.903 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 2.9 pp20? -54.02 -28.84 40.8 Favored 'General case' 0 C--N 1.339 0.131 0 O-C-N 121.544 -0.722 . . . . 0.0 111.693 179.175 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 3.9 m -67.31 -44.04 80.14 Favored 'General case' 0 N--CA 1.454 -0.231 0 O-C-N 121.962 -0.461 . . . . 0.0 111.518 -176.662 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 45' ' ' LYS . . . . . 0.445 ' HD3' ' CD1' ' A' ' 7' ' ' PHE . 16.6 ptpt -73.73 -27.47 61.2 Favored 'General case' 0 C--N 1.341 0.206 0 CA-C-N 118.699 0.681 . . . . 0.0 109.789 177.56 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 64.0 mt -71.45 -53.88 19.26 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.274 0 C-N-CA 123.102 0.561 . . . . 0.0 110.721 -178.29 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 34.0 mm -68.18 -39.82 81.84 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.351 0 C-N-CA 122.381 0.272 . . . . 0.0 110.313 -176.49 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 66.0 p -68.15 -33.55 74.68 Favored 'General case' 0 N--CA 1.452 -0.347 0 C-N-CA 120.219 -0.592 . . . . 0.0 110.54 179.922 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 48.4 tp -75.21 -35.13 61.52 Favored 'General case' 0 N--CA 1.453 -0.286 0 N-CA-C 113.033 0.753 . . . . 0.0 113.033 -177.823 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 50' ' ' ILE . . . . . 0.443 HD12 HG12 ' A' ' 69' ' ' ILE . 3.4 pt -73.06 -42.61 59.21 Favored 'Isoleucine or valine' 0 CA--C 1.526 0.041 0 CA-C-N 118.788 0.722 . . . . 0.0 111.137 179.311 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 21.8 pt -65.79 -39.17 84.01 Favored 'Isoleucine or valine' 0 CA--C 1.528 0.112 0 C-N-CA 119.649 -0.821 . . . . 0.0 110.708 177.707 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 84.8 m-20 -68.79 -35.44 77.04 Favored 'General case' 0 N--CA 1.453 -0.325 0 CA-C-N 118.248 0.476 . . . . 0.0 111.279 177.901 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 53' ' ' TYR . . . . . 0.529 ' CE1' ' HG2' ' A' ' 18' ' ' LYS . 7.7 t80 -62.02 -45.33 94.04 Favored 'General case' 0 N--CA 1.453 -0.301 0 N-CA-C 108.501 -0.926 . . . . 0.0 108.501 174.781 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 20.5 m -63.27 -33.93 76.58 Favored 'General case' 0 N--CA 1.454 -0.232 0 C-N-CA 123.258 0.623 . . . . 0.0 111.99 -175.193 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 64.6 mtm180 -79.0 -42.65 26.1 Favored 'General case' 0 N--CA 1.455 -0.201 0 N-CA-C 111.883 0.327 . . . . 0.0 111.883 -176.685 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 45.2 mt -77.47 -43.29 32.81 Favored 'General case' 0 N--CA 1.457 -0.08 0 N-CA-C 112.309 0.485 . . . . 0.0 112.309 -177.743 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 57' ' ' CYS . . . . . 0.461 ' HB2' ' HD2' ' A' ' 58' ' ' PRO . 10.6 p -67.49 161.42 65.37 Favored Pre-proline 0 CA--C 1.532 0.264 0 N-CA-C 113.049 0.759 . . . . 0.0 113.049 -173.489 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 58' ' ' PRO . . . . . 0.461 ' HD2' ' HB2' ' A' ' 57' ' ' CYS . 86.3 Cg_endo -72.89 179.25 5.5 Favored 'Trans proline' 0 N--CA 1.454 -0.823 0 C-N-CA 124.249 3.299 . . . . 0.0 110.59 174.614 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 59' ' ' ASP . . . . . 0.493 ' CG ' ' HA ' ' A' ' 116' ' ' SER . 49.9 t0 -55.37 -52.52 63.24 Favored 'General case' 0 N--CA 1.453 -0.311 0 N-CA-C 113.958 1.095 . . . . 0.0 113.958 -173.479 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 97.4 p -63.4 -39.61 94.96 Favored 'General case' 0 C--O 1.231 0.131 0 CA-C-N 119.091 0.86 . . . . 0.0 110.545 -174.297 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 49.6 m170 -66.11 -34.71 78.67 Favored 'General case' 0 N--CA 1.452 -0.348 0 N-CA-C 109.666 -0.494 . . . . 0.0 109.666 175.54 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 62' ' ' LYS . . . . . 0.599 ' HE3' HD11 ' A' ' 124' ' ' ILE . 0.0 OUTLIER -72.36 -32.1 66.18 Favored 'General case' 0 N--CA 1.453 -0.283 0 C-N-CA 122.893 0.477 . . . . 0.0 111.954 -178.464 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 1.7 tm? -75.29 -35.11 61.34 Favored 'General case' 0 CA--C 1.532 0.276 0 N-CA-C 107.783 -1.192 . . . . 0.0 107.783 178.699 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -71.49 -31.64 65.42 Favored Glycine 0 CA--C 1.526 0.77 0 N-CA-C 111.601 -0.6 . . . . 0.0 111.601 176.449 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 65' ' ' SER . . . . . 0.453 ' HA ' HD12 ' A' ' 68' ' ' ILE . 82.6 p -71.96 -31.47 66.33 Favored 'General case' 0 N--CA 1.451 -0.401 0 O-C-N 121.822 -0.81 . . . . 0.0 109.882 177.797 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 76.8 mt -75.05 -25.08 58.4 Favored 'General case' 0 N--CA 1.455 -0.222 0 CA-C-O 119.568 -0.253 . . . . 0.0 110.413 174.781 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 4.1 m-30 -66.5 -36.26 82.29 Favored 'General case' 0 CA--C 1.516 -0.341 0 N-CA-C 109.453 -0.573 . . . . 0.0 109.453 172.465 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 68' ' ' ILE . . . . . 0.582 HD11 ' CE1' ' A' ' 17' ' ' PHE . 41.0 mt -68.32 -55.82 14.86 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.567 0 N-CA-C 108.758 -0.83 . . . . 0.0 108.758 178.03 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 69' ' ' ILE . . . . . 0.443 HG12 HD12 ' A' ' 50' ' ' ILE . 61.9 mt -47.87 -37.67 6.45 Favored 'Isoleucine or valine' 0 C--N 1.343 0.297 0 C-N-CA 124.089 0.956 . . . . 0.0 111.742 176.016 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 15.4 t70 -70.4 -44.07 68.73 Favored 'General case' 0 C--O 1.233 0.203 0 CA-C-N 118.557 0.617 . . . . 0.0 110.881 178.976 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 20.4 m -68.97 -52.32 30.2 Favored 'General case' 0 N--CA 1.455 -0.183 0 N-CA-C 110.202 -0.296 . . . . 0.0 110.202 -175.46 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 72' ' ' ILE . . . . . 0.476 HD11 ' CZ ' ' A' ' 76' ' ' TYR . 0.0 OUTLIER -73.97 -31.04 29.28 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.403 0 N-CA-C 109.68 -0.489 . . . . 0.0 109.68 -176.403 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -68.76 -53.84 17.87 Favored Glycine 0 C--N 1.338 0.694 0 N-CA-C 111.695 -0.562 . . . . 0.0 111.695 -175.458 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 37.8 mtm105 -68.5 -39.5 81.24 Favored 'General case' 0 N--CA 1.452 -0.335 0 C-N-CA 120.672 -0.411 . . . . 0.0 110.157 179.844 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -65.26 -30.9 71.81 Favored 'General case' 0 N--CA 1.451 -0.386 0 C-N-CA 120.457 -0.497 . . . . 0.0 110.755 -179.183 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 76' ' ' TYR . . . . . 0.476 ' CZ ' HD11 ' A' ' 72' ' ' ILE . 1.4 m-30 -68.23 -48.06 66.14 Favored 'General case' 0 CA--C 1.517 -0.318 0 CA-C-N 118.225 0.466 . . . . 0.0 110.779 176.358 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 51.3 tp -68.59 -37.25 79.69 Favored 'General case' 0 N--CA 1.448 -0.534 0 C-N-CA 118.617 -1.233 . . . . 0.0 110.021 -177.669 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 96.5 m-20 -67.87 -40.27 83.61 Favored 'General case' 0 C--N 1.333 -0.139 0 N-CA-C 113.273 0.842 . . . . 0.0 113.273 -179.584 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 13.6 mm-40 -65.8 -48.37 71.97 Favored 'General case' 0 N--CA 1.456 -0.175 0 C-N-CA 119.917 -0.713 . . . . 0.0 110.336 174.06 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 80' ' ' THR . . . . . 0.447 HG21 ' HB3' ' A' ' 94' ' ' CYS . 76.5 p -66.53 -26.86 67.35 Favored 'General case' 0 CA--C 1.529 0.145 0 CA-C-N 118.505 0.593 . . . . 0.0 111.251 -179.632 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 74.7 mtt180 -65.41 -37.75 87.88 Favored 'General case' 0 C--N 1.338 0.067 0 C-N-CA 122.717 0.407 . . . . 0.0 110.393 170.858 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 20.7 m . . . . . 0 N--CA 1.452 -0.326 0 N-CA-C 112.07 0.396 . . . . 0.0 112.07 -176.645 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 91.0 Cg_endo . . . . . 0 N--CA 1.454 -0.83 0 N-CA-C 108.951 -1.211 . . . . 0.0 108.951 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 92' ' ' GLY . . . . . 0.413 ' HA2' ' O ' ' A' ' 40' ' ' ILE . . . 97.73 16.65 33.09 Favored Glycine 0 CA--C 1.527 0.842 0 CA-C-O 119.507 -0.607 . . . . 0.0 113.793 179.944 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 21.9 p -152.22 169.36 22.66 Favored 'General case' 0 C--O 1.231 0.099 0 CA-C-N 118.14 0.97 . . . . 0.0 110.508 178.179 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 94' ' ' CYS . . . . . 0.478 ' HB2' HD13 ' A' ' 98' ' ' ILE . 30.0 p -57.8 -23.24 51.52 Favored 'General case' 0 N--CA 1.449 -0.514 0 CA-C-N 115.956 -0.565 . . . . 0.0 109.64 175.88 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -60.38 -55.84 28.68 Favored 'General case' 0 N--CA 1.446 -0.659 0 N-CA-C 109.358 -0.608 . . . . 0.0 109.358 -178.013 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 53.9 t60 -76.06 -29.5 58.04 Favored 'General case' 0 N--CA 1.451 -0.401 0 N-CA-C 111.608 0.225 . . . . 0.0 111.608 179.997 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -67.58 -49.46 63.04 Favored 'General case' 0 N--CA 1.448 -0.528 0 N-CA-C 110.493 -0.188 . . . . 0.0 110.493 -178.596 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 98' ' ' ILE . . . . . 0.478 HD13 ' HB2' ' A' ' 94' ' ' CYS . 2.1 mp -72.47 -26.84 24.83 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.313 0 C-N-CA 120.546 -0.461 . . . . 0.0 110.062 178.78 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 67.9 m-20 -63.69 -45.0 92.02 Favored 'General case' 0 N--CA 1.454 -0.264 0 CA-C-N 118.912 0.778 . . . . 0.0 110.193 173.251 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 85.0 m -65.04 -35.5 81.38 Favored 'General case' 0 N--CA 1.455 -0.189 0 C-N-CA 122.705 0.402 . . . . 0.0 110.967 -176.395 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 93.3 mt -75.74 -35.36 60.24 Favored 'General case' 0 N--CA 1.448 -0.559 0 N-CA-C 110.501 -0.185 . . . . 0.0 110.501 176.461 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -75.44 -30.23 58.73 Favored Glycine 0 CA--C 1.527 0.813 0 CA-C-O 119.785 -0.453 . . . . 0.0 112.941 -175.843 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 25.8 pt-20 -75.99 -6.11 49.43 Favored 'General case' 0 CA--C 1.53 0.183 0 CA-C-N 117.856 0.828 . . . . 0.0 111.926 -177.348 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 27.0 m -140.17 21.04 0.56 Allowed 'Isoleucine or valine' 0 CA--C 1.531 0.218 0 CA-C-N 118.102 0.41 . . . . 0.0 111.064 175.524 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 105' ' ' ILE . . . . . . . . . . . . . 10.0 tp -62.05 -39.21 82.95 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.288 0 CA-C-N 118.033 0.379 . . . . 0.0 111.768 -173.958 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 13.3 pt20 -73.86 -31.08 63.0 Favored 'General case' 0 N--CA 1.454 -0.228 0 O-C-N 122.009 -0.432 . . . . 0.0 110.19 -179.421 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 58.7 mm-40 -76.11 -41.42 50.28 Favored 'General case' 0 N--CA 1.454 -0.258 0 CA-C-N 117.743 0.247 . . . . 0.0 110.467 -179.863 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 65.7 tp -70.32 -38.49 74.94 Favored 'General case' 0 N--CA 1.45 -0.463 0 C-N-CA 122.657 0.383 . . . . 0.0 110.61 -177.775 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 88.5 mt -73.44 -42.51 61.9 Favored 'General case' 0 N--CA 1.453 -0.31 0 C-N-CA 120.692 -0.403 . . . . 0.0 110.16 177.386 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 45.6 t -58.07 -43.96 87.26 Favored 'General case' 0 N--CA 1.456 -0.129 0 CA-C-N 118.187 0.449 . . . . 0.0 110.465 178.753 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 55.0 t0 -64.48 -39.72 94.33 Favored 'General case' 0 N--CA 1.453 -0.299 0 N-CA-C 108.682 -0.859 . . . . 0.0 108.682 175.59 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 112' ' ' ALA . . . . . 0.428 ' HA ' ' HD2' ' A' ' 62' ' ' LYS . . . -66.39 -38.32 87.26 Favored 'General case' 0 N--CA 1.444 -0.742 0 N-CA-C 112.202 0.445 . . . . 0.0 112.202 -175.89 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 113' ' ' ILE . . . . . 0.451 HG22 ' HE3' ' A' ' 121' ' ' LYS . 9.3 mm -71.83 -38.99 67.26 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.287 0 CA-C-N 118.462 0.574 . . . . 0.0 109.809 179.816 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -71.26 -35.44 71.4 Favored 'General case' 0 CA--C 1.531 0.23 0 N-CA-C 112.247 0.462 . . . . 0.0 112.247 178.916 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 5.2 tppp? -74.15 -32.91 63.33 Favored 'General case' 0 N--CA 1.456 -0.141 0 C-N-CA 123.004 0.522 . . . . 0.0 110.779 178.436 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 116' ' ' SER . . . . . 0.493 ' HA ' ' CG ' ' A' ' 59' ' ' ASP . 94.4 p -90.93 142.86 27.32 Favored 'General case' 0 N--CA 1.452 -0.37 0 N-CA-C 113.188 0.811 . . . . 0.0 113.188 -169.972 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 14.0 t-20 -76.82 170.53 16.3 Favored 'General case' 0 N--CA 1.454 -0.23 0 N-CA-C 109.013 -0.736 . . . . 0.0 109.013 173.456 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 118' ' ' GLN . . . . . . . . . . . . . 13.9 mm100 -58.88 -32.2 69.27 Favored 'General case' 0 CA--C 1.528 0.097 0 N-CA-C 112.489 0.551 . . . . 0.0 112.489 -170.859 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 10.5 t0 -63.22 -51.81 64.78 Favored 'General case' 0 C--O 1.233 0.221 0 CA-C-O 121.508 0.671 . . . . 0.0 109.257 175.572 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 120' ' ' HIS . . . . . 0.404 ' HB2' ' HB2' ' A' ' 116' ' ' SER . 98.5 m-70 -72.83 -25.44 61.13 Favored 'General case' 0 N--CA 1.447 -0.595 0 CA-C-N 116.046 -0.524 . . . . 0.0 111.098 -177.555 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 121' ' ' LYS . . . . . 0.451 ' HE3' HG22 ' A' ' 113' ' ' ILE . 56.3 mttp -61.44 -44.65 96.75 Favored 'General case' 0 C--N 1.338 0.073 0 N-CA-C 108.973 -0.751 . . . . 0.0 108.973 172.012 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 41.0 tp10 -67.63 -35.78 79.56 Favored 'General case' 0 N--CA 1.454 -0.246 0 C-N-CA 122.185 0.194 . . . . 0.0 111.123 -177.223 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 43.7 mtmt -71.21 -30.23 66.12 Favored 'General case' 0 N--CA 1.454 -0.246 0 O-C-N 122.129 -0.357 . . . . 0.0 110.537 178.147 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 124' ' ' ILE . . . . . 0.599 HD11 ' HE3' ' A' ' 62' ' ' LYS . 56.4 mt -68.8 -37.69 77.78 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.195 0 N-CA-C 108.891 -0.781 . . . . 0.0 108.891 171.802 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 125' ' ' ARG . . . . . 0.422 ' HA ' ' HD2' ' A' ' 125' ' ' ARG . 6.1 mmm180 -61.5 -45.33 94.65 Favored 'General case' 0 N--CA 1.453 -0.284 0 CA-C-O 118.717 -0.659 . . . . 0.0 111.476 -179.606 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 126' ' ' MET . . . . . . . . . . . . . 28.5 ptm -64.85 -34.34 78.15 Favored 'General case' 0 N--CA 1.455 -0.176 0 C-N-CA 119.187 -1.005 . . . . 0.0 108.923 177.712 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 3.6 mp -64.41 -39.82 94.59 Favored 'General case' 0 CA--C 1.531 0.224 0 CA-C-N 118.317 0.508 . . . . 0.0 110.873 175.742 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 81.3 mt -70.23 -30.59 67.71 Favored 'General case' 0 N--CA 1.454 -0.263 0 CA-C-N 118.404 0.547 . . . . 0.0 111.191 179.755 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 48.5 m-20 -73.97 -35.86 64.52 Favored 'General case' 0 N--CA 1.456 -0.143 0 N-CA-C 109.951 -0.389 . . . . 0.0 109.951 176.102 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 60.1 mt -62.15 -35.8 70.87 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.22 0 N-CA-C 109.133 -0.691 . . . . 0.0 109.133 175.273 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 131' ' ' TRP . . . . . . . . . . . . . 43.3 m0 . . . . . 0 N--CA 1.455 -0.21 0 N-CA-C 112.975 0.732 . . . . 0.0 112.975 179.536 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 28.6 p-10 . . . . . 0 N--CA 1.452 -0.342 0 CA-C-O 120.555 0.217 . . . . 0.0 110.434 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 7' ' ' PHE . . . . . 0.472 ' CD1' ' HD3' ' A' ' 45' ' ' LYS . 1.5 t80 -59.18 -41.97 89.73 Favored 'General case' 0 N--CA 1.449 -0.508 0 CA-C-N 116.746 -0.207 . . . . 0.0 110.489 -178.984 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 9.7 tp60 -55.18 -32.74 62.41 Favored 'General case' 0 N--CA 1.454 -0.252 0 C-N-CA 122.635 0.374 . . . . 0.0 110.934 -178.793 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 27.4 m-20 -70.84 -34.64 71.88 Favored 'General case' 0 N--CA 1.45 -0.455 0 N-CA-C 109.49 -0.559 . . . . 0.0 109.49 179.856 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 10' ' ' PHE . . . . . 0.519 ' CE2' ' HB2' ' A' ' 32' ' ' LEU . 11.7 t80 -69.14 -41.45 77.29 Favored 'General case' 0 N--CA 1.453 -0.284 0 C-N-CA 123.295 0.638 . . . . 0.0 109.411 175.503 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 94.6 t -63.68 -50.1 79.42 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.36 0 N-CA-C 109.032 -0.729 . . . . 0.0 109.032 179.771 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -61.13 -28.45 69.11 Favored 'General case' 0 N--CA 1.451 -0.409 0 C-N-CA 122.702 0.401 . . . . 0.0 111.137 179.731 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 85.8 m -73.98 -38.22 64.23 Favored 'General case' 0 N--CA 1.454 -0.266 0 N-CA-C 109.335 -0.617 . . . . 0.0 109.335 175.817 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.408 ' HA ' ' CD1' ' A' ' 17' ' ' PHE . 0.1 OUTLIER -64.67 -43.82 92.36 Favored 'General case' 0 N--CA 1.453 -0.285 0 N-CA-C 108.809 -0.811 . . . . 0.0 108.809 176.916 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 66.4 mm-40 -65.22 -29.05 69.82 Favored 'General case' 0 N--CA 1.454 -0.243 0 C-N-CA 123.88 0.872 . . . . 0.0 109.988 178.633 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 67.0 m -69.76 -29.03 66.28 Favored 'General case' 0 N--CA 1.451 -0.397 0 N-CA-C 109.787 -0.449 . . . . 0.0 109.787 176.968 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 17' ' ' PHE . . . . . 0.467 ' CD1' HD11 ' A' ' 68' ' ' ILE . 18.4 m-85 -68.55 -40.49 80.62 Favored 'General case' 0 N--CA 1.456 -0.151 0 C-N-CA 120.195 -0.602 . . . . 0.0 109.869 172.814 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 18' ' ' LYS . . . . . 0.4 ' HG2' ' CE1' ' A' ' 53' ' ' TYR . 65.5 mttt -65.48 -26.14 67.8 Favored 'General case' 0 N--CA 1.463 0.187 0 CA-C-O 121.134 0.492 . . . . 0.0 110.544 178.338 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 31.7 t0 -81.04 -6.81 59.24 Favored 'General case' 0 CA--C 1.536 0.442 0 C-N-CA 123.748 0.819 . . . . 0.0 112.99 -178.537 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 20' ' ' LEU . . . . . 0.42 ' CD1' ' HB2' ' A' ' 25' ' ' SER . 18.4 mt -93.6 151.01 19.96 Favored 'General case' 0 N--CA 1.455 -0.2 0 N-CA-C 113.17 0.804 . . . . 0.0 113.17 -176.558 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -71.75 -6.36 40.77 Favored 'General case' 0 CA--C 1.53 0.188 0 C-N-CA 124.049 0.939 . . . . 0.0 112.978 178.532 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 58.9 m -137.85 -7.8 1.63 Allowed 'General case' 0 CA--C 1.522 -0.096 0 N-CA-C 112.925 0.713 . . . . 0.0 112.925 -176.875 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 72.52 -25.69 0.74 Allowed Glycine 0 CA--C 1.528 0.859 0 C-N-CA 123.758 0.694 . . . . 0.0 112.512 -179.805 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 94.8 mt -76.98 141.64 15.35 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.263 0 N-CA-C 108.012 -1.107 . . . . 0.0 108.012 175.388 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 25' ' ' SER . . . . . 0.42 ' HB2' ' CD1' ' A' ' 20' ' ' LEU . 7.5 t -160.51 79.88 0.65 Allowed 'General case' 0 CA--C 1.518 -0.254 0 N-CA-C 110.209 -0.293 . . . . 0.0 110.209 -174.598 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 26' ' ' GLY . . . . . 0.4 ' O ' ' HE2' ' A' ' 30' ' ' LYS . . . -48.28 -49.95 24.19 Favored Glycine 0 CA--C 1.527 0.782 0 CA-C-O 118.851 -0.972 . . . . 0.0 114.17 -171.002 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 27' ' ' SER . . . . . 0.522 ' HA ' ' HE3' ' A' ' 30' ' ' LYS . 47.3 p -73.27 -33.34 65.2 Favored 'General case' 0 C--N 1.339 0.14 0 CA-C-N 119.962 1.881 . . . . 0.0 111.641 -174.54 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 2.3 mpt_? -73.91 -36.8 64.76 Favored 'General case' 0 N--CA 1.456 -0.147 0 N-CA-C 109.253 -0.647 . . . . 0.0 109.253 177.344 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 74.5 mt -61.25 -47.51 93.17 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.287 0 N-CA-C 109.007 -0.738 . . . . 0.0 109.007 175.417 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 30' ' ' LYS . . . . . 0.522 ' HE3' ' HA ' ' A' ' 27' ' ' SER . 52.1 mtmt -64.87 -30.15 71.14 Favored 'General case' 0 C--N 1.339 0.122 0 CA-C-O 119.36 -0.352 . . . . 0.0 111.135 179.65 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 31' ' ' LYS . . . . . 0.47 ' CE ' ' HA ' ' A' ' 31' ' ' LYS . 2.8 mmpt? -65.87 -60.07 3.23 Favored 'General case' 0 N--CA 1.455 -0.223 0 CA-C-N 118.455 0.57 . . . . 0.0 111.328 -179.942 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.519 ' HB2' ' CE2' ' A' ' 10' ' ' PHE . 1.2 pp -75.89 -16.55 60.02 Favored 'General case' 0 CA--C 1.532 0.276 0 C-N-CA 119.247 -0.981 . . . . 0.0 111.687 -177.925 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 33' ' ' THR . . . . . 0.434 ' N ' HD12 ' A' ' 32' ' ' LEU . 24.7 m -70.26 -42.94 71.49 Favored 'General case' 0 N--CA 1.454 -0.232 0 N-CA-C 108.398 -0.964 . . . . 0.0 108.398 173.338 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 93.5 m -66.65 -41.46 88.19 Favored 'General case' 0 N--CA 1.45 -0.459 0 N-CA-C 109.664 -0.495 . . . . 0.0 109.664 -178.728 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 23.8 t80 -60.49 -36.53 78.54 Favored 'General case' 0 C--N 1.339 0.122 0 N-CA-C 110.155 -0.313 . . . . 0.0 110.155 177.073 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -72.3 -28.12 62.88 Favored 'General case' 0 N--CA 1.451 -0.391 0 CA-C-O 119.211 -0.423 . . . . 0.0 111.516 179.457 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 2.7 mm? -82.12 -34.08 29.4 Favored 'General case' 0 CA--C 1.518 -0.281 0 N-CA-C 108.822 -0.807 . . . . 0.0 108.822 -177.923 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 86.7 m-20 -64.4 -27.19 68.83 Favored 'General case' 0 N--CA 1.444 -0.766 0 C-N-CA 123.652 0.781 . . . . 0.0 110.959 174.274 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 65.8 m80 -151.53 106.62 3.29 Favored 'General case' 0 N--CA 1.454 -0.234 0 C-N-CA 122.624 0.37 . . . . 0.0 111.621 -179.187 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 40' ' ' ILE . . . . . 0.597 ' H ' HD13 ' A' ' 40' ' ' ILE . 0.0 OUTLIER -80.53 -10.15 12.3 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.359 0 C-N-CA 123.058 0.543 . . . . 0.0 109.728 173.631 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -55.4 -23.39 24.45 Favored 'General case' 0 N--CA 1.457 -0.122 0 C-N-CA 123.86 0.864 . . . . 0.0 111.86 -178.016 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -108.6 18.0 6.74 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.246 0 C-N-CA 124.032 0.933 . . . . 0.0 111.95 -179.83 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 3.0 pp20? -53.33 -30.1 37.46 Favored 'General case' 0 CA--C 1.53 0.183 0 O-C-N 121.649 -0.657 . . . . 0.0 111.598 178.985 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 47.1 t -65.33 -44.49 87.61 Favored 'General case' 0 CA--C 1.53 0.196 0 N-CA-C 111.756 0.28 . . . . 0.0 111.756 -175.89 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 45' ' ' LYS . . . . . 0.472 ' HD3' ' CD1' ' A' ' 7' ' ' PHE . 19.4 ptpt -73.94 -24.79 59.71 Favored 'General case' 0 C--N 1.341 0.22 0 O-C-N 121.738 -0.601 . . . . 0.0 110.167 179.253 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 84.8 mt -72.99 -48.17 45.4 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.327 0 C-N-CA 122.873 0.469 . . . . 0.0 109.948 -179.475 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 35.5 mm -63.92 -35.54 73.69 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.323 0 N-CA-C 109.646 -0.501 . . . . 0.0 109.646 178.977 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 15.4 t -63.25 -45.76 90.06 Favored 'General case' 0 N--CA 1.453 -0.276 0 C-N-CA 119.813 -0.755 . . . . 0.0 110.557 178.158 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 49' ' ' LEU . . . . . 0.417 HD23 ' HA ' ' A' ' 49' ' ' LEU . 25.7 mt -66.6 -33.6 76.03 Favored 'General case' 0 N--CA 1.451 -0.415 0 CA-C-O 118.677 -0.677 . . . . 0.0 112.684 -175.671 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 15.9 pt -69.58 -42.64 80.67 Favored 'Isoleucine or valine' 0 C--N 1.339 0.12 0 CA-C-N 119.553 1.069 . . . . 0.0 110.85 177.077 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 37.7 pt -71.03 -39.86 75.32 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.173 0 C-N-CA 119.926 -0.71 . . . . 0.0 111.13 179.8 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 79.7 m-20 -65.99 -42.31 89.98 Favored 'General case' 0 N--CA 1.454 -0.238 0 C-N-CA 122.492 0.317 . . . . 0.0 110.589 178.984 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 53' ' ' TYR . . . . . 0.4 ' CE1' ' HG2' ' A' ' 18' ' ' LYS . 14.5 t80 -64.95 -45.23 86.63 Favored 'General case' 0 N--CA 1.451 -0.419 0 N-CA-C 109.566 -0.531 . . . . 0.0 109.566 178.266 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 23.7 m -63.84 -30.16 71.27 Favored 'General case' 0 N--CA 1.456 -0.156 0 N-CA-C 111.502 0.186 . . . . 0.0 111.502 -177.522 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 15.6 tpp180 -75.63 -45.07 39.44 Favored 'General case' 0 N--CA 1.453 -0.281 0 O-C-N 122.957 0.161 . . . . 0.0 110.822 -177.16 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 42.0 mt -83.71 -43.4 15.56 Favored 'General case' 0 N--CA 1.456 -0.154 0 N-CA-C 113.379 0.881 . . . . 0.0 113.379 -174.912 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 9.0 p -64.42 154.42 83.85 Favored Pre-proline 0 CA--C 1.535 0.4 0 N-CA-C 113.074 0.768 . . . . 0.0 113.074 -172.088 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 94.6 Cg_endo -74.43 171.6 17.79 Favored 'Trans proline' 0 N--CA 1.455 -0.745 0 C-N-CA 125.125 3.883 . . . . 0.0 111.824 179.806 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -43.5 -49.14 7.39 Favored 'General case' 0 CA--C 1.532 0.255 0 C-N-CA 125.909 1.684 . . . . 0.0 113.794 -174.173 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 87.9 p -70.08 -35.34 74.12 Favored 'General case' 0 N--CA 1.457 -0.118 0 O-C-N 121.967 -0.458 . . . . 0.0 110.684 -176.408 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 62.3 m170 -75.33 -24.91 57.45 Favored 'General case' 0 N--CA 1.45 -0.438 0 CA-C-O 119.28 -0.39 . . . . 0.0 110.379 178.617 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 66.3 mttm -64.61 -47.76 77.43 Favored 'General case' 0 C--N 1.342 0.251 0 N-CA-C 109.094 -0.706 . . . . 0.0 109.094 172.913 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -58.93 -43.23 91.12 Favored 'General case' 0 CA--C 1.533 0.316 0 N-CA-C 108.003 -1.11 . . . . 0.0 108.003 177.454 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -63.02 -34.84 91.05 Favored Glycine 0 CA--C 1.526 0.733 0 N-CA-C 111.146 -0.782 . . . . 0.0 111.146 -179.582 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 44.6 t -67.32 -39.18 85.84 Favored 'General case' 0 N--CA 1.452 -0.337 0 CA-C-N 117.61 0.705 . . . . 0.0 109.644 177.409 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 8.0 mp -64.27 -28.92 70.05 Favored 'General case' 0 N--CA 1.453 -0.324 0 N-CA-C 110.098 -0.334 . . . . 0.0 110.098 178.38 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 0.9 OUTLIER -69.96 -41.27 74.71 Favored 'General case' 0 CA--C 1.528 0.123 0 CA-C-N 117.784 0.265 . . . . 0.0 110.59 175.673 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 68' ' ' ILE . . . . . 0.467 HD11 ' CD1' ' A' ' 17' ' ' PHE . 8.3 mt -64.19 -48.56 85.11 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.269 0 N-CA-C 109.73 -0.471 . . . . 0.0 109.73 176.874 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 91.2 mt -57.75 -33.71 46.02 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.317 0 C-N-CA 123.129 0.572 . . . . 0.0 111.504 178.117 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 17.6 t70 -69.63 -41.84 75.11 Favored 'General case' 0 CA--C 1.521 -0.139 0 CA-C-N 119.116 0.871 . . . . 0.0 110.563 176.986 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 35.4 t -66.24 -59.6 3.58 Favored 'General case' 0 N--CA 1.45 -0.431 0 C-N-CA 122.672 0.389 . . . . 0.0 110.279 -177.381 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -75.17 -33.05 27.56 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.272 0 O-C-N 122.262 -0.274 . . . . 0.0 110.511 -177.217 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -68.33 -50.32 39.41 Favored Glycine 0 CA--C 1.524 0.613 0 N-CA-C 111.739 -0.544 . . . . 0.0 111.739 -174.119 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 41.6 mtm105 -72.13 -39.17 69.0 Favored 'General case' 0 N--CA 1.452 -0.347 0 CA-C-N 117.482 0.641 . . . . 0.0 109.753 179.061 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -62.56 -30.33 71.23 Favored 'General case' 0 N--CA 1.45 -0.461 0 C-N-CA 119.788 -0.765 . . . . 0.0 110.334 -179.611 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 1.7 m-30 -70.02 -53.46 17.49 Favored 'General case' 0 CA--C 1.518 -0.25 0 CA-C-N 118.161 0.437 . . . . 0.0 111.133 176.317 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -71.4 -32.0 67.92 Favored 'General case' 0 N--CA 1.449 -0.512 0 C-N-CA 117.751 -1.58 . . . . 0.0 109.865 -175.04 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 85.5 m-20 -68.9 -45.57 70.57 Favored 'General case' 0 N--CA 1.457 -0.096 0 CA-C-N 118.218 0.463 . . . . 0.0 112.152 179.378 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 15.7 tm-20 -65.19 -50.13 67.08 Favored 'General case' 0 N--CA 1.444 -0.727 0 C-N-CA 120.764 -0.374 . . . . 0.0 110.64 179.705 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 80' ' ' THR . . . . . 0.431 HG21 ' HB3' ' A' ' 94' ' ' CYS . 69.3 p -64.74 -27.11 68.68 Favored 'General case' 0 N--CA 1.454 -0.262 0 N-CA-C 111.708 0.262 . . . . 0.0 111.708 -179.242 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 32.8 ttp-105 -75.26 -30.56 60.51 Favored 'General case' 0 N--CA 1.456 -0.156 0 C-N-CA 122.806 0.442 . . . . 0.0 110.807 175.468 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 19.8 m . . . . . 0 N--CA 1.454 -0.232 0 C-N-CA 122.894 0.478 . . . . 0.0 111.673 -179.75 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 31.2 Cg_exo . . . . . 0 N--CA 1.451 -1.022 0 N-CA-C 109.368 -1.051 . . . . 0.0 109.368 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 83.6 13.81 74.9 Favored Glycine 0 CA--C 1.528 0.871 0 N-CA-C 111.65 -0.58 . . . . 0.0 111.65 -177.088 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -153.52 165.23 36.53 Favored 'General case' 0 N--CA 1.454 -0.245 0 C-N-CA 124.534 1.134 . . . . 0.0 109.469 -179.845 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 94' ' ' CYS . . . . . 0.431 ' HB3' HG21 ' A' ' 80' ' ' THR . 29.4 p -56.22 -21.35 22.76 Favored 'General case' 0 N--CA 1.453 -0.305 0 C-N-CA 123.519 0.728 . . . . 0.0 110.925 177.323 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -58.31 -63.44 1.27 Allowed 'General case' 0 N--CA 1.447 -0.616 0 O-C-N 122.297 -0.252 . . . . 0.0 110.327 -176.111 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 76.8 t60 -71.62 -33.28 68.83 Favored 'General case' 0 N--CA 1.451 -0.418 0 CA-C-N 117.609 0.186 . . . . 0.0 110.514 -179.489 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -62.75 -52.78 61.89 Favored 'General case' 0 N--CA 1.451 -0.388 0 O-C-N 123.229 0.331 . . . . 0.0 111.535 -176.837 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 98' ' ' ILE . . . . . 0.426 HD13 ' HB2' ' A' ' 94' ' ' CYS . 1.8 mp -71.82 -36.11 57.31 Favored 'Isoleucine or valine' 0 C--N 1.338 0.097 0 C-N-CA 121.001 -0.28 . . . . 0.0 110.75 -178.69 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 24.4 m-80 -69.02 -38.51 79.25 Favored 'General case' 0 N--CA 1.455 -0.2 0 CA-C-N 118.442 0.565 . . . . 0.0 111.736 -179.996 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 99.6 m -73.37 -33.68 65.18 Favored 'General case' 0 N--CA 1.456 -0.143 0 CA-C-N 118.422 0.555 . . . . 0.0 110.449 -178.98 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 62.6 tp -75.29 -37.56 60.79 Favored 'General case' 0 N--CA 1.449 -0.489 0 N-CA-C 110.317 -0.253 . . . . 0.0 110.317 179.707 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -61.96 -22.75 62.83 Favored Glycine 0 CA--C 1.527 0.81 0 CA-C-O 119.448 -0.64 . . . . 0.0 113.138 -173.752 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 13.7 mm-40 -80.14 -39.32 29.67 Favored 'General case' 0 N--CA 1.452 -0.36 0 CA-C-N 117.702 0.751 . . . . 0.0 112.403 -179.939 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 21.7 m -100.61 -14.77 7.8 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.092 0 N-CA-C 112.992 0.738 . . . . 0.0 112.992 -175.746 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 105' ' ' ILE . . . . . . . . . . . . . 9.8 tp -63.5 -26.8 41.62 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.206 0 CA-C-N 118.511 0.596 . . . . 0.0 111.206 -177.458 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 20.3 pt20 -66.27 -29.85 70.17 Favored 'General case' 0 N--CA 1.452 -0.361 0 O-C-N 122.006 -0.434 . . . . 0.0 111.039 -179.937 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 84.0 mt-10 -73.74 -40.7 63.34 Favored 'General case' 0 N--CA 1.453 -0.31 0 N-CA-C 109.511 -0.552 . . . . 0.0 109.511 177.395 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 66.1 mt -74.96 -35.94 62.08 Favored 'General case' 0 N--CA 1.451 -0.405 0 C-N-CA 122.996 0.518 . . . . 0.0 111.343 -174.853 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 92.7 mt -70.54 -52.71 19.84 Favored 'General case' 0 N--CA 1.452 -0.341 0 N-CA-C 109.583 -0.525 . . . . 0.0 109.583 177.163 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 13.1 t -59.26 -37.43 77.6 Favored 'General case' 0 N--CA 1.453 -0.276 0 CA-C-N 117.749 0.249 . . . . 0.0 111.034 -178.153 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 36.9 t0 -62.87 -45.75 91.1 Favored 'General case' 0 N--CA 1.454 -0.267 0 N-CA-C 108.883 -0.784 . . . . 0.0 108.883 174.59 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -65.7 -30.36 71.03 Favored 'General case' 0 N--CA 1.448 -0.569 0 CA-C-O 118.959 -0.543 . . . . 0.0 110.837 -176.538 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 113' ' ' ILE . . . . . . . . . . . . . 49.6 mm -68.19 -50.78 54.91 Favored 'Isoleucine or valine' 0 C--N 1.34 0.156 0 CA-C-N 119.073 0.851 . . . . 0.0 109.56 177.647 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -69.63 -41.29 75.82 Favored 'General case' 0 N--CA 1.449 -0.501 0 O-C-N 123.03 0.207 . . . . 0.0 111.088 -175.381 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 115' ' ' LYS . . . . . 0.575 ' HE2' ' HA ' ' A' ' 115' ' ' LYS . 0.6 OUTLIER -75.61 -40.42 56.4 Favored 'General case' 0 N--CA 1.45 -0.429 0 N-CA-C 113.977 1.103 . . . . 0.0 113.977 -176.521 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 116' ' ' SER . . . . . 0.479 ' HB3' ' CB ' ' A' ' 120' ' ' HIS . 2.4 m -80.53 157.33 26.14 Favored 'General case' 0 CA--C 1.53 0.188 0 C-N-CA 120.181 -0.608 . . . . 0.0 112.539 -169.156 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 62.9 t30 -72.74 171.35 12.76 Favored 'General case' 0 CA--C 1.531 0.213 0 C-N-CA 124.05 0.94 . . . . 0.0 111.887 -174.845 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 118' ' ' GLN . . . . . . . . . . . . . 53.6 mt-30 -51.4 -44.3 62.18 Favored 'General case' 0 C--O 1.231 0.115 0 C-N-CA 123.615 0.766 . . . . 0.0 111.553 -176.826 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 22.5 t0 -65.97 -33.04 74.9 Favored 'General case' 0 N--CA 1.454 -0.234 0 CA-C-O 121.469 0.652 . . . . 0.0 109.975 -179.717 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 120' ' ' HIS . . . . . 0.479 ' CB ' ' HB3' ' A' ' 116' ' ' SER . 21.9 m170 -75.98 -45.88 32.5 Favored 'General case' 0 N--CA 1.447 -0.576 0 CA-C-N 115.746 -0.661 . . . . 0.0 110.342 -178.824 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 52.8 mttm -57.7 -37.77 74.07 Favored 'General case' 0 C--N 1.341 0.234 0 N-CA-C 108.856 -0.794 . . . . 0.0 108.856 179.792 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 7.0 tm-20 -62.48 -51.99 65.29 Favored 'General case' 0 N--CA 1.452 -0.373 0 C-N-CA 122.251 0.221 . . . . 0.0 110.758 179.004 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 3.1 mtmm -64.77 -27.12 68.68 Favored 'General case' 0 N--CA 1.454 -0.226 0 CA-C-N 116.761 -0.2 . . . . 0.0 111.244 179.866 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 124' ' ' ILE . . . . . . . . . . . . . 54.6 mt -74.81 -39.65 45.81 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.242 0 O-C-N 121.576 -0.702 . . . . 0.0 109.517 175.706 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 125' ' ' ARG . . . . . 0.424 HH11 ' HA ' ' A' ' 125' ' ' ARG . 7.2 mmm180 -59.79 -41.5 91.3 Favored 'General case' 0 N--CA 1.454 -0.271 0 CA-C-O 119.073 -0.489 . . . . 0.0 111.09 178.584 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 126' ' ' MET . . . . . . . . . . . . . 28.1 ptm -66.23 -39.98 89.93 Favored 'General case' 0 N--CA 1.449 -0.48 0 C-N-CA 118.542 -1.263 . . . . 0.0 108.409 176.663 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 4.0 mp -62.29 -36.95 83.7 Favored 'General case' 0 N--CA 1.456 -0.174 0 CA-C-N 118.839 0.745 . . . . 0.0 111.549 179.845 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 93.2 mt -67.61 -42.94 81.58 Favored 'General case' 0 N--CA 1.457 -0.099 0 CA-C-N 118.551 0.614 . . . . 0.0 110.325 178.598 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 27.6 m-20 -69.73 -32.4 70.93 Favored 'General case' 0 N--CA 1.454 -0.261 0 N-CA-C 110.045 -0.354 . . . . 0.0 110.045 178.946 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 34.5 mt -61.98 -39.76 84.82 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.286 0 N-CA-C 109.885 -0.413 . . . . 0.0 109.885 176.641 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 131' ' ' TRP . . . . . . . . . . . . . 32.3 m0 . . . . . 0 N--CA 1.453 -0.302 0 C-N-CA 120.372 -0.531 . . . . 0.0 112.084 -179.779 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 21.3 p-10 . . . . . 0 CA--C 1.518 -0.28 0 CA-C-O 120.649 0.261 . . . . 0.0 111.678 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -75.65 -41.58 53.7 Favored 'General case' 0 N--CA 1.441 -0.905 0 C-N-CA 120.356 -0.538 . . . . 0.0 111.534 -170.501 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 52.2 tp60 -52.52 -36.57 55.62 Favored 'General case' 0 N--CA 1.453 -0.298 0 N-CA-C 112.169 0.433 . . . . 0.0 112.169 -176.179 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 54.2 m-80 -71.74 -35.64 70.2 Favored 'General case' 0 N--CA 1.453 -0.291 0 C-N-CA 120.541 -0.463 . . . . 0.0 110.139 179.391 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 10' ' ' PHE . . . . . 0.426 ' CE1' HD22 ' A' ' 32' ' ' LEU . 1.9 t80 -71.99 -37.49 69.84 Favored 'General case' 0 N--CA 1.451 -0.394 0 C-N-CA 123.011 0.524 . . . . 0.0 110.891 178.987 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 99.3 t -65.79 -57.3 11.23 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.337 0 N-CA-C 108.625 -0.88 . . . . 0.0 108.625 179.6 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -59.06 -31.35 68.79 Favored 'General case' 0 N--CA 1.453 -0.284 0 C-N-CA 122.894 0.477 . . . . 0.0 112.021 -177.246 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 79.2 m -70.31 -39.36 74.85 Favored 'General case' 0 N--CA 1.456 -0.144 0 CA-C-N 118.723 0.692 . . . . 0.0 109.588 176.707 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.441 ' HA ' ' CD1' ' A' ' 17' ' ' PHE . 2.8 tp -70.15 -39.66 75.24 Favored 'General case' 0 N--CA 1.453 -0.285 0 CA-C-O 121.169 0.509 . . . . 0.0 110.489 -179.479 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 61.7 mm-40 -64.07 -29.69 70.81 Favored 'General case' 0 N--CA 1.45 -0.431 0 N-CA-C 108.872 -0.788 . . . . 0.0 108.872 177.617 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 32.3 t -71.59 -29.18 64.41 Favored 'General case' 0 N--CA 1.45 -0.455 0 CA-C-O 119.476 -0.297 . . . . 0.0 110.427 177.306 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 17' ' ' PHE . . . . . 0.535 ' CD1' HD11 ' A' ' 68' ' ' ILE . 27.3 m-85 -67.6 -36.66 81.29 Favored 'General case' 0 C--N 1.342 0.253 0 CA-C-N 118.508 0.595 . . . . 0.0 110.845 172.503 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 18' ' ' LYS . . . . . 0.495 ' HG2' ' CE1' ' A' ' 53' ' ' TYR . 61.2 mttt -61.49 -37.72 84.66 Favored 'General case' 0 C--N 1.341 0.202 0 C-N-CA 120.088 -0.645 . . . . 0.0 109.367 176.643 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 39.1 t0 -81.07 -18.87 45.13 Favored 'General case' 0 CA--C 1.534 0.331 0 N-CA-C 113.176 0.806 . . . . 0.0 113.176 -178.908 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 20' ' ' LEU . . . . . 0.451 HD12 ' HA ' ' A' ' 17' ' ' PHE . 1.4 mt -64.8 -7.51 11.38 Favored 'General case' 0 C--O 1.227 -0.1 0 CA-C-O 118.439 -0.791 . . . . 0.0 112.816 178.722 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 36.0 mmtm 64.19 -48.08 0.29 Allowed 'General case' 0 CA--C 1.528 0.111 0 C-N-CA 126.506 1.923 . . . . 0.0 112.547 179.602 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 53.3 m -85.74 -13.26 48.9 Favored 'General case' 0 N--CA 1.451 -0.418 0 C-N-CA 123.186 0.594 . . . . 0.0 110.861 174.309 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 79.31 -34.33 1.99 Allowed Glycine 0 CA--C 1.527 0.834 0 C-N-CA 124.45 1.024 . . . . 0.0 113.16 175.553 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 93.9 mt -80.45 146.15 8.02 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.252 0 CA-C-N 118.025 0.912 . . . . 0.0 111.401 -178.933 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 35.1 t -169.02 97.68 0.36 Allowed 'General case' 0 CA--C 1.517 -0.326 0 N-CA-C 108.274 -1.01 . . . . 0.0 108.274 173.438 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -53.41 -34.72 49.22 Favored Glycine 0 CA--C 1.526 0.742 0 CA-C-O 119.405 -0.664 . . . . 0.0 111.672 -176.518 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 98.4 p -66.6 -49.92 64.74 Favored 'General case' 0 N--CA 1.456 -0.157 0 CA-C-N 118.255 1.027 . . . . 0.0 110.432 -178.261 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 33.8 mtm180 -73.83 -34.9 64.75 Favored 'General case' 0 C--O 1.231 0.127 0 C-N-CA 122.383 0.273 . . . . 0.0 110.788 -179.077 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 59.7 mt -58.79 -50.44 79.32 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.467 0 N-CA-C 109.228 -0.656 . . . . 0.0 109.228 174.55 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 70.9 mttt -64.47 -28.73 69.87 Favored 'General case' 0 CA--C 1.529 0.141 0 CA-C-O 118.904 -0.569 . . . . 0.0 111.43 178.773 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 31' ' ' LYS . . . . . 0.439 ' CE ' ' HA ' ' A' ' 31' ' ' LYS . 3.4 mmpt? -63.41 -58.88 5.65 Favored 'General case' 0 N--CA 1.457 -0.083 0 CA-C-N 118.624 0.647 . . . . 0.0 111.205 179.124 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.514 HD12 ' N ' ' A' ' 33' ' ' THR . 1.4 pp -75.78 -18.42 59.53 Favored 'General case' 0 N--CA 1.454 -0.256 0 C-N-CA 118.732 -1.187 . . . . 0.0 111.739 -178.714 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 33' ' ' THR . . . . . 0.514 ' N ' HD12 ' A' ' 32' ' ' LEU . 38.6 m -70.76 -41.49 71.68 Favored 'General case' 0 N--CA 1.455 -0.201 0 N-CA-C 108.664 -0.865 . . . . 0.0 108.664 175.931 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 98.2 m -69.54 -38.31 77.43 Favored 'General case' 0 N--CA 1.45 -0.46 0 CA-C-N 116.459 -0.337 . . . . 0.0 110.441 -178.188 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 26.6 t80 -69.89 -29.81 67.1 Favored 'General case' 0 N--CA 1.454 -0.259 0 C-N-CA 119.826 -0.75 . . . . 0.0 110.899 178.369 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -68.94 -32.15 71.55 Favored 'General case' 0 N--CA 1.448 -0.571 0 N-CA-C 110.313 -0.254 . . . . 0.0 110.313 176.53 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -76.98 -34.26 57.56 Favored 'General case' 0 N--CA 1.456 -0.154 0 N-CA-C 110.173 -0.306 . . . . 0.0 110.173 174.171 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 40.4 t0 -60.55 -24.81 65.7 Favored 'General case' 0 CA--C 1.531 0.229 0 C-N-CA 122.926 0.49 . . . . 0.0 110.563 175.547 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 27.3 m-70 -158.32 110.19 2.25 Favored 'General case' 0 N--CA 1.455 -0.193 0 C-N-CA 123.374 0.67 . . . . 0.0 111.28 172.691 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 40' ' ' ILE . . . . . 0.584 ' H ' HD13 ' A' ' 40' ' ' ILE . 0.0 OUTLIER -77.35 -11.39 13.59 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.385 0 N-CA-C 109.626 -0.509 . . . . 0.0 109.626 173.45 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 48.0 m-20 -59.33 -19.91 50.28 Favored 'General case' 0 CA--C 1.532 0.264 0 C-N-CA 122.987 0.515 . . . . 0.0 111.87 -177.916 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -102.95 13.36 6.93 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.195 0 C-N-CA 123.068 0.547 . . . . 0.0 111.848 176.576 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 3.0 pp20? -52.78 -32.01 41.51 Favored 'General case' 0 CA--C 1.527 0.093 0 O-C-N 121.613 -0.679 . . . . 0.0 112.096 -179.659 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 48.2 t -61.99 -48.86 78.46 Favored 'General case' 0 N--CA 1.455 -0.199 0 O-C-N 122.172 -0.33 . . . . 0.0 111.563 -176.113 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 19.6 ptpt -71.9 -24.66 61.69 Favored 'General case' 0 C--N 1.34 0.156 0 O-C-N 121.857 -0.527 . . . . 0.0 109.837 179.764 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 46' ' ' ILE . . . . . 0.42 HG12 ' CZ ' ' A' ' 10' ' ' PHE . 89.6 mt -71.87 -46.0 62.51 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.263 0 C-N-CA 122.763 0.425 . . . . 0.0 110.427 -179.393 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 33.9 mm -63.99 -35.67 74.26 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.224 0 N-CA-C 109.478 -0.564 . . . . 0.0 109.478 178.058 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 13.3 t -63.25 -41.6 99.08 Favored 'General case' 0 N--CA 1.453 -0.319 0 C-N-CA 119.644 -0.822 . . . . 0.0 110.36 177.801 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 4.4 mp -67.99 -37.13 81.12 Favored 'General case' 0 N--CA 1.454 -0.272 0 CA-C-O 118.791 -0.623 . . . . 0.0 112.172 -176.202 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 15.6 pt -69.33 -41.54 80.98 Favored 'Isoleucine or valine' 0 C--O 1.23 0.076 0 CA-C-N 119.168 0.895 . . . . 0.0 110.597 179.901 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 27.5 pt -71.48 -39.75 71.3 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.178 0 C-N-CA 120.084 -0.647 . . . . 0.0 110.646 179.164 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 90.1 m-20 -68.19 -41.67 81.05 Favored 'General case' 0 N--CA 1.452 -0.33 0 CA-C-N 118.1 0.409 . . . . 0.0 112.002 -179.93 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 53' ' ' TYR . . . . . 0.495 ' CE1' ' HG2' ' A' ' 18' ' ' LYS . 8.5 t80 -67.1 -47.04 72.42 Favored 'General case' 0 N--CA 1.453 -0.292 0 N-CA-C 109.202 -0.666 . . . . 0.0 109.202 178.512 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 39.8 t -65.19 -28.16 69.2 Favored 'General case' 0 N--CA 1.453 -0.288 0 N-CA-C 111.589 0.218 . . . . 0.0 111.589 -178.052 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 55.7 ttp85 -75.48 -41.46 55.44 Favored 'General case' 0 N--CA 1.454 -0.232 0 C-N-CA 123.405 0.682 . . . . 0.0 112.251 -179.078 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 46.8 mt -86.98 -43.54 12.28 Favored 'General case' 0 C--O 1.227 -0.111 0 N-CA-C 112.541 0.571 . . . . 0.0 112.541 -176.448 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 8.2 p -66.48 156.8 84.83 Favored Pre-proline 0 CA--C 1.538 0.486 0 N-CA-C 113.416 0.895 . . . . 0.0 113.416 -172.666 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 87.2 Cg_endo -73.49 173.3 14.06 Favored 'Trans proline' 0 N--CA 1.456 -0.711 0 C-N-CA 124.707 3.605 . . . . 0.0 111.048 178.887 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -51.78 -42.78 62.68 Favored 'General case' 0 CA--C 1.53 0.197 0 N-CA-C 113.581 0.956 . . . . 0.0 113.581 -172.96 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 51.0 m -66.88 -40.39 87.78 Favored 'General case' 0 N--CA 1.455 -0.189 0 CA-C-N 118.076 0.398 . . . . 0.0 110.283 -177.006 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 39.9 m170 -75.78 -24.11 55.97 Favored 'General case' 0 N--CA 1.45 -0.44 0 N-CA-C 109.89 -0.411 . . . . 0.0 109.89 177.272 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 62' ' ' LYS . . . . . 0.405 ' HB2' ' HE2' ' A' ' 62' ' ' LYS . 19.7 ttmm -73.61 -34.02 64.86 Favored 'General case' 0 N--CA 1.454 -0.257 0 C-N-CA 123.744 0.817 . . . . 0.0 109.595 178.51 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -66.54 -45.18 80.28 Favored 'General case' 0 CA--C 1.53 0.186 0 N-CA-C 107.334 -1.358 . . . . 0.0 107.334 172.719 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -64.96 -30.45 78.04 Favored Glycine 0 C--N 1.34 0.768 0 N-CA-C 111.193 -0.763 . . . . 0.0 111.193 179.241 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 59.4 m -67.54 -40.63 85.02 Favored 'General case' 0 N--CA 1.454 -0.255 0 N-CA-C 109.419 -0.586 . . . . 0.0 109.419 177.649 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 59.6 mt -70.82 -24.05 62.47 Favored 'General case' 0 N--CA 1.452 -0.326 0 N-CA-C 110.187 -0.301 . . . . 0.0 110.187 178.885 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -72.43 -37.91 68.47 Favored 'General case' 0 C--O 1.231 0.101 0 CA-C-N 117.932 0.333 . . . . 0.0 110.105 175.421 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 68' ' ' ILE . . . . . 0.535 HD11 ' CD1' ' A' ' 17' ' ' PHE . 18.2 mt -68.48 -44.94 82.79 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.342 0 N-CA-C 109.114 -0.699 . . . . 0.0 109.114 176.609 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 76.2 mt -58.34 -32.01 44.06 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.114 0 C-N-CA 123.156 0.582 . . . . 0.0 110.748 175.791 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 19.7 t70 -69.57 -47.11 64.72 Favored 'General case' 0 N--CA 1.454 -0.263 0 CA-C-N 117.967 0.349 . . . . 0.0 111.325 179.696 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 99.2 p -71.59 -47.35 55.38 Favored 'General case' 0 N--CA 1.449 -0.503 0 C-N-CA 121.092 -0.243 . . . . 0.0 110.73 -176.538 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -75.66 -34.04 27.88 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.28 0 N-CA-C 109.879 -0.415 . . . . 0.0 109.879 -178.539 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -66.23 -52.41 36.5 Favored Glycine 0 C--N 1.334 0.466 0 N-CA-C 111.248 -0.741 . . . . 0.0 111.248 -175.745 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 44.5 mtm105 -71.46 -38.65 71.26 Favored 'General case' 0 N--CA 1.451 -0.408 0 CA-C-O 119.168 -0.444 . . . . 0.0 110.767 -179.926 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -63.16 -30.94 71.99 Favored 'General case' 0 N--CA 1.451 -0.401 0 C-N-CA 119.763 -0.775 . . . . 0.0 109.972 -179.231 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 1.8 m-30 -69.76 -52.14 27.94 Favored 'General case' 0 N--CA 1.454 -0.234 0 CA-C-O 119.265 -0.398 . . . . 0.0 110.965 176.473 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 8.0 tt -70.28 -45.53 66.17 Favored 'General case' 0 N--CA 1.448 -0.547 0 C-N-CA 117.328 -1.749 . . . . 0.0 109.458 -176.474 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 91.0 m-20 -56.96 -47.64 80.25 Favored 'General case' 0 N--CA 1.455 -0.189 0 CA-C-O 119.17 -0.443 . . . . 0.0 111.795 -176.244 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 75.5 mm-40 -70.41 -41.38 73.05 Favored 'General case' 0 N--CA 1.455 -0.22 0 CA-C-N 118.498 0.59 . . . . 0.0 111.902 -179.614 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 80.9 p -72.38 -28.14 62.82 Favored 'General case' 0 CA--C 1.529 0.148 0 CA-C-N 118.804 0.729 . . . . 0.0 111.574 -179.429 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 5.7 tmm_? -82.48 -35.05 27.79 Favored 'General case' 0 N--CA 1.457 -0.09 0 C-N-CA 123.22 0.608 . . . . 0.0 111.48 179.372 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 40.0 t . . . . . 0 N--CA 1.457 -0.082 0 N-CA-C 113.086 0.773 . . . . 0.0 113.086 -179.326 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 83.7 Cg_endo . . . . . 0 N--CA 1.453 -0.877 0 N-CA-C 108.94 -1.215 . . . . 0.0 108.94 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 88.64 15.33 60.05 Favored Glycine 0 CA--C 1.526 0.762 0 C-N-CA 121.186 -0.53 . . . . 0.0 112.175 -177.753 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -152.48 164.35 37.75 Favored 'General case' 0 N--CA 1.455 -0.187 0 C-N-CA 124.025 0.93 . . . . 0.0 110.042 179.679 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 94' ' ' CYS . . . . . 0.593 ' SG ' HD13 ' A' ' 98' ' ' ILE . 2.5 t -52.63 -26.47 13.74 Favored 'General case' 0 N--CA 1.453 -0.317 0 C-N-CA 123.316 0.646 . . . . 0.0 110.716 175.93 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -55.74 -58.76 6.48 Favored 'General case' 0 N--CA 1.449 -0.501 0 O-C-N 122.164 -0.335 . . . . 0.0 110.598 -176.98 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 76.3 t60 -75.49 -32.96 60.74 Favored 'General case' 0 N--CA 1.453 -0.306 0 O-C-N 122.286 -0.259 . . . . 0.0 111.117 -179.833 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -65.4 -51.86 57.45 Favored 'General case' 0 N--CA 1.449 -0.493 0 O-C-N 122.977 0.173 . . . . 0.0 111.453 -176.255 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 98' ' ' ILE . . . . . 0.593 HD13 ' SG ' ' A' ' 94' ' ' CYS . 1.7 mp -72.03 -34.18 49.67 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.153 0 N-CA-C 110.18 -0.304 . . . . 0.0 110.18 -179.248 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 21.8 m-20 -66.87 -46.18 75.78 Favored 'General case' 0 N--CA 1.452 -0.355 0 C-N-CA 120.319 -0.552 . . . . 0.0 111.304 178.281 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 87.8 m -67.95 -35.03 77.7 Favored 'General case' 0 N--CA 1.456 -0.125 0 CA-C-N 118.077 0.399 . . . . 0.0 110.896 -176.319 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 57.7 tp -75.9 -39.83 55.57 Favored 'General case' 0 N--CA 1.449 -0.489 0 CA-C-O 119.779 -0.153 . . . . 0.0 111.05 -179.261 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -66.37 -16.09 64.49 Favored Glycine 0 CA--C 1.528 0.849 0 CA-C-O 119.634 -0.537 . . . . 0.0 112.717 -175.549 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 14.9 mm-40 -78.83 -34.77 44.9 Favored 'General case' 0 N--CA 1.455 -0.211 0 CA-C-N 117.754 0.777 . . . . 0.0 112.133 179.908 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 18.9 m -112.44 3.47 8.4 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.135 0 O-C-N 124.007 0.817 . . . . 0.0 112.88 -174.027 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 105' ' ' ILE . . . . . . . . . . . . . 10.9 tp -68.93 -26.93 33.68 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.224 0 O-C-N 121.927 -0.483 . . . . 0.0 111.49 -177.915 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 14.1 pt20 -70.32 -31.56 68.93 Favored 'General case' 0 N--CA 1.455 -0.214 0 O-C-N 121.786 -0.571 . . . . 0.0 110.085 -178.888 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 48.4 mp0 -71.49 -38.74 71.15 Favored 'General case' 0 N--CA 1.451 -0.394 0 CA-C-N 118.256 0.48 . . . . 0.0 110.32 177.705 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 87.3 mt -74.11 -36.24 64.2 Favored 'General case' 0 N--CA 1.455 -0.212 0 N-CA-C 110.669 -0.122 . . . . 0.0 110.669 -178.401 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 87.6 mt -71.58 -47.7 53.14 Favored 'General case' 0 N--CA 1.452 -0.344 0 C-N-CA 120.874 -0.33 . . . . 0.0 110.295 176.133 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 48.3 t -57.16 -40.34 77.06 Favored 'General case' 0 N--CA 1.457 -0.105 0 C-N-CA 122.435 0.294 . . . . 0.0 110.604 179.716 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 39.8 t0 -64.12 -42.75 96.72 Favored 'General case' 0 N--CA 1.453 -0.282 0 N-CA-C 109.256 -0.646 . . . . 0.0 109.256 176.156 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -70.79 -39.01 73.39 Favored 'General case' 0 N--CA 1.445 -0.68 0 CA-C-O 119.141 -0.457 . . . . 0.0 111.36 -175.252 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 113' ' ' ILE . . . . . . . . . . . . . 12.1 mm -68.65 -38.53 79.12 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.276 0 CA-C-N 119.592 1.087 . . . . 0.0 109.75 -179.308 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -67.2 -47.6 70.41 Favored 'General case' 0 N--CA 1.45 -0.464 0 C-N-CA 122.839 0.456 . . . . 0.0 111.707 178.234 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 115' ' ' LYS . . . . . 0.588 ' HE2' ' HA ' ' A' ' 115' ' ' LYS . 0.3 OUTLIER -84.05 -34.79 24.16 Favored 'General case' 0 N--CA 1.455 -0.194 0 N-CA-C 114.018 1.118 . . . . 0.0 114.018 -172.907 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 116' ' ' SER . . . . . 0.453 ' HB2' ' CB ' ' A' ' 120' ' ' HIS . 28.3 p -77.63 159.42 29.21 Favored 'General case' 0 CA--C 1.528 0.121 0 N-CA-C 112.527 0.565 . . . . 0.0 112.527 -172.505 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 53.8 t30 -80.35 164.58 23.02 Favored 'General case' 0 C--O 1.225 -0.22 0 C-N-CA 123.713 0.805 . . . . 0.0 111.127 -178.461 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 118' ' ' GLN . . . . . . . . . . . . . 4.9 pt20 -44.76 -48.86 10.85 Favored 'General case' 0 N--CA 1.455 -0.197 0 C-N-CA 124.034 0.934 . . . . 0.0 113.05 -179.176 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 49.8 t0 -60.76 -39.69 89.68 Favored 'General case' 0 CA--C 1.531 0.217 0 CA-C-O 121.002 0.429 . . . . 0.0 110.192 178.51 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 120' ' ' HIS . . . . . 0.453 ' CB ' ' HB2' ' A' ' 116' ' ' SER . 24.9 m170 -68.67 -40.8 79.96 Favored 'General case' 0 N--CA 1.451 -0.38 0 N-CA-C 109.69 -0.485 . . . . 0.0 109.69 -179.053 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 94.8 mttt -59.26 -34.6 72.44 Favored 'General case' 0 C--N 1.339 0.127 0 N-CA-C 109.446 -0.576 . . . . 0.0 109.446 178.87 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 24.2 tt0 -67.58 -45.98 73.97 Favored 'General case' 0 N--CA 1.455 -0.193 0 C-N-CA 122.527 0.331 . . . . 0.0 110.766 179.134 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 14.4 mptt -68.18 -35.42 77.99 Favored 'General case' 0 C--N 1.338 0.099 0 C-N-CA 120.42 -0.512 . . . . 0.0 110.386 -177.753 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 124' ' ' ILE . . . . . . . . . . . . . 63.5 mt -66.7 -38.52 81.74 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.207 0 N-CA-C 108.96 -0.756 . . . . 0.0 108.96 177.513 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 125' ' ' ARG . . . . . 0.442 ' HA ' ' HD2' ' A' ' 125' ' ' ARG . 25.0 tpt85 -66.39 -42.22 88.21 Favored 'General case' 0 N--CA 1.443 -0.776 0 N-CA-C 111.849 0.314 . . . . 0.0 111.849 -172.431 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 126' ' ' MET . . . . . . . . . . . . . 27.1 ptm -67.13 -33.28 75.1 Favored 'General case' 0 N--CA 1.45 -0.436 0 N-CA-C 108.965 -0.754 . . . . 0.0 108.965 175.606 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 2.7 mp -61.92 -34.55 76.28 Favored 'General case' 0 CA--C 1.53 0.203 0 CA-C-O 119.271 -0.395 . . . . 0.0 110.146 176.227 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 53.6 mt -68.1 -43.46 78.4 Favored 'General case' 0 N--CA 1.455 -0.201 0 CA-C-N 119.139 0.881 . . . . 0.0 110.459 178.743 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 55.3 m-20 -65.47 -37.74 87.74 Favored 'General case' 0 CA--C 1.529 0.163 0 C-N-CA 120.314 -0.555 . . . . 0.0 110.042 177.925 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 53.1 mt -63.06 -36.39 75.65 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.319 0 C-N-CA 122.766 0.426 . . . . 0.0 110.297 178.516 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 131' ' ' TRP . . . . . . . . . . . . . 51.4 m0 . . . . . 0 N--CA 1.453 -0.299 0 N-CA-C 112.522 0.564 . . . . 0.0 112.522 -179.27 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 23.1 p-10 . . . . . 0 CA--C 1.52 -0.184 0 N-CA-C 106.835 -1.543 . . . . 0.0 106.835 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 7' ' ' PHE . . . . . 0.44 ' CE1' HD22 ' A' ' 49' ' ' LEU . 0.7 OUTLIER -75.05 -34.3 61.82 Favored 'General case' 0 N--CA 1.441 -0.886 0 CA-C-N 115.341 -0.845 . . . . 0.0 110.129 -179.023 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 60.5 tp60 -48.19 -39.84 22.27 Favored 'General case' 0 CA--C 1.529 0.163 0 C-N-CA 123.984 0.914 . . . . 0.0 112.125 -175.427 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 4.1 m-80 -70.16 -38.65 75.49 Favored 'General case' 0 CA--C 1.529 0.173 0 CA-C-O 121.264 0.554 . . . . 0.0 110.283 -178.867 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 1.8 t80 -70.82 -37.38 73.2 Favored 'General case' 0 N--CA 1.451 -0.425 0 C-N-CA 124.289 1.036 . . . . 0.0 109.601 179.503 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 74.9 t -68.6 -52.9 31.26 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.302 0 N-CA-C 108.872 -0.788 . . . . 0.0 108.872 179.322 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -57.91 -31.43 66.77 Favored 'General case' 0 N--CA 1.453 -0.29 0 CA-C-N 117.78 0.264 . . . . 0.0 111.519 -179.135 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 82.9 m -69.31 -42.67 75.1 Favored 'General case' 0 CA--C 1.534 0.332 0 N-CA-C 109.015 -0.735 . . . . 0.0 109.015 175.366 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.459 HD11 ' CD2' ' A' ' 53' ' ' TYR . 0.1 OUTLIER -64.09 -40.23 95.77 Favored 'General case' 0 N--CA 1.454 -0.232 0 C-N-CA 122.947 0.499 . . . . 0.0 110.039 179.152 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 73.1 mm-40 -65.27 -32.5 74.19 Favored 'General case' 0 N--CA 1.451 -0.38 0 C-N-CA 123.565 0.746 . . . . 0.0 109.702 179.558 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 16.2 p -65.14 -34.28 78.02 Favored 'General case' 0 N--CA 1.454 -0.253 0 N-CA-C 109.537 -0.542 . . . . 0.0 109.537 176.068 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 17' ' ' PHE . . . . . 0.536 ' CD1' HD11 ' A' ' 68' ' ' ILE . 14.8 m-30 -67.18 -34.26 77.15 Favored 'General case' 0 N--CA 1.458 -0.038 0 C-N-CA 121.187 -0.205 . . . . 0.0 111.529 175.845 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 18' ' ' LYS . . . . . 0.513 ' HG2' ' CE1' ' A' ' 53' ' ' TYR . 53.2 mttt -68.99 -24.9 64.28 Favored 'General case' 0 C--O 1.227 -0.089 0 N-CA-C 110.084 -0.339 . . . . 0.0 110.084 175.172 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 30.6 t0 -78.43 -23.9 46.41 Favored 'General case' 0 CA--C 1.534 0.359 0 C-N-CA 123.106 0.563 . . . . 0.0 111.811 178.23 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 93.3 mt -75.53 164.93 25.84 Favored 'General case' 0 CA--C 1.529 0.17 0 CA-C-O 121.132 0.492 . . . . 0.0 111.196 179.101 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -94.01 -45.53 7.55 Favored 'General case' 0 N--CA 1.455 -0.212 0 N-CA-C 108.573 -0.899 . . . . 0.0 108.573 177.533 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 53.9 m -80.43 -16.35 54.62 Favored 'General case' 0 CA--C 1.529 0.139 0 C-N-CA 122.949 0.5 . . . . 0.0 111.563 -179.235 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 72.6 -29.05 0.73 Allowed Glycine 0 CA--C 1.529 0.963 0 C-N-CA 124.29 0.948 . . . . 0.0 113.203 178.134 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 94.6 mt -75.81 147.54 7.95 Favored 'Isoleucine or valine' 0 C--N 1.339 0.109 0 CA-C-N 117.94 0.87 . . . . 0.0 109.455 177.028 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 6.4 t -163.7 78.23 0.41 Allowed 'General case' 0 N--CA 1.453 -0.312 0 N-CA-C 110.322 -0.251 . . . . 0.0 110.322 -178.495 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -45.72 -52.74 9.12 Favored Glycine 0 CA--C 1.527 0.798 0 CA-C-O 118.928 -0.929 . . . . 0.0 114.126 -170.63 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 37.8 t -65.5 -45.04 85.12 Favored 'General case' 0 N--CA 1.456 -0.157 0 CA-C-N 119.432 1.616 . . . . 0.0 110.918 -175.374 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 17.1 mtm180 -70.48 -37.64 74.26 Favored 'General case' 0 CA--C 1.527 0.091 0 CA-C-O 119.385 -0.341 . . . . 0.0 111.228 -179.356 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 63.4 mt -56.5 -43.92 79.25 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.474 0 N-CA-C 108.185 -1.042 . . . . 0.0 108.185 172.105 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 46.0 mtmt -70.81 -19.3 62.69 Favored 'General case' 0 N--CA 1.452 -0.337 0 CA-C-O 118.653 -0.689 . . . . 0.0 111.753 179.382 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 31' ' ' LYS . . . . . 0.518 ' HE3' ' HA ' ' A' ' 31' ' ' LYS . 0.0 OUTLIER -69.32 -55.17 11.21 Favored 'General case' 0 C--N 1.343 0.284 0 CA-C-N 119.223 0.919 . . . . 0.0 109.585 174.793 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.422 HD12 ' N ' ' A' ' 33' ' ' THR . 3.2 pp -75.18 -19.71 59.69 Favored 'General case' 0 N--CA 1.456 -0.145 0 C-N-CA 119.567 -0.853 . . . . 0.0 111.177 -178.773 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 33' ' ' THR . . . . . 0.422 ' N ' HD12 ' A' ' 32' ' ' LEU . 53.3 m -71.84 -43.18 65.97 Favored 'General case' 0 N--CA 1.453 -0.314 0 N-CA-C 108.923 -0.769 . . . . 0.0 108.923 175.535 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 80.6 m -67.39 -37.53 83.27 Favored 'General case' 0 N--CA 1.453 -0.284 0 O-C-N 122.359 -0.213 . . . . 0.0 110.449 -177.7 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 81.0 t80 -68.68 -34.42 75.65 Favored 'General case' 0 N--CA 1.45 -0.467 0 O-C-N 122.285 -0.259 . . . . 0.0 110.493 177.451 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -68.48 -36.18 78.58 Favored 'General case' 0 N--CA 1.451 -0.421 0 O-C-N 122.288 -0.257 . . . . 0.0 110.352 177.688 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -69.86 -33.84 72.8 Favored 'General case' 0 N--CA 1.455 -0.208 0 C-N-CA 122.729 0.412 . . . . 0.0 110.32 179.357 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 43.5 t0 -69.44 -21.59 63.72 Favored 'General case' 0 N--CA 1.451 -0.393 0 C-N-CA 122.564 0.346 . . . . 0.0 110.767 176.129 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 95.6 m-70 -150.67 95.62 2.25 Favored 'General case' 0 C--N 1.341 0.22 0 N-CA-C 112.208 0.447 . . . . 0.0 112.208 -175.413 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 40' ' ' ILE . . . . . 0.617 ' H ' HD13 ' A' ' 40' ' ' ILE . 0.0 OUTLIER -74.28 -13.28 15.64 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.291 0 CA-C-O 119.529 -0.272 . . . . 0.0 110.311 175.09 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 19.1 m-20 -57.68 -22.46 46.16 Favored 'General case' 0 N--CA 1.456 -0.131 0 C-N-CA 122.975 0.51 . . . . 0.0 112.104 -176.997 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -108.77 18.38 6.6 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.185 0 C-N-CA 122.897 0.479 . . . . 0.0 112.255 178.384 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 3.1 pp20? -52.85 -27.58 19.03 Favored 'General case' 0 C--O 1.226 -0.165 0 CA-C-N 118.365 0.529 . . . . 0.0 109.582 174.785 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 90.3 p -58.94 -55.11 39.42 Favored 'General case' 0 N--CA 1.453 -0.294 0 C-N-CA 123.668 0.787 . . . . 0.0 111.315 -178.708 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 45' ' ' LYS . . . . . 0.435 ' HD3' ' CD1' ' A' ' 7' ' ' PHE . 17.0 ptpt -73.76 -21.5 60.17 Favored 'General case' 0 C--N 1.338 0.108 0 O-C-N 122.298 -0.251 . . . . 0.0 110.98 -179.858 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 93.5 mt -74.37 -45.61 46.01 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.198 0 N-CA-C 110.045 -0.354 . . . . 0.0 110.045 -179.81 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 34.6 mm -66.35 -38.85 82.71 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.126 0 N-CA-C 109.422 -0.584 . . . . 0.0 109.422 178.66 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 27.4 t -63.05 -38.92 93.11 Favored 'General case' 0 N--CA 1.453 -0.278 0 C-N-CA 119.657 -0.817 . . . . 0.0 109.887 177.332 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 49' ' ' LEU . . . . . 0.44 HD22 ' CE1' ' A' ' 7' ' ' PHE . 32.7 tp -72.03 -31.89 66.61 Favored 'General case' 0 N--CA 1.449 -0.52 0 N-CA-C 112.615 0.598 . . . . 0.0 112.615 -173.772 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 14.4 pt -70.82 -41.34 77.33 Favored 'Isoleucine or valine' 0 C--N 1.34 0.169 0 CA-C-N 118.785 0.72 . . . . 0.0 110.099 175.996 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 42.4 pt -71.38 -37.74 66.24 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.171 0 C-N-CA 119.875 -0.73 . . . . 0.0 110.85 179.664 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 84.5 m-20 -65.37 -44.99 85.88 Favored 'General case' 0 C--O 1.233 0.214 0 CA-C-N 117.927 0.331 . . . . 0.0 111.307 177.849 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 53' ' ' TYR . . . . . 0.513 ' CE1' ' HG2' ' A' ' 18' ' ' LYS . 9.3 t80 -60.64 -42.94 97.94 Favored 'General case' 0 C--N 1.34 0.189 0 N-CA-C 108.893 -0.78 . . . . 0.0 108.893 176.365 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 25.0 m -69.21 -26.93 65.06 Favored 'General case' 0 N--CA 1.453 -0.319 0 C-N-CA 122.197 0.199 . . . . 0.0 111.479 -177.899 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 51.9 tpt85 -75.78 -35.13 60.21 Favored 'General case' 0 N--CA 1.455 -0.194 0 O-C-N 121.985 -0.447 . . . . 0.0 111.336 -178.697 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 32.4 mt -89.08 -43.17 11.27 Favored 'General case' 0 N--CA 1.457 -0.113 0 N-CA-C 112.772 0.656 . . . . 0.0 112.772 -177.548 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 57' ' ' CYS . . . . . 0.44 ' HB2' ' CB ' ' A' ' 61' ' ' HIS . 3.4 p -65.89 157.86 78.08 Favored Pre-proline 0 CA--C 1.536 0.422 0 N-CA-C 114.981 1.474 . . . . 0.0 114.981 -169.715 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 58' ' ' PRO . . . . . 0.415 ' HD2' ' HB2' ' A' ' 57' ' ' CYS . 51.5 Cg_endo -78.12 -166.92 0.43 Allowed 'Trans proline' 0 N--CA 1.456 -0.677 1 C-N-CA 125.72 4.28 . . . . 0.0 111.243 175.29 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 29.9 p-10 -61.7 -52.26 65.05 Favored 'General case' 0 CA--C 1.53 0.2 0 C-N-CA 125.131 1.372 . . . . 0.0 113.793 -172.15 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 40.3 m -67.73 -34.25 76.47 Favored 'General case' 0 N--CA 1.455 -0.198 0 CA-C-O 120.709 0.29 . . . . 0.0 110.615 -174.234 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 61' ' ' HIS . . . . . 0.44 ' CB ' ' HB2' ' A' ' 57' ' ' CYS . 55.3 m170 -74.33 -23.29 59.03 Favored 'General case' 0 N--CA 1.452 -0.33 0 N-CA-C 109.901 -0.407 . . . . 0.0 109.901 176.132 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 4.4 tppt? -67.36 -39.8 85.73 Favored 'General case' 0 N--CA 1.455 -0.215 0 N-CA-C 108.978 -0.749 . . . . 0.0 108.978 176.558 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -67.49 -42.41 82.96 Favored 'General case' 0 N--CA 1.454 -0.254 0 N-CA-C 108.875 -0.787 . . . . 0.0 108.875 177.221 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -66.14 -31.0 77.94 Favored Glycine 0 C--N 1.339 0.738 0 N-CA-C 111.116 -0.794 . . . . 0.0 111.116 179.533 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 50.5 m -67.29 -43.04 82.75 Favored 'General case' 0 N--CA 1.455 -0.189 0 N-CA-C 109.808 -0.442 . . . . 0.0 109.808 177.571 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 61.3 mt -68.51 -25.98 65.22 Favored 'General case' 0 N--CA 1.453 -0.311 0 CA-C-O 119.554 -0.26 . . . . 0.0 110.79 179.384 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 1.4 m-85 -70.94 -37.81 72.87 Favored 'General case' 0 N--CA 1.455 -0.215 0 CA-C-N 117.778 0.263 . . . . 0.0 110.721 175.473 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 68' ' ' ILE . . . . . 0.536 HD11 ' CD1' ' A' ' 17' ' ' PHE . 14.7 mt -67.69 -46.9 81.78 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.472 0 N-CA-C 108.859 -0.793 . . . . 0.0 108.859 176.401 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 95.7 mt -57.39 -37.5 57.69 Favored 'Isoleucine or valine' 0 C--N 1.339 0.128 0 C-N-CA 123.49 0.716 . . . . 0.0 111.071 176.641 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 17.6 t70 -69.42 -43.6 73.07 Favored 'General case' 0 N--CA 1.455 -0.19 0 CA-C-N 118.161 0.437 . . . . 0.0 110.291 178.421 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 29.4 t -66.63 -57.33 7.42 Favored 'General case' 0 N--CA 1.451 -0.385 0 C-N-CA 122.733 0.413 . . . . 0.0 110.988 -176.993 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -75.57 -32.32 24.71 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.408 0 N-CA-C 109.868 -0.419 . . . . 0.0 109.868 -176.733 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -64.84 -50.55 57.77 Favored Glycine 0 C--N 1.337 0.606 0 N-CA-C 111.385 -0.686 . . . . 0.0 111.385 -175.587 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 37.1 mtm105 -71.88 -39.13 69.84 Favored 'General case' 0 N--CA 1.451 -0.383 0 CA-C-N 117.481 0.64 . . . . 0.0 110.134 178.81 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -62.16 -33.94 75.46 Favored 'General case' 0 N--CA 1.452 -0.357 0 C-N-CA 120.54 -0.464 . . . . 0.0 110.751 -179.122 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 1.4 m-30 -69.79 -49.85 48.8 Favored 'General case' 0 CA--C 1.52 -0.204 0 CA-C-N 118.419 0.554 . . . . 0.0 111.023 175.764 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 2.5 tm? -67.93 -35.85 79.14 Favored 'General case' 0 N--CA 1.45 -0.443 0 C-N-CA 118.689 -1.204 . . . . 0.0 109.092 -175.024 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 92.6 m-20 -65.79 -46.9 76.96 Favored 'General case' 0 C--O 1.231 0.116 0 N-CA-C 112.488 0.551 . . . . 0.0 112.488 177.166 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 13.6 tm-20 -65.02 -47.77 76.25 Favored 'General case' 0 N--CA 1.448 -0.573 0 C-N-CA 121.096 -0.241 . . . . 0.0 110.55 -179.027 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 80' ' ' THR . . . . . 0.568 HG21 ' HB3' ' A' ' 94' ' ' CYS . 68.4 p -67.27 -28.33 67.94 Favored 'General case' 0 N--CA 1.45 -0.463 0 CA-C-O 119.502 -0.285 . . . . 0.0 110.913 179.727 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 36.8 ttp-105 -69.93 -26.88 64.35 Favored 'General case' 0 C--N 1.338 0.088 0 CA-C-N 118.544 0.611 . . . . 0.0 110.182 173.401 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 22.5 m . . . . . 0 N--CA 1.454 -0.242 0 N-CA-C 112.965 0.728 . . . . 0.0 112.965 -177.669 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_exo . . . . . 0 N--CA 1.453 -0.875 0 CA-C-O 120.769 0.237 . . . . 0.0 111.707 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 89.31 17.17 56.07 Favored Glycine 0 CA--C 1.528 0.851 0 CA-C-O 119.525 -0.597 . . . . 0.0 113.238 176.427 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -156.21 165.37 36.58 Favored 'General case' 0 N--CA 1.457 -0.076 0 CA-C-N 117.904 0.852 . . . . 0.0 109.557 178.724 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 94' ' ' CYS . . . . . 0.568 ' HB3' HG21 ' A' ' 80' ' ' THR . 31.5 p -55.55 -23.08 24.75 Favored 'General case' 0 N--CA 1.453 -0.317 0 C-N-CA 123.611 0.764 . . . . 0.0 110.813 178.729 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -60.18 -60.35 3.96 Favored 'General case' 0 N--CA 1.445 -0.681 0 N-CA-C 110.098 -0.334 . . . . 0.0 110.098 -176.076 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 75.0 t60 -72.71 -31.45 65.02 Favored 'General case' 0 N--CA 1.451 -0.386 0 O-C-N 122.052 -0.405 . . . . 0.0 110.728 179.417 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -64.33 -53.67 45.04 Favored 'General case' 0 N--CA 1.452 -0.348 0 CA-C-O 119.686 -0.197 . . . . 0.0 111.366 -178.36 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 98' ' ' ILE . . . . . 0.424 HD13 ' HB2' ' A' ' 94' ' ' CYS . 1.9 mp -70.91 -34.31 55.33 Favored 'Isoleucine or valine' 0 C--N 1.339 0.109 0 CA-C-N 118.074 0.397 . . . . 0.0 110.244 -179.757 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 73.0 m-20 -62.56 -42.28 99.44 Favored 'General case' 0 N--CA 1.456 -0.165 0 CA-C-N 118.159 0.436 . . . . 0.0 110.883 177.719 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 92.2 m -74.54 -31.78 62.23 Favored 'General case' 0 N--CA 1.455 -0.178 0 N-CA-C 110.443 -0.206 . . . . 0.0 110.443 -178.705 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -70.82 -41.11 71.98 Favored 'General case' 0 N--CA 1.452 -0.359 0 C-N-CA 122.632 0.373 . . . . 0.0 110.742 -179.01 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -62.47 -20.74 61.6 Favored Glycine 0 CA--C 1.529 0.928 0 CA-C-O 119.63 -0.539 . . . . 0.0 113.741 -173.767 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 55.9 mm-40 -85.58 -36.06 20.66 Favored 'General case' 0 N--CA 1.455 -0.21 0 CA-C-N 118.362 1.081 . . . . 0.0 112.666 -179.837 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 59.0 t -92.14 -26.57 4.89 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.155 0 O-C-N 123.26 0.35 . . . . 0.0 111.765 -176.985 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 105' ' ' ILE . . . . . . . . . . . . . 10.5 tp -62.45 -26.0 39.32 Favored 'Isoleucine or valine' 0 C--N 1.338 0.075 0 O-C-N 122.111 -0.368 . . . . 0.0 111.672 -174.126 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 24.0 pt20 -69.73 -40.69 76.04 Favored 'General case' 0 N--CA 1.451 -0.404 0 C-N-CA 120.96 -0.296 . . . . 0.0 110.695 -178.765 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 76.8 mm-40 -80.89 -26.15 37.05 Favored 'General case' 0 N--CA 1.454 -0.252 0 CA-C-N 118.367 0.531 . . . . 0.0 110.743 176.696 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 6.8 tt -67.69 -42.59 81.81 Favored 'General case' 0 N--CA 1.454 -0.248 0 N-CA-C 108.891 -0.781 . . . . 0.0 108.891 176.277 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 69.2 mt -68.9 -45.42 70.95 Favored 'General case' 0 N--CA 1.449 -0.475 0 N-CA-C 109.192 -0.67 . . . . 0.0 109.192 173.921 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 43.2 t -47.4 -52.07 17.91 Favored 'General case' 0 C--O 1.234 0.264 0 CA-C-N 118.041 0.382 . . . . 0.0 111.087 178.471 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 40.7 t0 -62.09 -43.8 98.05 Favored 'General case' 0 N--CA 1.455 -0.175 0 N-CA-C 109.135 -0.691 . . . . 0.0 109.135 179.362 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -65.08 -39.69 93.56 Favored 'General case' 0 N--CA 1.45 -0.472 0 N-CA-C 112.237 0.458 . . . . 0.0 112.237 -176.424 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 113' ' ' ILE . . . . . . . . . . . . . 26.8 mm -69.08 -39.44 79.53 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.502 0 CA-C-N 119.133 0.879 . . . . 0.0 109.756 -176.714 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -74.95 -43.83 51.87 Favored 'General case' 0 N--CA 1.453 -0.291 0 C-N-CA 120.624 -0.431 . . . . 0.0 111.878 178.935 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 33.3 ttmt -80.0 -30.74 39.7 Favored 'General case' 0 C--O 1.227 -0.11 0 N-CA-C 113.892 1.071 . . . . 0.0 113.892 -173.159 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 116' ' ' SER . . . . . 0.457 ' HB2' ' CB ' ' A' ' 120' ' ' HIS . 50.6 p -80.0 157.28 26.84 Favored 'General case' 0 CA--C 1.529 0.166 0 N-CA-C 111.974 0.361 . . . . 0.0 111.974 -174.139 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 53.1 t30 -76.21 166.5 23.37 Favored 'General case' 0 N--CA 1.454 -0.226 0 C-N-CA 123.323 0.649 . . . . 0.0 110.269 -179.056 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 118' ' ' GLN . . . . . . . . . . . . . 21.2 mm100 -55.11 -38.46 68.19 Favored 'General case' 0 CA--C 1.528 0.13 0 N-CA-C 112.778 0.658 . . . . 0.0 112.778 -172.426 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 8.0 p30 -69.4 -37.77 77.66 Favored 'General case' 0 N--CA 1.457 -0.084 0 N-CA-C 109.667 -0.494 . . . . 0.0 109.667 178.617 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 120' ' ' HIS . . . . . 0.457 ' CB ' ' HB2' ' A' ' 116' ' ' SER . 31.0 m170 -65.47 -42.11 92.61 Favored 'General case' 0 N--CA 1.45 -0.451 0 N-CA-C 109.445 -0.576 . . . . 0.0 109.445 176.798 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 52.8 mttm -56.74 -38.69 72.75 Favored 'General case' 0 C--N 1.341 0.234 0 N-CA-C 109.299 -0.63 . . . . 0.0 109.299 178.147 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 3.5 tm-20 -68.18 -48.93 63.95 Favored 'General case' 0 N--CA 1.456 -0.142 0 CA-C-O 119.47 -0.3 . . . . 0.0 111.71 179.179 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 40.9 mmtm -58.67 -33.65 70.36 Favored 'General case' 0 N--CA 1.456 -0.133 0 CA-C-N 118.112 0.414 . . . . 0.0 111.05 178.31 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 124' ' ' ILE . . . . . . . . . . . . . 57.1 mt -74.17 -37.41 46.18 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.291 0 N-CA-C 109.606 -0.516 . . . . 0.0 109.606 178.122 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 5.9 tpt180 -68.09 -36.68 80.2 Favored 'General case' 0 N--CA 1.45 -0.451 0 O-C-N 122.07 -0.394 . . . . 0.0 111.066 -176.84 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 126' ' ' MET . . . . . . . . . . . . . 5.6 ppp? -75.05 -27.03 59.86 Favored 'General case' 0 C--O 1.226 -0.139 0 N-CA-C 109.913 -0.402 . . . . 0.0 109.913 176.255 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 1.1 mp -62.11 -39.34 92.18 Favored 'General case' 0 CA--C 1.528 0.119 0 CA-C-N 117.928 0.331 . . . . 0.0 110.269 172.066 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -69.44 -37.81 77.53 Favored 'General case' 0 N--CA 1.457 -0.085 0 CA-C-N 118.162 0.437 . . . . 0.0 109.96 178.158 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 18.6 t70 -59.05 -45.03 91.8 Favored 'General case' 0 N--CA 1.452 -0.337 0 N-CA-C 109.27 -0.641 . . . . 0.0 109.27 175.666 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 55.0 mt -60.14 -35.68 63.19 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.24 0 N-CA-C 110.407 -0.22 . . . . 0.0 110.407 179.909 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 131' ' ' TRP . . . . . . . . . . . . . 46.2 m0 . . . . . 0 N--CA 1.453 -0.305 0 N-CA-C 112.937 0.717 . . . . 0.0 112.937 -178.589 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 23.5 p-10 . . . . . 0 N--CA 1.451 -0.408 0 N-CA-C 107.003 -1.48 . . . . 0.0 107.003 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 7' ' ' PHE . . . . . 0.494 ' CD1' ' HD3' ' A' ' 45' ' ' LYS . 1.5 t80 -54.58 -34.45 61.95 Favored 'General case' 0 N--CA 1.45 -0.447 0 CA-C-N 114.839 -1.073 . . . . 0.0 109.311 175.006 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 50.9 tp60 -51.82 -35.64 45.06 Favored 'General case' 0 N--CA 1.454 -0.234 0 C-N-CA 124.564 1.145 . . . . 0.0 111.802 -178.157 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 30.3 m-80 -73.0 -34.13 66.21 Favored 'General case' 0 N--CA 1.455 -0.196 0 N-CA-C 109.826 -0.435 . . . . 0.0 109.826 -179.762 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 10' ' ' PHE . . . . . 0.451 ' CE2' ' HB2' ' A' ' 32' ' ' LEU . 5.1 t80 -69.54 -38.95 77.69 Favored 'General case' 0 N--CA 1.447 -0.59 0 C-N-CA 123.57 0.748 . . . . 0.0 109.166 175.774 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 93.3 t -65.47 -53.18 42.52 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.426 0 N-CA-C 109.167 -0.679 . . . . 0.0 109.167 178.548 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -57.59 -29.18 64.26 Favored 'General case' 0 N--CA 1.454 -0.246 0 C-N-CA 122.554 0.341 . . . . 0.0 111.359 178.884 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 87.2 m -72.31 -39.1 68.5 Favored 'General case' 0 N--CA 1.456 -0.16 0 N-CA-C 109.345 -0.613 . . . . 0.0 109.345 176.263 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -64.74 -45.61 85.73 Favored 'General case' 0 N--CA 1.454 -0.236 0 N-CA-C 109.457 -0.572 . . . . 0.0 109.457 178.356 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 57.5 mm-40 -63.83 -32.12 73.53 Favored 'General case' 0 N--CA 1.453 -0.302 0 N-CA-C 109.357 -0.609 . . . . 0.0 109.357 178.37 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 69.7 m -66.25 -34.13 77.32 Favored 'General case' 0 N--CA 1.45 -0.473 0 CA-C-O 118.722 -0.656 . . . . 0.0 110.188 177.456 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 17' ' ' PHE . . . . . 0.435 ' CD1' HD11 ' A' ' 68' ' ' ILE . 42.8 m-85 -67.77 -39.33 84.13 Favored 'General case' 0 C--N 1.343 0.296 0 CA-C-N 119.036 0.835 . . . . 0.0 110.152 176.274 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 18' ' ' LYS . . . . . 0.425 ' HG2' ' CE1' ' A' ' 53' ' ' TYR . 46.0 mttt -60.14 -31.2 69.86 Favored 'General case' 0 C--N 1.341 0.208 0 CA-C-N 118.285 0.493 . . . . 0.0 109.844 -179.715 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 45.8 t0 -74.71 -16.78 60.74 Favored 'General case' 0 CA--C 1.534 0.359 0 CA-C-N 115.33 -0.85 . . . . 0.0 112.36 -179.676 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 20' ' ' LEU . . . . . 0.4 HD11 ' HB2' ' A' ' 25' ' ' SER . 81.8 mt -73.29 158.72 34.59 Favored 'General case' 0 N--CA 1.456 -0.138 0 O-C-N 121.528 -0.732 . . . . 0.0 112.07 -176.796 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 1.5 mppt? -98.3 -2.97 38.24 Favored 'General case' 0 CA--C 1.533 0.317 0 CA-C-N 115.106 -0.952 . . . . 0.0 109.7 176.087 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 87.0 p -120.65 -20.08 7.2 Favored 'General case' 0 C--N 1.34 0.168 0 C-N-CA 123.885 0.874 . . . . 0.0 111.031 179.428 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 77.03 -28.71 1.63 Allowed Glycine 0 CA--C 1.53 0.986 0 C-N-CA 124.093 0.854 . . . . 0.0 111.952 179.424 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 92.8 mt -85.89 150.21 3.98 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.341 0 N-CA-C 108.889 -0.782 . . . . 0.0 108.889 175.181 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 25' ' ' SER . . . . . 0.4 ' HB2' HD11 ' A' ' 20' ' ' LEU . 29.7 t -161.56 94.96 0.99 Allowed 'General case' 0 CA--C 1.513 -0.47 0 N-CA-C 109.159 -0.682 . . . . 0.0 109.159 170.006 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -55.56 -34.56 60.36 Favored Glycine 0 N--CA 1.445 -0.722 0 N-CA-C 110.881 -0.887 . . . . 0.0 110.881 -177.646 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 15.8 t -65.28 -54.44 29.24 Favored 'General case' 0 N--CA 1.455 -0.218 0 CA-C-N 118.334 1.067 . . . . 0.0 109.905 179.327 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 17.4 mmt85 -68.19 -38.06 81.61 Favored 'General case' 0 N--CA 1.455 -0.217 0 C-N-CA 122.3 0.24 . . . . 0.0 110.69 -176.523 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 75.6 mt -59.71 -43.49 91.55 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.634 0 N-CA-C 108.615 -0.883 . . . . 0.0 108.615 176.109 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 31.6 mtmm -67.02 -27.61 67.55 Favored 'General case' 0 C--N 1.34 0.19 0 CA-C-O 118.928 -0.558 . . . . 0.0 111.466 178.108 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.55 -58.61 5.38 Favored 'General case' 0 C--N 1.343 0.291 0 CA-C-N 118.848 0.749 . . . . 0.0 110.028 -179.969 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.548 HD12 ' N ' ' A' ' 33' ' ' THR . 2.3 pp -75.31 -19.23 59.77 Favored 'General case' 0 CA--C 1.529 0.144 0 C-N-CA 119.887 -0.725 . . . . 0.0 111.589 -175.964 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 33' ' ' THR . . . . . 0.548 ' N ' HD12 ' A' ' 32' ' ' LEU . 37.9 m -71.61 -40.93 69.49 Favored 'General case' 0 N--CA 1.456 -0.158 0 N-CA-C 107.8 -1.185 . . . . 0.0 107.8 176.517 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 92.6 m -68.21 -37.24 80.67 Favored 'General case' 0 N--CA 1.453 -0.323 0 C-N-CA 121.078 -0.249 . . . . 0.0 110.384 -178.563 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 24.1 t80 -63.06 -37.62 87.93 Favored 'General case' 0 N--CA 1.456 -0.135 0 N-CA-C 109.992 -0.373 . . . . 0.0 109.992 175.749 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -73.52 -36.5 65.73 Favored 'General case' 0 N--CA 1.45 -0.434 0 C-N-CA 122.471 0.309 . . . . 0.0 110.761 -179.026 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -71.32 -34.58 70.69 Favored 'General case' 0 N--CA 1.455 -0.183 0 C-N-CA 122.568 0.347 . . . . 0.0 110.547 179.363 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 43.5 t0 -69.72 -22.81 63.36 Favored 'General case' 0 CA--C 1.534 0.344 0 C-N-CA 122.544 0.338 . . . . 0.0 110.745 176.462 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 39' ' ' HIS . . . . . 0.401 ' HB2' HD11 ' A' ' 42' ' ' ILE . 96.5 m-70 -151.68 101.23 2.76 Favored 'General case' 0 N--CA 1.454 -0.24 0 N-CA-C 111.914 0.338 . . . . 0.0 111.914 -175.461 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 40' ' ' ILE . . . . . 0.58 ' H ' HD13 ' A' ' 40' ' ' ILE . 0.0 OUTLIER -78.67 -12.78 13.57 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.294 0 N-CA-C 109.728 -0.471 . . . . 0.0 109.728 174.187 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 17.2 m-20 -57.87 -19.43 29.28 Favored 'General case' 0 N--CA 1.454 -0.235 0 C-N-CA 123.774 0.83 . . . . 0.0 112.655 -176.817 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 42' ' ' ILE . . . . . 0.401 HD11 ' HB2' ' A' ' 39' ' ' HIS . 0.0 OUTLIER -112.29 19.82 6.79 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.245 0 C-N-CA 123.31 0.644 . . . . 0.0 111.388 178.091 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 3.1 pp20? -52.89 -28.1 21.64 Favored 'General case' 0 CA--C 1.532 0.255 0 O-C-N 121.856 -0.528 . . . . 0.0 111.728 178.055 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 36.6 t -64.97 -48.42 74.11 Favored 'General case' 0 CA--C 1.532 0.269 0 N-CA-C 111.634 0.235 . . . . 0.0 111.634 -177.26 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 45' ' ' LYS . . . . . 0.494 ' HD3' ' CD1' ' A' ' 7' ' ' PHE . 17.6 ptpt -73.35 -23.6 60.24 Favored 'General case' 0 C--N 1.341 0.2 0 CA-C-N 117.95 0.341 . . . . 0.0 110.398 179.275 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 67.1 mt -72.58 -51.19 29.63 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.318 0 C-N-CA 122.999 0.52 . . . . 0.0 110.278 -178.835 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 36.6 mm -66.78 -38.35 81.33 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.352 0 N-CA-C 109.996 -0.372 . . . . 0.0 109.996 -179.716 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 33.3 t -67.85 -34.98 77.74 Favored 'General case' 0 N--CA 1.454 -0.272 0 C-N-CA 120.778 -0.369 . . . . 0.0 111.378 -179.046 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 39.7 tp -77.79 -33.67 52.5 Favored 'General case' 0 N--CA 1.451 -0.395 0 O-C-N 121.652 -0.655 . . . . 0.0 112.407 -176.46 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 50' ' ' ILE . . . . . 0.426 HD12 HG12 ' A' ' 69' ' ' ILE . 4.2 pt -70.28 -43.08 78.83 Favored 'Isoleucine or valine' 0 C--N 1.34 0.173 0 CA-C-N 118.832 0.742 . . . . 0.0 110.378 177.55 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 51' ' ' ILE . . . . . 0.404 ' HA ' HD21 ' A' ' 108' ' ' LEU . 32.3 pt -63.12 -37.32 79.09 Favored 'Isoleucine or valine' 0 N--CA 1.461 0.101 0 C-N-CA 119.444 -0.903 . . . . 0.0 110.766 177.949 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 92.6 m-20 -68.51 -41.5 79.87 Favored 'General case' 0 N--CA 1.452 -0.346 0 O-C-N 121.937 -0.477 . . . . 0.0 111.571 178.409 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 53' ' ' TYR . . . . . 0.425 ' CE1' ' HG2' ' A' ' 18' ' ' LYS . 11.2 t80 -64.15 -42.75 96.66 Favored 'General case' 0 CA--C 1.523 -0.078 0 CA-C-N 118.891 0.769 . . . . 0.0 109.227 177.027 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 24.1 t -68.75 -24.72 64.48 Favored 'General case' 0 N--CA 1.453 -0.323 0 N-CA-C 112.105 0.409 . . . . 0.0 112.105 -176.665 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 73.4 mtm180 -86.18 -31.72 21.62 Favored 'General case' 0 N--CA 1.457 -0.094 0 CA-C-N 118.7 0.682 . . . . 0.0 111.823 179.946 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 47.4 mt -84.86 -43.6 13.98 Favored 'General case' 0 CA--C 1.528 0.118 0 N-CA-C 113.02 0.748 . . . . 0.0 113.02 -179.22 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 16.7 p -60.65 155.26 51.76 Favored Pre-proline 0 CA--C 1.538 0.493 0 N-CA-C 113.705 1.002 . . . . 0.0 113.705 -173.322 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 72.3 Cg_endo -75.67 -177.76 3.82 Favored 'Trans proline' 0 N--CA 1.457 -0.619 0 C-N-CA 124.848 3.698 . . . . 0.0 111.545 177.188 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -55.02 -50.91 67.87 Favored 'General case' 0 CA--C 1.53 0.201 0 N-CA-C 114.908 1.447 . . . . 0.0 114.908 -171.913 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 45.3 m -66.99 -39.34 87.12 Favored 'General case' 0 C--N 1.331 -0.199 0 O-C-N 121.743 -0.598 . . . . 0.0 109.964 -176.609 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 71.2 m80 -75.43 -17.47 60.16 Favored 'General case' 0 N--CA 1.45 -0.437 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.526 177.378 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 62' ' ' LYS . . . . . 0.4 ' HE2' ' HB2' ' A' ' 62' ' ' LYS . 10.9 tppt? -66.95 -45.08 78.88 Favored 'General case' 0 N--CA 1.457 -0.086 0 N-CA-C 109.065 -0.716 . . . . 0.0 109.065 174.081 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -63.91 -42.76 97.32 Favored 'General case' 0 N--CA 1.454 -0.267 0 N-CA-C 108.32 -0.993 . . . . 0.0 108.32 177.789 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -66.15 -33.84 86.47 Favored Glycine 0 CA--C 1.53 0.98 0 N-CA-C 111.95 -0.46 . . . . 0.0 111.95 178.331 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 63.2 m -64.74 -42.16 95.39 Favored 'General case' 0 N--CA 1.456 -0.141 0 CA-C-N 117.927 0.864 . . . . 0.0 110.342 177.601 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 80.0 mt -68.71 -27.23 65.76 Favored 'General case' 0 N--CA 1.455 -0.224 0 N-CA-C 110.277 -0.268 . . . . 0.0 110.277 179.421 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 1.0 OUTLIER -68.42 -38.73 81.48 Favored 'General case' 0 N--CA 1.455 -0.203 0 CA-C-N 117.736 0.244 . . . . 0.0 111.413 175.739 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 68' ' ' ILE . . . . . 0.435 HD11 ' CD1' ' A' ' 17' ' ' PHE . 14.7 mt -66.42 -53.64 34.09 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.445 0 N-CA-C 109.178 -0.675 . . . . 0.0 109.178 176.679 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 69' ' ' ILE . . . . . 0.426 HG12 HD12 ' A' ' 50' ' ' ILE . 81.3 mt -50.27 -37.11 13.79 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.19 0 C-N-CA 124.233 1.013 . . . . 0.0 111.678 174.413 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 12.8 t70 -69.05 -46.2 68.47 Favored 'General case' 0 N--CA 1.455 -0.195 0 CA-C-N 118.292 0.496 . . . . 0.0 111.109 179.915 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 30.7 t -64.06 -55.51 21.64 Favored 'General case' 0 N--CA 1.45 -0.464 0 CA-C-N 116.58 -0.282 . . . . 0.0 110.646 -175.968 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -74.36 -32.9 32.25 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.246 0 N-CA-C 110.192 -0.299 . . . . 0.0 110.192 -177.18 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -66.7 -55.26 18.14 Favored Glycine 0 C--N 1.34 0.777 0 N-CA-C 111.589 -0.604 . . . . 0.0 111.589 -174.555 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 33.9 mtm105 -68.7 -37.52 79.58 Favored 'General case' 0 N--CA 1.455 -0.182 0 C-N-CA 120.099 -0.64 . . . . 0.0 110.088 179.158 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -64.7 -29.95 70.96 Favored 'General case' 0 N--CA 1.452 -0.368 0 C-N-CA 120.1 -0.64 . . . . 0.0 110.624 -179.624 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 1.3 m-30 -69.73 -46.0 66.89 Favored 'General case' 0 N--CA 1.454 -0.274 0 CA-C-N 118.401 0.546 . . . . 0.0 110.494 175.832 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -65.01 -49.09 71.57 Favored 'General case' 0 N--CA 1.449 -0.475 0 C-N-CA 118.788 -1.165 . . . . 0.0 108.047 -179.634 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 89.2 m-20 -55.92 -44.34 78.21 Favored 'General case' 0 CA--C 1.53 0.176 0 N-CA-C 112.725 0.639 . . . . 0.0 112.725 -179.689 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 8.3 tm-20 -63.42 -51.85 64.02 Favored 'General case' 0 N--CA 1.45 -0.438 0 CA-C-N 118.548 0.613 . . . . 0.0 111.32 -178.808 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 80' ' ' THR . . . . . 0.557 HG21 ' HB3' ' A' ' 94' ' ' CYS . 59.2 p -65.47 -26.24 67.84 Favored 'General case' 0 N--CA 1.454 -0.237 0 CA-C-N 117.83 0.286 . . . . 0.0 110.567 -179.957 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 35.5 ttp180 -75.62 -20.07 58.79 Favored 'General case' 0 N--CA 1.448 -0.542 0 C-N-CA 123.937 0.895 . . . . 0.0 111.051 174.349 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 27.5 m . . . . . 0 CA--C 1.53 0.198 0 C-N-CA 122.924 0.49 . . . . 0.0 111.82 179.476 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 67.2 Cg_endo . . . . . 0 N--CA 1.453 -0.899 0 N-CA-C 109.193 -1.118 . . . . 0.0 109.193 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 85.55 16.25 64.43 Favored Glycine 0 CA--C 1.525 0.674 0 N-CA-C 110.788 -0.925 . . . . 0.0 110.788 -176.272 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -155.8 167.15 31.33 Favored 'General case' 0 N--CA 1.454 -0.255 0 C-N-CA 123.7 0.8 . . . . 0.0 109.333 -179.218 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 94' ' ' CYS . . . . . 0.557 ' HB3' HG21 ' A' ' 80' ' ' THR . 30.1 p -58.15 -20.01 37.32 Favored 'General case' 0 N--CA 1.453 -0.307 0 C-N-CA 122.703 0.401 . . . . 0.0 110.807 179.087 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -58.53 -60.47 3.74 Favored 'General case' 0 N--CA 1.447 -0.577 0 C-N-CA 122.34 0.256 . . . . 0.0 110.702 -176.514 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 75.3 t60 -74.01 -32.65 63.48 Favored 'General case' 0 N--CA 1.451 -0.407 0 C-N-CA 121.003 -0.279 . . . . 0.0 110.496 -179.86 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -64.46 -53.44 48.15 Favored 'General case' 0 N--CA 1.451 -0.402 0 C-N-CA 122.407 0.283 . . . . 0.0 111.124 -176.26 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 1.7 mp -72.42 -33.12 44.6 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.291 0 N-CA-C 110.056 -0.35 . . . . 0.0 110.056 -178.737 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 15.3 m-20 -66.42 -41.25 89.49 Favored 'General case' 0 C--O 1.225 -0.199 0 CA-C-N 118.27 0.486 . . . . 0.0 111.1 177.976 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 96.7 m -73.5 -32.59 64.35 Favored 'General case' 0 N--CA 1.457 -0.122 0 CA-C-N 118.242 0.474 . . . . 0.0 110.894 -177.675 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 60.5 tp -73.2 -39.6 65.44 Favored 'General case' 0 N--CA 1.45 -0.463 0 N-CA-C 111.528 0.196 . . . . 0.0 111.528 -177.268 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -69.31 -16.9 71.74 Favored Glycine 0 CA--C 1.529 0.944 0 CA-C-O 119.713 -0.493 . . . . 0.0 114.031 -173.828 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 6.2 mm-40 -87.76 -32.08 19.31 Favored 'General case' 0 CA--C 1.52 -0.173 0 CA-C-N 118.322 1.061 . . . . 0.0 111.538 178.92 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 81.7 t -93.69 -20.68 6.23 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.09 0 C-N-CA 122.759 0.424 . . . . 0.0 112.119 -177.499 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 105' ' ' ILE . . . . . 0.403 HD12 ' HA ' ' A' ' 105' ' ' ILE . 10.7 tp -60.54 -22.5 25.9 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.224 0 O-C-N 121.571 -0.706 . . . . 0.0 112.099 -175.167 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 26.4 pt20 -67.77 -25.67 65.73 Favored 'General case' 0 CA--C 1.53 0.201 0 O-C-N 121.982 -0.448 . . . . 0.0 110.511 177.236 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 72.2 mt-10 -74.3 -43.04 58.43 Favored 'General case' 0 N--CA 1.454 -0.254 0 N-CA-C 109.474 -0.565 . . . . 0.0 109.474 176.816 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 108' ' ' LEU . . . . . 0.404 HD21 ' HA ' ' A' ' 51' ' ' ILE . 10.4 mp -67.4 -45.11 77.14 Favored 'General case' 0 N--CA 1.452 -0.364 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.239 -177.847 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 3.0 mp -65.94 -53.33 40.59 Favored 'General case' 0 N--CA 1.451 -0.379 0 CA-C-O 119.146 -0.454 . . . . 0.0 110.584 -178.219 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 15.4 m -54.39 -47.22 72.94 Favored 'General case' 0 C--O 1.233 0.198 0 CA-C-N 118.139 0.427 . . . . 0.0 110.501 -178.262 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 40.5 t0 -62.21 -43.37 98.98 Favored 'General case' 0 N--CA 1.452 -0.365 0 N-CA-C 109.309 -0.626 . . . . 0.0 109.309 178.117 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 112' ' ' ALA . . . . . 0.4 ' HA ' ' HG2' ' A' ' 62' ' ' LYS . . . -67.87 -36.89 81.05 Favored 'General case' 0 N--CA 1.447 -0.619 0 CA-C-O 119.135 -0.46 . . . . 0.0 111.438 -175.148 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 113' ' ' ILE . . . . . 0.456 ' O ' ' HE2' ' A' ' 121' ' ' LYS . 19.9 mm -68.79 -40.85 81.94 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.426 0 C-N-CA 118.805 -1.158 . . . . 0.0 110.1 -179.434 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -75.56 -39.09 58.7 Favored 'General case' 0 N--CA 1.454 -0.237 0 N-CA-C 112.837 0.68 . . . . 0.0 112.837 179.836 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 115' ' ' LYS . . . . . 0.61 ' HE2' ' HA ' ' A' ' 115' ' ' LYS . 0.6 OUTLIER -78.85 -38.41 38.0 Favored 'General case' 0 N--CA 1.456 -0.165 0 N-CA-C 113.342 0.867 . . . . 0.0 113.342 -177.711 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 116' ' ' SER . . . . . 0.453 ' HB2' ' CB ' ' A' ' 120' ' ' HIS . 52.6 p -74.56 157.23 35.82 Favored 'General case' 0 CA--C 1.529 0.146 0 CA-C-N 117.918 0.326 . . . . 0.0 111.744 -172.628 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 56.5 t30 -79.57 166.21 22.15 Favored 'General case' 0 CA--C 1.531 0.23 0 C-N-CA 122.877 0.471 . . . . 0.0 110.61 -178.997 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 118' ' ' GLN . . . . . . . . . . . . . 3.4 pt20 -49.1 -46.27 44.51 Favored 'General case' 0 CA--C 1.532 0.25 0 N-CA-C 112.823 0.675 . . . . 0.0 112.823 -174.34 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 6.8 p30 -65.42 -35.85 82.18 Favored 'General case' 0 N--CA 1.456 -0.149 0 C-N-CA 123.059 0.544 . . . . 0.0 111.358 179.122 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 120' ' ' HIS . . . . . 0.453 ' CB ' ' HB2' ' A' ' 116' ' ' SER . 32.3 m170 -68.12 -43.91 77.3 Favored 'General case' 0 N--CA 1.448 -0.544 0 N-CA-C 110.145 -0.317 . . . . 0.0 110.145 176.666 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 121' ' ' LYS . . . . . 0.456 ' HE2' ' O ' ' A' ' 113' ' ' ILE . 76.0 mttt -57.0 -38.99 73.85 Favored 'General case' 0 C--N 1.342 0.254 0 N-CA-C 109.514 -0.55 . . . . 0.0 109.514 179.896 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 2.8 tm-20 -65.43 -47.61 75.61 Favored 'General case' 0 N--CA 1.456 -0.172 0 C-N-CA 122.402 0.281 . . . . 0.0 110.614 178.905 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 62.4 mttp -65.95 -28.92 69.27 Favored 'General case' 0 N--CA 1.454 -0.233 0 CA-C-O 119.836 -0.126 . . . . 0.0 111.075 -179.558 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 124' ' ' ILE . . . . . . . . . . . . . 59.2 mt -70.73 -42.97 77.7 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.297 0 N-CA-C 109.436 -0.579 . . . . 0.0 109.436 176.071 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 125' ' ' ARG . . . . . 0.468 HH11 ' HA ' ' A' ' 125' ' ' ARG . 7.3 mmm180 -59.27 -46.39 88.67 Favored 'General case' 0 N--CA 1.451 -0.383 0 CA-C-O 118.982 -0.532 . . . . 0.0 111.236 -179.503 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 126' ' ' MET . . . . . . . . . . . . . 27.6 ptm -65.47 -33.47 76.0 Favored 'General case' 0 N--CA 1.451 -0.401 0 C-N-CA 119.278 -0.969 . . . . 0.0 109.66 178.814 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 18.7 tp -69.61 -31.72 70.01 Favored 'General case' 0 CA--C 1.533 0.307 0 CA-C-N 118.025 0.375 . . . . 0.0 111.617 179.654 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 92.9 mt -75.76 -38.06 58.73 Favored 'General case' 0 N--CA 1.456 -0.167 0 O-C-N 121.909 -0.494 . . . . 0.0 110.531 177.378 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 54.7 m-20 -60.29 -38.23 82.97 Favored 'General case' 0 N--CA 1.454 -0.226 0 N-CA-C 109.117 -0.698 . . . . 0.0 109.117 176.031 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 36.5 mt -63.15 -40.7 90.02 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.359 0 C-N-CA 124.32 1.048 . . . . 0.0 110.816 176.08 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 131' ' ' TRP . . . . . . . . . . . . . 48.7 m0 . . . . . 0 N--CA 1.452 -0.349 0 C-N-CA 120.009 -0.677 . . . . 0.0 111.178 176.949 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 29.7 p-10 . . . . . 0 N--CA 1.451 -0.389 0 N-CA-C 107.786 -1.19 . . . . 0.0 107.786 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 7' ' ' PHE . . . . . 0.511 ' CD1' ' HD3' ' A' ' 45' ' ' LYS . 1.3 t80 -59.14 -33.99 71.54 Favored 'General case' 0 N--CA 1.446 -0.67 0 C-N-CA 125.416 1.487 . . . . 0.0 109.981 -179.978 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 51.2 tp60 -49.76 -37.24 28.84 Favored 'General case' 0 N--CA 1.451 -0.395 0 C-N-CA 124.347 1.059 . . . . 0.0 111.609 -179.006 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 25.5 m-80 -73.94 -33.27 63.86 Favored 'General case' 0 N--CA 1.452 -0.356 0 O-C-N 122.202 -0.311 . . . . 0.0 110.397 -179.478 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 10' ' ' PHE . . . . . 0.417 ' CE2' ' HB2' ' A' ' 32' ' ' LEU . 6.5 t80 -71.23 -40.36 71.12 Favored 'General case' 0 N--CA 1.449 -0.515 0 C-N-CA 123.311 0.645 . . . . 0.0 109.499 177.511 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 89.1 t -63.6 -53.46 44.71 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.417 0 N-CA-C 108.407 -0.96 . . . . 0.0 108.407 179.071 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -59.54 -29.34 67.83 Favored 'General case' 0 N--CA 1.455 -0.221 0 C-N-CA 122.748 0.419 . . . . 0.0 111.774 -179.659 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 92.3 m -71.73 -37.12 70.64 Favored 'General case' 0 CA--C 1.531 0.216 0 N-CA-C 108.901 -0.777 . . . . 0.0 108.901 176.206 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.466 HD21 ' HB2' ' A' ' 53' ' ' TYR . 5.6 tp -69.03 -41.05 78.22 Favored 'General case' 0 N--CA 1.452 -0.352 0 CA-C-O 120.981 0.42 . . . . 0.0 110.379 178.751 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 64.1 mm-40 -64.88 -30.98 72.0 Favored 'General case' 0 N--CA 1.45 -0.447 0 N-CA-C 108.378 -0.971 . . . . 0.0 108.378 176.668 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 23.1 t -73.48 -20.45 60.68 Favored 'General case' 0 N--CA 1.453 -0.288 0 CA-C-N 115.844 -0.616 . . . . 0.0 109.894 178.375 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 17' ' ' PHE . . . . . 0.453 ' CD1' ' HA ' ' A' ' 14' ' ' LEU . 22.9 m-85 -75.43 -35.66 60.92 Favored 'General case' 0 N--CA 1.455 -0.188 0 C-N-CA 120.181 -0.607 . . . . 0.0 110.512 168.62 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 68.2 mttt -62.0 -28.79 69.82 Favored 'General case' 0 C--N 1.339 0.127 0 CA-C-N 118.37 0.532 . . . . 0.0 109.776 179.066 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 19.7 t0 -64.31 -20.89 66.38 Favored 'General case' 0 CA--C 1.533 0.323 0 CA-C-N 115.706 -0.679 . . . . 0.0 111.885 176.86 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 43.3 mt -70.79 155.17 41.12 Favored 'General case' 0 N--CA 1.457 -0.082 0 O-C-N 121.476 -0.765 . . . . 0.0 111.885 -175.192 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 1.4 mppt? -100.99 -3.72 28.88 Favored 'General case' 0 CA--C 1.528 0.116 0 N-CA-C 109.06 -0.719 . . . . 0.0 109.06 173.168 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 82.9 p -121.83 -20.4 6.42 Favored 'General case' 0 CA--C 1.528 0.096 0 C-N-CA 124.507 1.123 . . . . 0.0 111.091 -178.924 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 82.7 -16.8 24.04 Favored Glycine 0 CA--C 1.53 0.995 0 C-N-CA 124.153 0.882 . . . . 0.0 113.499 176.213 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 81.5 mt -101.43 148.5 7.24 Favored 'Isoleucine or valine' 0 CA--C 1.528 0.113 0 CA-C-N 118.452 1.126 . . . . 0.0 110.73 -179.671 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 41.9 t -162.54 85.59 0.56 Allowed 'General case' 0 CA--C 1.519 -0.23 0 N-CA-C 110.04 -0.356 . . . . 0.0 110.04 178.82 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 26' ' ' GLY . . . . . 0.428 ' O ' ' HE2' ' A' ' 30' ' ' LYS . . . -51.15 -39.72 42.68 Favored Glycine 0 CA--C 1.523 0.551 0 CA-C-O 119.168 -0.795 . . . . 0.0 112.236 -175.635 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 91.4 p -66.0 -48.03 72.54 Favored 'General case' 0 N--CA 1.454 -0.243 0 CA-C-N 118.999 1.399 . . . . 0.0 110.952 -176.807 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 54.5 mtm180 -73.15 -34.57 66.14 Favored 'General case' 0 CA--C 1.527 0.09 0 CA-C-N 118.014 0.37 . . . . 0.0 110.57 -179.351 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 65.1 mt -59.05 -48.45 86.67 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.487 0 N-CA-C 109.057 -0.72 . . . . 0.0 109.057 173.584 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 30' ' ' LYS . . . . . 0.428 ' HE2' ' O ' ' A' ' 26' ' ' GLY . 49.2 mtmt -68.75 -23.18 64.3 Favored 'General case' 0 N--CA 1.456 -0.173 0 CA-C-O 119.012 -0.518 . . . . 0.0 111.505 -179.564 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 31' ' ' LYS . . . . . 0.445 ' HE2' ' HA ' ' A' ' 31' ' ' LYS . 4.1 mmpt? -66.35 -57.14 8.1 Favored 'General case' 0 C--N 1.341 0.213 0 CA-C-N 118.693 0.679 . . . . 0.0 110.443 176.255 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.489 HD12 ' N ' ' A' ' 33' ' ' THR . 2.3 pp -75.43 -18.85 59.79 Favored 'General case' 0 CA--C 1.531 0.247 0 C-N-CA 119.615 -0.834 . . . . 0.0 111.505 -178.105 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 33' ' ' THR . . . . . 0.489 ' N ' HD12 ' A' ' 32' ' ' LEU . 60.1 m -72.88 -38.42 66.99 Favored 'General case' 0 N--CA 1.455 -0.222 0 N-CA-C 109.077 -0.712 . . . . 0.0 109.077 175.678 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 57.9 m -69.08 -35.59 76.67 Favored 'General case' 0 N--CA 1.453 -0.312 0 N-CA-C 110.001 -0.37 . . . . 0.0 110.001 179.918 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 9.1 t80 -62.17 -39.51 92.91 Favored 'General case' 0 C--O 1.231 0.122 0 N-CA-C 109.626 -0.509 . . . . 0.0 109.626 174.446 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -71.61 -36.79 70.92 Favored 'General case' 0 N--CA 1.448 -0.526 0 CA-C-O 119.564 -0.255 . . . . 0.0 111.685 -179.644 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -70.0 -34.07 72.85 Favored 'General case' 0 N--CA 1.456 -0.168 0 CA-C-N 117.915 0.325 . . . . 0.0 111.045 -179.825 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 43.9 t0 -68.91 -23.93 64.24 Favored 'General case' 0 CA--C 1.533 0.325 0 C-N-CA 122.132 0.173 . . . . 0.0 110.633 176.934 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 39' ' ' HIS . . . . . 0.41 ' HB2' HD11 ' A' ' 42' ' ' ILE . 97.8 m-70 -151.93 104.6 3.01 Favored 'General case' 0 N--CA 1.456 -0.167 0 N-CA-C 112.199 0.444 . . . . 0.0 112.199 -174.517 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 40' ' ' ILE . . . . . 0.581 ' H ' HD13 ' A' ' 40' ' ' ILE . 0.0 OUTLIER -79.0 -12.03 13.25 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.302 0 C-N-CA 122.736 0.414 . . . . 0.0 110.149 174.165 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 16.0 m-20 -59.44 -11.73 4.95 Favored 'General case' 0 CA--C 1.53 0.176 0 C-N-CA 123.418 0.687 . . . . 0.0 112.787 -176.794 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 42' ' ' ILE . . . . . 0.41 HD11 ' HB2' ' A' ' 39' ' ' HIS . 0.0 OUTLIER -119.46 18.06 6.58 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.198 0 C-N-CA 124.068 0.947 . . . . 0.0 111.667 177.799 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 3.0 pp20? -53.88 -28.91 39.19 Favored 'General case' 0 CA--C 1.53 0.193 0 O-C-N 121.379 -0.825 . . . . 0.0 111.296 178.092 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 47.1 t -65.21 -44.24 88.94 Favored 'General case' 0 CA--C 1.533 0.289 0 N-CA-C 111.899 0.333 . . . . 0.0 111.899 -177.878 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 45' ' ' LYS . . . . . 0.511 ' HD3' ' CD1' ' A' ' 7' ' ' PHE . 15.0 ptpt -74.87 -25.67 59.13 Favored 'General case' 0 CA--C 1.53 0.185 0 CA-C-N 118.385 0.539 . . . . 0.0 109.816 179.012 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 67.2 mt -72.72 -51.68 26.61 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.251 0 C-N-CA 123.076 0.55 . . . . 0.0 110.314 -177.476 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 38.8 mm -67.11 -39.95 84.27 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.112 0 N-CA-C 110.119 -0.326 . . . . 0.0 110.119 -179.768 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 48.0 t -66.72 -33.59 75.98 Favored 'General case' 0 N--CA 1.453 -0.313 0 C-N-CA 120.745 -0.382 . . . . 0.0 111.201 -178.841 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 49' ' ' LEU . . . . . 0.41 ' HG ' HD22 ' A' ' 14' ' ' LEU . 44.4 tp -78.68 -37.55 41.5 Favored 'General case' 0 N--CA 1.451 -0.397 0 N-CA-C 112.749 0.648 . . . . 0.0 112.749 -177.474 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 50' ' ' ILE . . . . . 0.487 HD12 HG12 ' A' ' 69' ' ' ILE . 3.6 pt -67.4 -44.01 87.3 Favored 'Isoleucine or valine' 0 C--N 1.34 0.162 0 CA-C-N 118.924 0.784 . . . . 0.0 110.172 178.933 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 16.9 pt -65.48 -38.05 81.53 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.203 0 C-N-CA 119.858 -0.737 . . . . 0.0 111.477 178.758 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 47.6 t0 -60.86 -53.63 54.95 Favored 'General case' 0 CA--C 1.528 0.104 0 CA-C-N 118.484 0.584 . . . . 0.0 110.21 177.469 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 53' ' ' TYR . . . . . 0.466 ' HB2' HD21 ' A' ' 14' ' ' LEU . 3.5 t80 -61.16 -32.49 72.22 Favored 'General case' 0 C--O 1.225 -0.21 0 CA-C-O 118.813 -0.613 . . . . 0.0 109.839 179.173 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 17.2 p -63.46 -35.99 82.26 Favored 'General case' 0 N--CA 1.456 -0.16 0 CA-C-N 118.693 0.679 . . . . 0.0 110.859 -179.89 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 1.9 tpp180 -79.49 -39.69 31.52 Favored 'General case' 0 N--CA 1.455 -0.195 0 C-N-CA 122.146 0.178 . . . . 0.0 111.181 -177.57 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 79.6 mt -77.75 -45.28 25.11 Favored 'General case' 0 N--CA 1.455 -0.215 0 C-N-CA 123.764 0.825 . . . . 0.0 113.196 -176.468 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 13.6 p -64.38 159.64 57.3 Favored Pre-proline 0 CA--C 1.533 0.3 0 N-CA-C 113.882 1.067 . . . . 0.0 113.882 -171.628 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 33.4 Cg_exo -58.03 175.65 0.45 Allowed 'Trans proline' 0 N--CA 1.454 -0.796 0 C-N-CA 125.012 3.808 . . . . 0.0 112.827 173.884 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 35.8 p-10 -63.6 -42.19 98.28 Favored 'General case' 0 CA--C 1.53 0.189 0 C-N-CA 123.916 0.886 . . . . 0.0 112.171 -174.945 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 20.0 m -72.57 -35.48 67.97 Favored 'General case' 0 N--CA 1.452 -0.362 0 C-N-CA 122.702 0.401 . . . . 0.0 110.015 -178.203 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 51.3 m80 -75.17 -23.72 57.78 Favored 'General case' 0 N--CA 1.452 -0.337 0 C-N-CA 122.814 0.446 . . . . 0.0 110.252 177.817 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 22.3 ttmm -71.94 -35.41 69.61 Favored 'General case' 0 N--CA 1.455 -0.184 0 N-CA-C 109.327 -0.619 . . . . 0.0 109.327 174.527 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -62.76 -44.29 96.58 Favored 'General case' 0 CA--C 1.532 0.269 0 N-CA-C 107.155 -1.424 . . . . 0.0 107.155 172.078 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -65.59 -29.69 75.73 Favored Glycine 0 CA--C 1.526 0.736 0 N-CA-C 111.474 -0.65 . . . . 0.0 111.474 179.99 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 35.3 t -65.56 -41.52 92.86 Favored 'General case' 0 N--CA 1.452 -0.351 0 CA-C-N 117.469 0.635 . . . . 0.0 109.449 176.814 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 81.4 mt -67.74 -27.44 66.79 Favored 'General case' 0 N--CA 1.453 -0.276 0 N-CA-C 110.473 -0.195 . . . . 0.0 110.473 178.157 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 67' ' ' TYR . . . . . 0.414 ' CD2' HD11 ' A' ' 127' ' ' LEU . 2.4 m-85 -70.09 -37.99 75.58 Favored 'General case' 0 C--N 1.34 0.153 0 CA-C-N 117.983 0.356 . . . . 0.0 110.731 174.873 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 68' ' ' ILE . . . . . 0.446 HD11 ' CE1' ' A' ' 17' ' ' PHE . 13.9 mt -69.95 -54.2 20.19 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.451 0 N-CA-C 109.259 -0.645 . . . . 0.0 109.259 178.297 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 69' ' ' ILE . . . . . 0.487 HG12 HD12 ' A' ' 50' ' ' ILE . 68.5 mt -48.11 -37.39 6.9 Favored 'Isoleucine or valine' 0 C--N 1.34 0.154 0 C-N-CA 124.141 0.976 . . . . 0.0 111.478 173.834 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 23.9 t70 -69.18 -43.89 73.31 Favored 'General case' 0 CA--C 1.52 -0.196 0 CA-C-N 118.912 0.778 . . . . 0.0 110.909 179.386 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 25.3 m -66.96 -56.01 12.05 Favored 'General case' 0 N--CA 1.449 -0.523 0 O-C-N 123.416 0.448 . . . . 0.0 110.024 -174.506 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -74.68 -32.97 30.26 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.386 0 N-CA-C 109.948 -0.39 . . . . 0.0 109.948 -176.944 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -65.57 -58.46 9.26 Favored Glycine 0 C--N 1.339 0.71 0 N-CA-C 111.388 -0.685 . . . . 0.0 111.388 -175.412 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 46.4 mtm105 -69.26 -36.41 77.1 Favored 'General case' 0 N--CA 1.456 -0.166 0 CA-C-N 117.455 0.628 . . . . 0.0 110.542 -178.972 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -64.23 -29.38 70.48 Favored 'General case' 0 N--CA 1.45 -0.433 0 C-N-CA 119.645 -0.822 . . . . 0.0 110.707 179.658 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 1.6 m-30 -71.27 -45.98 61.94 Favored 'General case' 0 C--N 1.342 0.244 0 CA-C-N 118.594 0.634 . . . . 0.0 110.637 175.399 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -64.58 -45.11 88.39 Favored 'General case' 0 N--CA 1.45 -0.452 0 N-CA-C 108.027 -1.101 . . . . 0.0 108.027 -178.123 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 92.2 m-20 -55.92 -46.85 78.34 Favored 'General case' 0 C--O 1.231 0.082 0 N-CA-C 113.463 0.912 . . . . 0.0 113.463 173.927 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 12.4 tm-20 -64.13 -47.44 79.92 Favored 'General case' 0 N--CA 1.449 -0.48 0 CA-C-N 118.604 0.638 . . . . 0.0 111.054 -178.341 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 80' ' ' THR . . . . . 0.563 HG21 ' HB3' ' A' ' 94' ' ' CYS . 75.7 p -69.34 -27.23 65.17 Favored 'General case' 0 N--CA 1.453 -0.304 0 CA-C-O 119.692 -0.194 . . . . 0.0 110.685 -179.409 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 36.4 ttp-105 -70.34 -27.69 64.56 Favored 'General case' 0 N--CA 1.451 -0.395 0 CA-C-N 118.096 0.407 . . . . 0.0 110.189 172.618 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 32.2 m . . . . . 0 N--CA 1.453 -0.276 0 N-CA-C 113.025 0.75 . . . . 0.0 113.025 -176.417 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 56.3 Cg_endo . . . . . 0 N--CA 1.45 -1.047 0 N-CA-C 108.467 -1.397 . . . . 0.0 108.467 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 90.23 17.06 54.49 Favored Glycine 0 CA--C 1.524 0.628 0 CA-C-O 119.417 -0.657 . . . . 0.0 112.277 -177.289 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 38.5 p -151.61 172.5 15.95 Favored 'General case' 0 C--N 1.341 0.201 0 CA-C-N 117.946 0.873 . . . . 0.0 110.203 176.739 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 94' ' ' CYS . . . . . 0.563 ' HB3' HG21 ' A' ' 80' ' ' THR . 26.2 p -59.98 -20.99 60.61 Favored 'General case' 0 N--CA 1.449 -0.493 0 CA-C-N 115.621 -0.718 . . . . 0.0 109.936 175.682 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -60.29 -55.26 35.84 Favored 'General case' 0 N--CA 1.448 -0.53 0 N-CA-C 109.398 -0.593 . . . . 0.0 109.398 -177.261 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 69.3 t60 -75.46 -34.74 60.95 Favored 'General case' 0 N--CA 1.448 -0.546 0 CA-C-N 116.736 -0.211 . . . . 0.0 110.906 179.68 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -66.18 -49.41 67.45 Favored 'General case' 0 N--CA 1.451 -0.413 0 O-C-N 123.09 0.244 . . . . 0.0 111.126 -176.17 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 98' ' ' ILE . . . . . 0.434 HD13 ' HB2' ' A' ' 94' ' ' CYS . 1.7 mp -72.79 -34.62 47.4 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.251 0 CA-C-O 119.234 -0.413 . . . . 0.0 109.986 179.699 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 16.4 m-20 -66.14 -40.23 90.47 Favored 'General case' 0 N--CA 1.453 -0.289 0 CA-C-N 118.612 0.642 . . . . 0.0 111.293 178.715 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 92.6 m -75.19 -34.85 61.56 Favored 'General case' 0 N--CA 1.454 -0.256 0 CA-C-N 118.008 0.367 . . . . 0.0 110.838 -178.471 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 58.8 tp -75.65 -38.77 58.58 Favored 'General case' 0 N--CA 1.451 -0.417 0 C-N-CA 122.886 0.474 . . . . 0.0 111.013 -178.589 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -67.18 -23.58 73.15 Favored Glycine 0 CA--C 1.528 0.856 0 CA-C-O 119.542 -0.588 . . . . 0.0 113.441 -173.479 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 16.3 mm-40 -74.63 -35.77 62.91 Favored 'General case' 0 CA--C 1.52 -0.188 0 CA-C-N 118.158 0.979 . . . . 0.0 111.179 179.41 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 25.9 m -101.77 -13.43 8.41 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.138 0 N-CA-C 113.379 0.881 . . . . 0.0 113.379 -176.114 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 105' ' ' ILE . . . . . . . . . . . . . 11.0 tp -61.84 -27.24 41.89 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.161 0 CA-C-N 119.18 0.9 . . . . 0.0 111.564 -175.282 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 19.8 pt20 -67.0 -29.86 69.8 Favored 'General case' 0 N--CA 1.453 -0.277 0 N-CA-C 109.994 -0.373 . . . . 0.0 109.994 176.704 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 86.1 mt-10 -75.75 -41.31 53.63 Favored 'General case' 0 N--CA 1.454 -0.265 0 N-CA-C 109.918 -0.401 . . . . 0.0 109.918 175.806 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 9.9 mp -64.66 -41.97 95.72 Favored 'General case' 0 C--N 1.34 0.164 0 N-CA-C 110.361 -0.237 . . . . 0.0 110.361 -178.472 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 72.3 mt -66.85 -50.78 61.44 Favored 'General case' 0 N--CA 1.453 -0.284 0 N-CA-C 109.833 -0.432 . . . . 0.0 109.833 178.952 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 16.8 m -59.51 -45.79 90.71 Favored 'General case' 0 C--O 1.232 0.155 0 CA-C-N 117.724 0.238 . . . . 0.0 111.022 -178.744 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 44.7 t0 -62.83 -38.44 90.77 Favored 'General case' 0 N--CA 1.454 -0.234 0 N-CA-C 108.932 -0.766 . . . . 0.0 108.932 179.258 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -68.03 -31.65 71.47 Favored 'General case' 0 N--CA 1.446 -0.645 0 CA-C-O 119.352 -0.356 . . . . 0.0 111.611 -176.531 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 113' ' ' ILE . . . . . . . . . . . . . 31.2 mm -70.38 -44.1 77.68 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.269 0 C-N-CA 118.856 -1.137 . . . . 0.0 109.362 178.011 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -72.91 -33.92 66.29 Favored 'General case' 0 N--CA 1.452 -0.334 0 N-CA-C 113.033 0.753 . . . . 0.0 113.033 -178.483 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -79.45 -37.01 37.94 Favored 'General case' 0 C--N 1.34 0.174 0 CA-C-N 118.293 0.497 . . . . 0.0 111.805 -179.186 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 116' ' ' SER . . . . . 0.496 ' HB2' ' CB ' ' A' ' 120' ' ' HIS . 21.0 p -85.45 164.6 17.78 Favored 'General case' 0 N--CA 1.449 -0.488 0 CA-C-O 120.93 0.395 . . . . 0.0 112.019 -171.431 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 20.4 m-80 -78.43 -100.19 0.02 OUTLIER 'General case' 0 N--CA 1.455 -0.204 0 N-CA-C 113.557 0.947 . . . . 0.0 113.557 -171.095 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 118' ' ' GLN . . . . . 0.482 ' HA ' ' HE2' ' A' ' 121' ' ' LYS . 14.8 mm100 -136.84 -49.84 0.64 Allowed 'General case' 0 CA--C 1.52 -0.174 0 CA-C-O 120.862 0.363 . . . . 0.0 110.355 -179.005 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 119' ' ' ASP . . . . . 0.407 ' N ' ' OD1' ' A' ' 119' ' ' ASP . 10.3 p-10 -62.9 -39.17 93.72 Favored 'General case' 0 N--CA 1.453 -0.3 0 N-CA-C 108.471 -0.937 . . . . 0.0 108.471 175.206 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 120' ' ' HIS . . . . . 0.496 ' CB ' ' HB2' ' A' ' 116' ' ' SER . 39.9 m170 -66.04 -40.91 91.36 Favored 'General case' 0 N--CA 1.45 -0.457 0 CA-C-N 115.687 -0.688 . . . . 0.0 110.881 176.477 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 121' ' ' LYS . . . . . 0.482 ' HE2' ' HA ' ' A' ' 118' ' ' GLN . 38.2 mtmt -63.67 -34.85 78.77 Favored 'General case' 0 N--CA 1.455 -0.213 0 N-CA-C 109.795 -0.446 . . . . 0.0 109.795 179.443 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 4.8 tm-20 -64.41 -48.66 74.55 Favored 'General case' 0 N--CA 1.456 -0.131 0 CA-C-N 117.705 0.23 . . . . 0.0 110.418 178.239 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 69.7 mmtt -59.8 -30.82 69.16 Favored 'General case' 0 N--CA 1.455 -0.214 0 CA-C-N 116.786 -0.188 . . . . 0.0 111.459 179.222 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 124' ' ' ILE . . . . . . . . . . . . . 51.3 mt -74.75 -34.34 33.7 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.293 0 O-C-N 121.882 -0.511 . . . . 0.0 110.183 178.681 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 24.1 mmt180 -68.46 -35.83 78.12 Favored 'General case' 0 N--CA 1.455 -0.189 0 CA-C-O 119.361 -0.352 . . . . 0.0 111.244 178.394 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 126' ' ' MET . . . . . . . . . . . . . 27.8 ptm -71.91 -33.48 68.32 Favored 'General case' 0 C--N 1.34 0.154 0 C-N-CA 119.333 -0.947 . . . . 0.0 109.514 177.659 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 127' ' ' LEU . . . . . 0.414 HD11 ' CD2' ' A' ' 67' ' ' TYR . 65.2 mt -70.7 -25.7 63.08 Favored 'General case' 0 C--N 1.341 0.2 0 CA-C-N 118.109 0.413 . . . . 0.0 110.167 175.882 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 55.3 tp -68.99 -42.97 75.82 Favored 'General case' 0 N--CA 1.452 -0.327 0 N-CA-C 109.793 -0.447 . . . . 0.0 109.793 177.875 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 12.9 t70 -61.46 -46.2 91.04 Favored 'General case' 0 N--CA 1.456 -0.133 0 N-CA-C 109.576 -0.528 . . . . 0.0 109.576 175.641 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 72.9 mt -59.86 -40.42 82.7 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.392 0 CA-C-N 116.362 -0.381 . . . . 0.0 110.991 -177.42 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 131' ' ' TRP . . . . . . . . . . . . . 46.1 m0 . . . . . 0 N--CA 1.453 -0.306 0 N-CA-C 112.754 0.65 . . . . 0.0 112.754 178.535 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 24.1 p-10 . . . . . 0 N--CA 1.451 -0.385 0 N-CA-C 106.98 -1.489 . . . . 0.0 106.98 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 7' ' ' PHE . . . . . 0.471 ' CD1' ' HD3' ' A' ' 45' ' ' LYS . 1.2 t80 -56.51 -34.37 66.92 Favored 'General case' 0 N--CA 1.449 -0.509 0 C-N-CA 125.144 1.378 . . . . 0.0 109.248 176.49 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 51.7 tp60 -49.77 -37.49 30.04 Favored 'General case' 0 N--CA 1.453 -0.308 0 C-N-CA 124.452 1.101 . . . . 0.0 111.861 -178.606 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 23.9 m-80 -73.02 -34.54 66.43 Favored 'General case' 0 N--CA 1.454 -0.232 0 CA-C-O 120.871 0.367 . . . . 0.0 110.23 -179.487 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 10' ' ' PHE . . . . . 0.458 ' CD2' ' HB2' ' A' ' 32' ' ' LEU . 9.1 t80 -70.05 -39.18 75.87 Favored 'General case' 0 N--CA 1.449 -0.498 0 C-N-CA 123.442 0.697 . . . . 0.0 109.454 176.777 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 98.7 t -64.56 -51.44 67.65 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.299 0 N-CA-C 108.757 -0.831 . . . . 0.0 108.757 178.978 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -59.21 -31.41 69.01 Favored 'General case' 0 N--CA 1.455 -0.175 0 CA-C-N 117.639 0.2 . . . . 0.0 111.529 179.737 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 46.8 m -71.17 -41.51 70.25 Favored 'General case' 0 N--CA 1.457 -0.111 0 N-CA-C 109.075 -0.713 . . . . 0.0 109.075 176.56 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -62.47 -41.61 98.9 Favored 'General case' 0 N--CA 1.451 -0.421 0 N-CA-C 109.482 -0.562 . . . . 0.0 109.482 177.929 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 61.4 mm-40 -66.38 -27.81 68.16 Favored 'General case' 0 N--CA 1.453 -0.314 0 C-N-CA 123.491 0.716 . . . . 0.0 110.137 179.312 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 16.0 p -70.9 -30.65 67.05 Favored 'General case' 0 N--CA 1.455 -0.19 0 N-CA-C 110.08 -0.341 . . . . 0.0 110.08 177.068 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 17' ' ' PHE . . . . . 0.48 ' CD1' HD11 ' A' ' 68' ' ' ILE . 24.4 m-85 -71.45 -32.03 67.86 Favored 'General case' 0 N--CA 1.457 -0.123 0 C-N-CA 120.675 -0.41 . . . . 0.0 110.764 173.672 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 76.4 mttt -67.21 -28.1 67.79 Favored 'General case' 0 C--O 1.232 0.171 0 CA-C-O 121.276 0.56 . . . . 0.0 109.939 172.1 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 41.0 t0 -76.09 -38.97 56.33 Favored 'General case' 0 CA--C 1.531 0.217 0 CA-C-N 115.861 -0.609 . . . . 0.0 110.676 -179.252 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 74.5 mt -74.89 128.74 36.29 Favored 'General case' 0 N--CA 1.454 -0.245 0 N-CA-C 109.187 -0.671 . . . . 0.0 109.187 175.05 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 21' ' ' LYS . . . . . 0.529 ' HA ' ' HE3' ' A' ' 21' ' ' LYS . 0.4 OUTLIER -73.8 -12.48 60.71 Favored 'General case' 0 CA--C 1.53 0.177 0 O-C-N 121.857 -0.527 . . . . 0.0 110.485 176.946 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 80.7 p -88.04 -23.88 23.64 Favored 'General case' 0 N--CA 1.457 -0.105 0 C-N-CA 123.176 0.59 . . . . 0.0 110.388 174.395 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 70.63 -12.31 2.04 Favored Glycine 0 CA--C 1.531 1.051 0 C-N-CA 124.698 1.142 . . . . 0.0 113.582 177.763 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 74.4 mt -106.22 148.91 10.1 Favored 'Isoleucine or valine' 0 C--N 1.334 -0.092 0 CA-C-N 118.073 0.936 . . . . 0.0 110.858 -179.47 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 31.2 t -166.91 100.48 0.55 Allowed 'General case' 0 CA--C 1.519 -0.24 0 N-CA-C 108.755 -0.831 . . . . 0.0 108.755 174.979 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -50.38 -41.44 40.44 Favored Glycine 0 CA--C 1.523 0.586 0 CA-C-O 119.375 -0.681 . . . . 0.0 111.431 -176.85 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 29.5 t -62.89 -52.17 64.13 Favored 'General case' 0 N--CA 1.454 -0.268 0 CA-C-N 118.484 1.142 . . . . 0.0 110.895 -178.084 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 72.3 mtt180 -70.8 -35.65 72.62 Favored 'General case' 0 CA--C 1.522 -0.122 0 C-N-CA 122.82 0.448 . . . . 0.0 110.499 -176.719 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 61.3 mt -58.09 -46.73 88.13 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.575 0 N-CA-C 108.114 -1.069 . . . . 0.0 108.114 174.719 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 63.9 mttt -65.6 -28.12 68.9 Favored 'General case' 0 C--N 1.341 0.211 0 CA-C-O 118.692 -0.671 . . . . 0.0 111.858 178.433 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.3 -57.33 10.74 Favored 'General case' 0 C--N 1.342 0.264 0 CA-C-N 118.935 0.789 . . . . 0.0 109.783 179.694 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.546 HD12 ' N ' ' A' ' 33' ' ' THR . 1.6 pp -75.63 -19.09 59.44 Favored 'General case' 0 N--CA 1.453 -0.279 0 C-N-CA 119.427 -0.909 . . . . 0.0 111.911 -177.356 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 33' ' ' THR . . . . . 0.546 ' N ' HD12 ' A' ' 32' ' ' LEU . 52.2 m -72.46 -36.44 68.5 Favored 'General case' 0 N--CA 1.454 -0.24 0 N-CA-C 108.455 -0.942 . . . . 0.0 108.455 176.925 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 96.0 m -72.5 -36.41 68.38 Favored 'General case' 0 N--CA 1.451 -0.387 0 CA-C-N 116.613 -0.267 . . . . 0.0 110.432 -179.942 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 12.2 t80 -61.21 -40.2 93.08 Favored 'General case' 0 N--CA 1.456 -0.16 0 N-CA-C 109.608 -0.516 . . . . 0.0 109.608 174.779 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -70.1 -34.67 73.41 Favored 'General case' 0 N--CA 1.448 -0.555 0 CA-C-N 116.072 -0.513 . . . . 0.0 111.135 -179.475 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 22.1 mt -71.1 -39.97 71.8 Favored 'General case' 0 N--CA 1.453 -0.313 0 C-N-CA 122.315 0.246 . . . . 0.0 111.22 179.776 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 44.4 t0 -64.69 -24.46 67.58 Favored 'General case' 0 N--CA 1.453 -0.285 0 C-N-CA 122.447 0.299 . . . . 0.0 110.784 176.864 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 39' ' ' HIS . . . . . 0.433 ' HB2' HD11 ' A' ' 42' ' ' ILE . 97.9 m-70 -149.82 102.06 3.11 Favored 'General case' 0 N--CA 1.454 -0.267 0 C-N-CA 122.499 0.319 . . . . 0.0 111.716 -176.082 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 40' ' ' ILE . . . . . 0.546 ' H ' HD13 ' A' ' 40' ' ' ILE . 0.0 OUTLIER -81.0 -15.49 12.58 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.279 0 C-N-CA 123.038 0.535 . . . . 0.0 110.872 177.009 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 2.9 m-20 -58.9 -20.12 48.55 Favored 'General case' 0 N--CA 1.454 -0.263 0 N-CA-C 112.546 0.572 . . . . 0.0 112.546 -177.128 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 42' ' ' ILE . . . . . 0.433 HD11 ' HB2' ' A' ' 39' ' ' HIS . 0.0 OUTLIER -104.35 17.65 5.14 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.258 0 C-N-CA 123.277 0.631 . . . . 0.0 111.792 176.497 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 3.0 pp20? -54.57 -27.99 42.72 Favored 'General case' 0 CA--C 1.529 0.16 0 O-C-N 121.75 -0.594 . . . . 0.0 111.281 178.299 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 32.8 t -63.93 -48.32 77.01 Favored 'General case' 0 N--CA 1.454 -0.234 0 N-CA-C 111.788 0.292 . . . . 0.0 111.788 -178.708 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 45' ' ' LYS . . . . . 0.471 ' HD3' ' CD1' ' A' ' 7' ' ' PHE . 18.2 ptpt -73.77 -23.18 59.68 Favored 'General case' 0 C--N 1.339 0.152 0 CA-C-N 118.541 0.609 . . . . 0.0 110.121 179.765 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 59.2 mt -72.85 -52.51 22.31 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.343 0 C-N-CA 122.698 0.399 . . . . 0.0 110.603 -178.999 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 39.2 mm -66.52 -36.39 77.19 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.245 0 N-CA-C 109.745 -0.465 . . . . 0.0 109.745 179.546 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 31.9 m -68.66 -40.35 80.21 Favored 'General case' 0 N--CA 1.454 -0.225 0 C-N-CA 121.114 -0.234 . . . . 0.0 111.162 -178.797 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 37.2 tp -75.97 -31.65 59.12 Favored 'General case' 0 N--CA 1.45 -0.463 0 N-CA-C 112.743 0.646 . . . . 0.0 112.743 -175.971 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 50' ' ' ILE . . . . . 0.505 HD12 HG12 ' A' ' 69' ' ' ILE . 3.3 pt -71.49 -43.87 71.69 Favored 'Isoleucine or valine' 0 C--N 1.34 0.163 0 CA-C-N 118.923 0.783 . . . . 0.0 110.596 177.165 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 25.1 pt -66.09 -38.14 81.34 Favored 'Isoleucine or valine' 0 C--N 1.339 0.136 0 C-N-CA 119.469 -0.892 . . . . 0.0 110.598 176.941 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 94.9 m-20 -68.87 -31.35 70.23 Favored 'General case' 0 N--CA 1.454 -0.232 0 CA-C-N 118.248 0.476 . . . . 0.0 111.34 177.471 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 7.8 t80 -60.0 -48.76 80.39 Favored 'General case' 0 N--CA 1.451 -0.376 0 N-CA-C 107.684 -1.228 . . . . 0.0 107.684 173.832 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 46.3 t -67.24 -27.76 67.49 Favored 'General case' 0 C--N 1.34 0.174 0 CA-C-N 117.82 0.282 . . . . 0.0 111.73 -179.404 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 55.2 ttp85 -75.16 -29.67 60.53 Favored 'General case' 0 N--CA 1.453 -0.309 0 N-CA-C 112.161 0.43 . . . . 0.0 112.161 -177.222 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 36.3 mt -99.37 -43.07 6.71 Favored 'General case' 0 N--CA 1.457 -0.101 0 N-CA-C 112.378 0.51 . . . . 0.0 112.378 -179.078 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 57' ' ' CYS . . . . . 0.478 ' HB2' ' HD2' ' A' ' 58' ' ' PRO . 9.0 p -67.75 161.36 67.11 Favored Pre-proline 0 CA--C 1.534 0.351 0 N-CA-C 113.226 0.824 . . . . 0.0 113.226 -173.084 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 58' ' ' PRO . . . . . 0.478 ' HD2' ' HB2' ' A' ' 57' ' ' CYS . 66.6 Cg_endo -78.5 178.47 7.53 Favored 'Trans proline' 0 N--CA 1.453 -0.871 0 C-N-CA 124.859 3.706 . . . . 0.0 111.743 178.119 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -44.49 -55.53 5.01 Favored 'General case' 0 CA--C 1.531 0.229 0 C-N-CA 126.016 1.726 . . . . 0.0 114.557 -171.182 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 47.8 m -68.93 -30.18 68.59 Favored 'General case' 0 N--CA 1.455 -0.213 0 O-C-N 122.126 -0.359 . . . . 0.0 110.827 -173.441 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 67.6 m170 -75.69 -28.5 58.68 Favored 'General case' 0 N--CA 1.451 -0.42 0 CA-C-O 119.554 -0.26 . . . . 0.0 110.412 176.795 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 61.3 mttm -65.57 -34.29 77.91 Favored 'General case' 0 C--N 1.34 0.177 0 N-CA-C 108.975 -0.75 . . . . 0.0 108.975 173.205 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 63' ' ' LEU . . . . . 0.515 HD11 ' HE3' ' A' ' 123' ' ' LYS . 0.2 OUTLIER -62.97 -47.54 82.73 Favored 'General case' 0 C--N 1.34 0.173 0 N-CA-C 109.088 -0.708 . . . . 0.0 109.088 175.609 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -66.42 -34.43 87.8 Favored Glycine 0 CA--C 1.524 0.6 0 CA-C-O 119.752 -0.471 . . . . 0.0 111.946 -178.287 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 27.3 t -61.3 -45.13 95.75 Favored 'General case' 0 N--CA 1.453 -0.31 0 CA-C-N 117.582 0.691 . . . . 0.0 109.543 177.452 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 80.8 mt -66.96 -27.17 67.24 Favored 'General case' 0 N--CA 1.455 -0.201 0 O-C-N 123.04 0.213 . . . . 0.0 110.517 179.363 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -71.5 -37.58 71.24 Favored 'General case' 0 C--O 1.234 0.249 0 CA-C-O 120.638 0.256 . . . . 0.0 110.964 178.198 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 68' ' ' ILE . . . . . 0.48 HD11 ' CD1' ' A' ' 17' ' ' PHE . 10.1 mt -71.5 -50.08 42.48 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.403 0 N-CA-C 109.286 -0.635 . . . . 0.0 109.286 174.498 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 69' ' ' ILE . . . . . 0.505 HG12 HD12 ' A' ' 50' ' ' ILE . 52.4 mt -48.8 -41.29 12.64 Favored 'Isoleucine or valine' 0 C--O 1.227 -0.113 0 C-N-CA 123.635 0.774 . . . . 0.0 110.78 174.977 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 10.0 t70 -67.07 -44.89 78.95 Favored 'General case' 0 N--CA 1.455 -0.218 0 CA-C-O 120.698 0.285 . . . . 0.0 110.684 179.044 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 19.6 m -69.21 -49.84 52.8 Favored 'General case' 0 N--CA 1.449 -0.483 0 CA-C-N 116.374 -0.375 . . . . 0.0 111.388 -173.762 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -75.53 -31.06 22.78 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.269 0 N-CA-C 109.678 -0.49 . . . . 0.0 109.678 -179.863 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -66.0 -49.61 57.32 Favored Glycine 0 CA--C 1.526 0.737 0 N-CA-C 111.143 -0.783 . . . . 0.0 111.143 -177.14 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 37.9 mtm105 -66.83 -43.86 82.64 Favored 'General case' 0 N--CA 1.453 -0.309 0 N-CA-C 109.585 -0.524 . . . . 0.0 109.585 177.413 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -61.77 -33.35 73.93 Favored 'General case' 0 N--CA 1.45 -0.443 0 CA-C-O 119.513 -0.28 . . . . 0.0 111.112 -176.902 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 1.5 m-30 -70.93 -46.66 62.08 Favored 'General case' 0 N--CA 1.453 -0.302 0 CA-C-N 118.162 0.437 . . . . 0.0 111.114 177.966 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -68.56 -38.49 80.79 Favored 'General case' 0 N--CA 1.45 -0.434 0 C-N-CA 117.584 -1.647 . . . . 0.0 108.057 -178.807 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 78' ' ' ASP . . . . . 0.428 ' HA ' ' HE ' ' A' ' 81' ' ' ARG . 93.8 m-20 -59.71 -48.31 82.17 Favored 'General case' 0 C--N 1.34 0.159 0 N-CA-C 112.147 0.425 . . . . 0.0 112.147 178.161 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 13.0 tm-20 -65.06 -46.74 79.95 Favored 'General case' 0 N--CA 1.446 -0.649 0 CA-C-N 117.91 0.323 . . . . 0.0 111.043 -177.425 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 80' ' ' THR . . . . . 0.503 HG21 ' HB3' ' A' ' 94' ' ' CYS . 70.5 p -68.65 -33.17 73.54 Favored 'General case' 0 N--CA 1.454 -0.241 0 CA-C-O 119.167 -0.444 . . . . 0.0 111.933 -178.257 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 81' ' ' ARG . . . . . 0.428 ' HE ' ' HA ' ' A' ' 78' ' ' ASP . 21.7 ptt180 -78.93 -23.91 44.38 Favored 'General case' 0 C--N 1.34 0.155 0 CA-C-N 118.771 0.714 . . . . 0.0 111.899 176.88 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 31.2 t . . . . . 0 N--CA 1.454 -0.234 0 C-N-CA 123.061 0.545 . . . . 0.0 112.209 179.191 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 63.7 Cg_endo . . . . . 0 N--CA 1.451 -0.996 0 N-CA-C 107.51 -1.765 . . . . 0.0 107.51 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 114.64 16.82 7.31 Favored Glycine 0 CA--C 1.525 0.696 0 CA-C-O 119.468 -0.629 . . . . 0.0 112.457 -172.978 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 26.9 p -151.59 170.58 19.33 Favored 'General case' 0 N--CA 1.456 -0.17 0 C-N-CA 123.825 0.85 . . . . 0.0 110.34 177.35 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 94' ' ' CYS . . . . . 0.503 ' HB3' HG21 ' A' ' 80' ' ' THR . 23.0 p -58.93 -23.86 61.83 Favored 'General case' 0 N--CA 1.451 -0.407 0 CA-C-N 115.891 -0.595 . . . . 0.0 109.469 175.582 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -60.13 -57.68 11.77 Favored 'General case' 0 N--CA 1.447 -0.606 0 N-CA-C 109.293 -0.632 . . . . 0.0 109.293 -177.178 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 52.4 t60 -75.55 -27.02 58.49 Favored 'General case' 0 N--CA 1.451 -0.419 0 C-N-CA 121.069 -0.252 . . . . 0.0 111.565 -179.893 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -69.51 -48.3 61.0 Favored 'General case' 0 N--CA 1.453 -0.307 0 CA-C-N 117.801 0.273 . . . . 0.0 110.693 -178.652 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 98' ' ' ILE . . . . . 0.43 HD13 ' HB2' ' A' ' 94' ' ' CYS . 2.0 mp -70.57 -30.94 44.62 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.226 0 N-CA-C 109.882 -0.414 . . . . 0.0 109.882 177.815 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 75.4 m-20 -63.63 -49.79 71.91 Favored 'General case' 0 N--CA 1.454 -0.266 0 CA-C-N 118.337 0.517 . . . . 0.0 110.89 175.216 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 49.7 m -70.42 -24.47 62.92 Favored 'General case' 0 N--CA 1.457 -0.11 0 O-C-N 123.131 0.269 . . . . 0.0 111.085 -175.289 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 57.2 tp -83.28 -50.24 8.6 Favored 'General case' 0 N--CA 1.45 -0.467 0 C-N-CA 122.436 0.294 . . . . 0.0 110.696 179.685 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -69.53 -18.02 73.28 Favored Glycine 0 C--N 1.338 0.658 0 CA-C-O 119.507 -0.607 . . . . 0.0 112.786 -174.237 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 26.6 pt-20 -81.8 -7.44 59.6 Favored 'General case' 0 CA--C 1.533 0.29 0 CA-C-N 118.264 1.032 . . . . 0.0 112.373 -178.832 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 17.5 m -140.61 0.02 0.51 Allowed 'Isoleucine or valine' 0 N--CA 1.463 0.213 0 N-CA-C 113.315 0.858 . . . . 0.0 113.315 176.9 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 105' ' ' ILE . . . . . . . . . . . . . 9.3 tp -60.3 -28.22 41.39 Favored 'Isoleucine or valine' 0 CA--C 1.527 0.074 0 CA-C-N 119.197 0.908 . . . . 0.0 111.953 -174.521 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 10.6 pt20 -67.15 -26.89 66.89 Favored 'General case' 0 N--CA 1.453 -0.291 0 CA-C-N 118.002 0.365 . . . . 0.0 110.319 179.261 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 59.8 mm-40 -75.51 -42.02 53.76 Favored 'General case' 0 N--CA 1.456 -0.168 0 N-CA-C 110.117 -0.327 . . . . 0.0 110.117 179.897 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -72.53 -35.26 68.03 Favored 'General case' 0 N--CA 1.454 -0.265 0 N-CA-C 109.637 -0.505 . . . . 0.0 109.637 179.708 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 68.2 mt -67.01 -53.26 32.97 Favored 'General case' 0 N--CA 1.454 -0.273 0 N-CA-C 109.974 -0.38 . . . . 0.0 109.974 176.137 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 35.9 t -53.32 -42.64 66.9 Favored 'General case' 0 C--O 1.232 0.138 0 C-N-CA 122.533 0.333 . . . . 0.0 111.86 -177.247 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 47.4 t0 -66.0 -43.11 88.68 Favored 'General case' 0 N--CA 1.451 -0.378 0 N-CA-C 109.439 -0.578 . . . . 0.0 109.439 177.113 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -67.27 -35.52 79.66 Favored 'General case' 0 N--CA 1.449 -0.504 0 CA-C-O 119.557 -0.258 . . . . 0.0 111.164 -176.387 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 113' ' ' ILE . . . . . . . . . . . . . 22.0 mm -68.55 -37.29 77.49 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.326 0 CA-C-N 118.682 0.673 . . . . 0.0 109.242 178.455 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -73.64 -38.58 64.95 Favored 'General case' 0 N--CA 1.45 -0.443 0 N-CA-C 112.094 0.405 . . . . 0.0 112.094 178.553 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 115' ' ' LYS . . . . . 0.401 ' N ' ' HZ2' ' A' ' 115' ' ' LYS . 0.0 OUTLIER -81.23 -38.68 26.55 Favored 'General case' 0 C--N 1.339 0.115 0 N-CA-C 113.075 0.769 . . . . 0.0 113.075 -175.754 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 116' ' ' SER . . . . . 0.499 ' HB2' ' CB ' ' A' ' 120' ' ' HIS . 52.5 p -81.49 158.41 24.52 Favored 'General case' 0 N--CA 1.454 -0.27 0 N-CA-C 113.314 0.857 . . . . 0.0 113.314 -169.473 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 38.9 t30 -78.92 167.92 20.44 Favored 'General case' 0 CA--C 1.531 0.224 0 C-N-CA 123.241 0.617 . . . . 0.0 110.481 -178.851 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 118' ' ' GLN . . . . . . . . . . . . . 27.8 mt-30 -56.33 -36.08 68.33 Favored 'General case' 0 CA--C 1.529 0.171 0 N-CA-C 113.054 0.761 . . . . 0.0 113.054 -171.608 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 13.3 p-10 -69.35 -37.65 77.75 Favored 'General case' 0 N--CA 1.456 -0.133 0 CA-C-O 121.176 0.512 . . . . 0.0 109.849 178.528 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 120' ' ' HIS . . . . . 0.499 ' CB ' ' HB2' ' A' ' 116' ' ' SER . 32.7 m170 -67.22 -41.14 86.22 Favored 'General case' 0 N--CA 1.45 -0.454 0 CA-C-N 115.843 -0.617 . . . . 0.0 110.112 176.63 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 50.4 mttm -58.46 -40.33 82.36 Favored 'General case' 0 C--N 1.342 0.263 0 N-CA-C 109.001 -0.741 . . . . 0.0 109.001 178.226 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 45.9 tp10 -69.91 -38.21 76.19 Favored 'General case' 0 N--CA 1.453 -0.292 0 C-N-CA 122.166 0.186 . . . . 0.0 111.202 -176.8 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 123' ' ' LYS . . . . . 0.515 ' HE3' HD11 ' A' ' 63' ' ' LEU . 50.3 mtmt -69.0 -28.21 66.39 Favored 'General case' 0 N--CA 1.453 -0.301 0 O-C-N 121.803 -0.561 . . . . 0.0 110.182 177.801 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 124' ' ' ILE . . . . . . . . . . . . . 61.5 mt -73.39 -37.68 51.65 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.297 0 N-CA-C 109.041 -0.725 . . . . 0.0 109.041 174.318 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 125' ' ' ARG . . . . . 0.462 HH11 ' HA ' ' A' ' 125' ' ' ARG . 5.7 mmm180 -60.53 -46.57 89.65 Favored 'General case' 0 N--CA 1.452 -0.331 0 CA-C-O 118.95 -0.547 . . . . 0.0 110.866 178.174 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 126' ' ' MET . . . . . . . . . . . . . 28.3 ptm -62.83 -35.75 80.95 Favored 'General case' 0 N--CA 1.452 -0.339 0 C-N-CA 118.593 -1.243 . . . . 0.0 108.736 178.12 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 2.8 mp -61.48 -35.64 78.22 Favored 'General case' 0 CA--C 1.534 0.335 0 CA-C-N 118.927 0.785 . . . . 0.0 112.033 178.59 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -70.9 -41.76 70.83 Favored 'General case' 0 CA--C 1.527 0.092 0 CA-C-N 118.858 0.754 . . . . 0.0 109.718 178.46 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 19.4 m-20 -68.05 -30.64 69.9 Favored 'General case' 0 N--CA 1.453 -0.286 0 N-CA-C 109.704 -0.48 . . . . 0.0 109.704 179.119 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 42.2 mt -64.24 -39.79 86.76 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.302 0 C-N-CA 122.745 0.418 . . . . 0.0 109.893 174.942 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 131' ' ' TRP . . . . . . . . . . . . . 47.4 m0 . . . . . 0 N--CA 1.45 -0.455 0 C-N-CA 119.783 -0.767 . . . . 0.0 111.744 177.669 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 41.8 t0 . . . . . 0 N--CA 1.45 -0.468 0 N-CA-C 107.873 -1.158 . . . . 0.0 107.873 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 7' ' ' PHE . . . . . 0.557 ' CD1' ' HD3' ' A' ' 45' ' ' LYS . 1.5 t80 -55.35 -35.3 65.08 Favored 'General case' 0 N--CA 1.451 -0.404 0 N-CA-C 108.525 -0.917 . . . . 0.0 108.525 175.996 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 51.8 tp60 -51.7 -34.0 36.79 Favored 'General case' 0 N--CA 1.452 -0.326 0 C-N-CA 124.937 1.295 . . . . 0.0 111.969 -178.778 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 79.9 m-20 -74.6 -36.14 62.98 Favored 'General case' 0 N--CA 1.453 -0.282 0 N-CA-C 109.906 -0.405 . . . . 0.0 109.906 -179.932 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 10' ' ' PHE . . . . . 0.486 ' CZ ' HG12 ' A' ' 46' ' ' ILE . 2.0 t80 -68.32 -36.43 79.28 Favored 'General case' 0 N--CA 1.449 -0.503 0 C-N-CA 123.086 0.554 . . . . 0.0 109.638 174.673 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 96.0 t -69.1 -52.79 30.24 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.234 0 N-CA-C 109.606 -0.516 . . . . 0.0 109.606 178.385 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -58.9 -28.47 66.21 Favored 'General case' 0 N--CA 1.454 -0.232 0 CA-C-N 117.747 0.248 . . . . 0.0 111.478 -179.154 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 86.7 m -72.64 -39.01 67.51 Favored 'General case' 0 N--CA 1.454 -0.242 0 N-CA-C 109.099 -0.704 . . . . 0.0 109.099 175.602 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -64.39 -43.26 95.02 Favored 'General case' 0 N--CA 1.451 -0.422 0 N-CA-C 109.018 -0.734 . . . . 0.0 109.018 177.773 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 67.6 mm-40 -65.42 -26.49 68.0 Favored 'General case' 0 N--CA 1.455 -0.22 0 C-N-CA 123.85 0.86 . . . . 0.0 110.011 178.425 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 68.1 m -70.53 -30.17 66.84 Favored 'General case' 0 N--CA 1.455 -0.183 0 N-CA-C 110.015 -0.365 . . . . 0.0 110.015 176.901 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 17' ' ' PHE . . . . . 0.536 ' CD1' HD11 ' A' ' 68' ' ' ILE . 35.9 m-85 -71.98 -32.8 67.6 Favored 'General case' 0 C--N 1.338 0.088 0 C-N-CA 119.943 -0.703 . . . . 0.0 110.76 172.41 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 72.9 mttt -66.76 -25.36 66.46 Favored 'General case' 0 CA--C 1.531 0.235 0 N-CA-C 110.037 -0.357 . . . . 0.0 110.037 174.541 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 42.6 t0 -76.56 -48.74 18.32 Favored 'General case' 0 CA--C 1.529 0.15 0 N-CA-C 110.306 -0.257 . . . . 0.0 110.306 175.439 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 16.2 mt -56.23 125.26 21.01 Favored 'General case' 0 N--CA 1.457 -0.098 0 CA-C-O 120.714 0.293 . . . . 0.0 110.467 -177.64 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 21' ' ' LYS . . . . . 0.487 ' H ' ' HE2' ' A' ' 21' ' ' LYS . 1.0 OUTLIER -70.74 -22.57 62.4 Favored 'General case' 0 N--CA 1.456 -0.138 0 N-CA-C 109.819 -0.437 . . . . 0.0 109.819 -179.84 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 61.8 m -90.69 -13.34 34.37 Favored 'General case' 0 N--CA 1.457 -0.09 0 C-N-CA 122.901 0.48 . . . . 0.0 111.059 176.299 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 70.55 -16.83 0.92 Allowed Glycine 0 CA--C 1.529 0.923 0 C-N-CA 124.135 0.874 . . . . 0.0 112.983 -179.677 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 93.6 mt -100.41 147.67 7.53 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.135 0 CA-C-N 117.773 0.786 . . . . 0.0 111.121 -179.961 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 24.3 t -161.12 104.68 1.31 Allowed 'General case' 0 CA--C 1.517 -0.294 0 N-CA-C 108.273 -1.01 . . . . 0.0 108.273 170.808 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -59.93 -28.47 66.12 Favored Glycine 0 CA--C 1.525 0.657 0 C-N-CA 119.914 -1.136 . . . . 0.0 110.829 -176.697 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 86.3 p -72.75 -49.34 31.53 Favored 'General case' 0 N--CA 1.453 -0.303 0 CA-C-N 117.854 0.827 . . . . 0.0 110.683 -179.634 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 40.5 mtt-85 -72.55 -37.35 68.27 Favored 'General case' 0 N--CA 1.453 -0.311 0 CA-C-N 117.577 0.171 . . . . 0.0 110.632 -178.534 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 63.0 mt -60.03 -46.24 94.47 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.668 0 N-CA-C 108.704 -0.85 . . . . 0.0 108.704 175.838 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 28.8 mtmm -64.89 -29.03 69.96 Favored 'General case' 0 C--N 1.338 0.091 0 CA-C-O 119.168 -0.444 . . . . 0.0 111.284 178.747 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 31' ' ' LYS . . . . . 0.472 ' CE ' ' HA ' ' A' ' 31' ' ' LYS . 3.5 mmpt? -66.2 -59.21 3.97 Favored 'General case' 0 N--CA 1.456 -0.155 0 CA-C-N 118.739 0.699 . . . . 0.0 111.454 -179.15 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.493 HD12 ' N ' ' A' ' 33' ' ' THR . 0.8 OUTLIER -75.33 -16.76 60.38 Favored 'General case' 0 CA--C 1.531 0.212 0 C-N-CA 118.747 -1.181 . . . . 0.0 111.568 -179.249 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 33' ' ' THR . . . . . 0.493 ' N ' HD12 ' A' ' 32' ' ' LEU . 40.5 m -71.04 -44.37 65.96 Favored 'General case' 0 N--CA 1.455 -0.194 0 N-CA-C 108.19 -1.041 . . . . 0.0 108.19 174.41 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 95.3 m -65.29 -42.74 92.79 Favored 'General case' 0 N--CA 1.453 -0.316 0 N-CA-C 109.601 -0.518 . . . . 0.0 109.601 -179.731 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 38.4 t80 -61.44 -34.31 75.2 Favored 'General case' 0 N--CA 1.453 -0.323 0 CA-C-O 120.731 0.3 . . . . 0.0 110.268 179.18 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -75.3 -25.51 57.96 Favored 'General case' 0 N--CA 1.45 -0.445 0 CA-C-O 119.378 -0.344 . . . . 0.0 111.767 177.977 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 2.2 mm? -82.93 -33.46 26.8 Favored 'General case' 0 N--CA 1.456 -0.149 0 N-CA-C 108.595 -0.891 . . . . 0.0 108.595 -178.127 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 82.7 m-20 -64.52 -28.42 69.64 Favored 'General case' 0 N--CA 1.444 -0.77 0 C-N-CA 123.595 0.758 . . . . 0.0 110.532 174.677 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 73.3 m80 -151.39 106.99 3.36 Favored 'General case' 0 N--CA 1.453 -0.286 0 C-N-CA 122.826 0.45 . . . . 0.0 111.902 -179.841 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 40' ' ' ILE . . . . . 0.62 ' H ' HD13 ' A' ' 40' ' ' ILE . 0.0 OUTLIER -78.61 -10.8 13.0 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.284 0 N-CA-C 109.593 -0.521 . . . . 0.0 109.593 172.699 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -54.85 -28.28 48.72 Favored 'General case' 0 N--CA 1.453 -0.301 0 C-N-CA 123.798 0.839 . . . . 0.0 111.75 -177.006 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -104.88 16.39 6.1 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.318 0 C-N-CA 123.47 0.708 . . . . 0.0 112.375 -179.94 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 3.1 pp20? -53.89 -31.44 49.93 Favored 'General case' 0 C--O 1.225 -0.235 0 O-C-N 121.51 -0.744 . . . . 0.0 110.375 179.66 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 37.6 t -59.42 -48.04 83.18 Favored 'General case' 0 CA--C 1.532 0.287 0 CA-C-O 119.703 -0.189 . . . . 0.0 111.32 -176.913 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 45' ' ' LYS . . . . . 0.557 ' HD3' ' CD1' ' A' ' 7' ' ' PHE . 18.7 ptpt -75.4 -25.48 57.62 Favored 'General case' 0 CA--C 1.531 0.23 0 CA-C-N 118.267 0.485 . . . . 0.0 110.49 179.541 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 46' ' ' ILE . . . . . 0.486 HG12 ' CZ ' ' A' ' 10' ' ' PHE . 94.5 mt -71.96 -46.45 59.88 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.254 0 N-CA-C 109.667 -0.494 . . . . 0.0 109.667 -179.339 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 39.6 mm -65.22 -34.0 67.52 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.531 0 N-CA-C 108.965 -0.754 . . . . 0.0 108.965 177.311 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 53.8 m -64.75 -35.1 79.96 Favored 'General case' 0 N--CA 1.453 -0.299 0 CA-C-O 119.649 -0.215 . . . . 0.0 111.117 178.068 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 16.1 mt -73.62 -40.58 63.7 Favored 'General case' 0 N--CA 1.452 -0.328 0 CA-C-O 118.753 -0.642 . . . . 0.0 112.528 179.516 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 9.0 pt -68.44 -40.25 81.94 Favored 'Isoleucine or valine' 0 C--N 1.339 0.124 0 CA-C-N 119.474 1.034 . . . . 0.0 111.051 -177.962 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 16.6 pt -68.99 -39.23 79.48 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.185 0 C-N-CA 120.136 -0.626 . . . . 0.0 110.709 179.333 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 50.7 t0 -64.81 -51.66 60.93 Favored 'General case' 0 N--CA 1.455 -0.194 0 N-CA-C 109.648 -0.501 . . . . 0.0 109.648 177.924 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 25.9 t80 -59.57 -53.29 59.81 Favored 'General case' 0 N--CA 1.45 -0.46 0 N-CA-C 109.543 -0.54 . . . . 0.0 109.543 -179.298 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 18.7 t -61.48 -29.53 70.03 Favored 'General case' 0 N--CA 1.452 -0.337 0 N-CA-C 111.974 0.361 . . . . 0.0 111.974 -174.344 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 5.1 tpm_? -75.5 -60.43 2.31 Favored 'General case' 0 CA--C 1.532 0.283 0 C-N-CA 122.5 0.32 . . . . 0.0 111.326 -179.5 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 56' ' ' LEU . . . . . 0.443 HD12 ' N ' ' A' ' 56' ' ' LEU . 9.1 mp -75.66 -28.66 58.82 Favored 'General case' 0 C--O 1.231 0.093 0 N-CA-C 114.14 1.163 . . . . 0.0 114.14 -174.966 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 57' ' ' CYS . . . . . 0.424 ' HB2' ' HD2' ' A' ' 58' ' ' PRO . 13.2 p -68.28 156.74 89.47 Favored Pre-proline 0 CA--C 1.536 0.428 0 N-CA-C 112.471 0.545 . . . . 0.0 112.471 -174.713 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 58' ' ' PRO . . . . . 0.424 ' HD2' ' HB2' ' A' ' 57' ' ' CYS . 94.0 Cg_endo -74.05 175.97 10.15 Favored 'Trans proline' 0 N--CA 1.454 -0.832 0 C-N-CA 125.046 3.83 . . . . 0.0 111.593 179.203 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 32.4 p-10 -52.66 -47.2 67.29 Favored 'General case' 0 CA--C 1.529 0.145 0 C-N-CA 124.533 1.133 . . . . 0.0 113.737 -170.847 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 40.2 t -65.23 -37.63 87.87 Favored 'General case' 0 N--CA 1.456 -0.145 0 CA-C-O 121.121 0.486 . . . . 0.0 110.462 -178.758 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 66.1 m170 -75.3 -26.36 58.64 Favored 'General case' 0 N--CA 1.452 -0.375 0 CA-C-N 116.521 -0.309 . . . . 0.0 110.232 179.836 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 62' ' ' LYS . . . . . 0.415 ' HE2' ' O ' ' A' ' 57' ' ' CYS . 68.7 mttm -65.93 -39.43 90.5 Favored 'General case' 0 C--N 1.342 0.249 0 N-CA-C 109.29 -0.633 . . . . 0.0 109.29 174.334 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -61.15 -48.38 81.86 Favored 'General case' 0 N--CA 1.454 -0.233 0 N-CA-C 108.313 -0.995 . . . . 0.0 108.313 176.541 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -63.99 -31.89 82.36 Favored Glycine 0 CA--C 1.524 0.642 0 N-CA-C 111.668 -0.573 . . . . 0.0 111.668 -179.21 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 37.4 p -65.85 -38.53 89.1 Favored 'General case' 0 N--CA 1.454 -0.271 0 CA-C-N 117.699 0.749 . . . . 0.0 109.887 179.011 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 82.3 mt -72.61 -25.54 61.35 Favored 'General case' 0 N--CA 1.451 -0.396 0 N-CA-C 110.026 -0.361 . . . . 0.0 110.026 178.914 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -72.45 -38.59 68.24 Favored 'General case' 0 N--CA 1.454 -0.268 0 N-CA-C 110.374 -0.232 . . . . 0.0 110.374 176.335 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 68' ' ' ILE . . . . . 0.536 HD11 ' CD1' ' A' ' 17' ' ' PHE . 18.2 mt -69.19 -46.82 77.06 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.237 0 N-CA-C 109.673 -0.491 . . . . 0.0 109.673 176.0 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 70.7 mt -56.55 -32.46 36.91 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.161 0 C-N-CA 123.031 0.532 . . . . 0.0 110.814 176.252 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 6.9 t70 -69.76 -50.08 46.83 Favored 'General case' 0 N--CA 1.452 -0.354 0 CA-C-O 119.383 -0.341 . . . . 0.0 111.132 179.38 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 99.2 p -67.5 -49.89 61.41 Favored 'General case' 0 N--CA 1.455 -0.219 0 C-N-CA 120.505 -0.478 . . . . 0.0 110.663 -175.757 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -74.89 -32.44 27.72 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.182 0 N-CA-C 109.931 -0.396 . . . . 0.0 109.931 -176.508 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -69.75 -58.53 6.27 Favored Glycine 0 C--N 1.336 0.566 0 N-CA-C 111.116 -0.794 . . . . 0.0 111.116 -176.975 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 28.7 mtp-105 -61.51 -40.95 96.46 Favored 'General case' 0 N--CA 1.45 -0.426 0 N-CA-C 109.808 -0.441 . . . . 0.0 109.808 -177.799 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -67.81 -28.23 67.41 Favored 'General case' 0 N--CA 1.451 -0.411 0 C-N-CA 120.771 -0.372 . . . . 0.0 111.331 179.993 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 1.3 m-30 -69.63 -46.23 66.68 Favored 'General case' 0 N--CA 1.455 -0.221 0 CA-C-N 118.648 0.658 . . . . 0.0 111.192 178.529 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 44.2 tp -73.51 -35.83 65.65 Favored 'General case' 0 N--CA 1.449 -0.477 0 C-N-CA 117.471 -1.691 . . . . 0.0 110.219 -179.995 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 89.0 m-20 -62.52 -46.22 89.39 Favored 'General case' 0 C--O 1.231 0.122 0 N-CA-C 112.393 0.516 . . . . 0.0 112.393 178.641 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 15.1 tm-20 -65.35 -47.75 75.39 Favored 'General case' 0 N--CA 1.444 -0.759 0 CA-C-N 118.017 0.371 . . . . 0.0 110.873 -179.026 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 76.7 p -68.23 -25.04 65.0 Favored 'General case' 0 N--CA 1.452 -0.328 0 CA-C-O 119.674 -0.203 . . . . 0.0 111.49 -179.172 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 35.4 ttp-105 -75.51 -34.05 60.79 Favored 'General case' 0 N--CA 1.457 -0.093 0 C-N-CA 122.711 0.404 . . . . 0.0 111.234 172.915 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 34.6 t . . . . . 0 N--CA 1.456 -0.157 0 C-N-CA 123.839 0.856 . . . . 0.0 113.249 -177.876 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 71.6 Cg_endo . . . . . 0 N--CA 1.455 -0.787 0 N-CA-C 110.246 -0.713 . . . . 0.0 110.246 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 84.9 19.13 60.02 Favored Glycine 0 CA--C 1.523 0.567 0 CA-C-O 119.483 -0.62 . . . . 0.0 112.344 179.303 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 25.1 p -153.76 172.82 16.71 Favored 'General case' 0 N--CA 1.455 -0.195 0 C-N-CA 123.533 0.733 . . . . 0.0 110.716 178.702 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 94' ' ' CYS . . . . . 0.426 ' HB2' HD13 ' A' ' 98' ' ' ILE . 30.6 p -59.93 -21.73 61.51 Favored 'General case' 0 N--CA 1.449 -0.522 0 CA-C-N 115.467 -0.788 . . . . 0.0 110.234 175.064 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -60.22 -56.8 17.14 Favored 'General case' 0 N--CA 1.447 -0.578 0 N-CA-C 109.722 -0.473 . . . . 0.0 109.722 -176.088 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 73.7 t60 -75.17 -37.12 61.4 Favored 'General case' 0 N--CA 1.45 -0.435 0 O-C-N 122.924 0.14 . . . . 0.0 111.014 179.191 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -62.58 -50.83 69.75 Favored 'General case' 0 N--CA 1.451 -0.379 0 N-CA-C 111.821 0.304 . . . . 0.0 111.821 -177.585 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 98' ' ' ILE . . . . . 0.426 HD13 ' HB2' ' A' ' 94' ' ' CYS . 1.8 mp -73.03 -33.14 41.98 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.165 0 CA-C-N 118.233 0.469 . . . . 0.0 110.068 -179.164 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 31.9 m-20 -65.0 -40.65 95.26 Favored 'General case' 0 N--CA 1.452 -0.326 0 CA-C-N 118.547 0.612 . . . . 0.0 111.465 177.129 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 96.7 m -67.2 -42.7 83.71 Favored 'General case' 0 N--CA 1.452 -0.339 0 CA-C-O 120.514 0.197 . . . . 0.0 110.532 -178.011 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 75.7 mt -74.3 -28.49 61.2 Favored 'General case' 0 N--CA 1.45 -0.439 0 C-N-CA 120.805 -0.358 . . . . 0.0 110.871 179.997 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -59.19 -25.11 59.6 Favored Glycine 0 CA--C 1.527 0.803 0 N-CA-C 111.683 -0.567 . . . . 0.0 111.683 -177.868 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 17.4 mm-40 -84.49 -41.74 16.27 Favored 'General case' 0 N--CA 1.454 -0.272 0 CA-C-N 117.965 0.882 . . . . 0.0 112.309 179.588 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 16.5 m -104.5 -4.17 9.63 Favored 'Isoleucine or valine' 0 N--CA 1.461 0.095 0 N-CA-C 114.164 1.172 . . . . 0.0 114.164 -171.501 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 105' ' ' ILE . . . . . 0.414 HD12 ' HA ' ' A' ' 105' ' ' ILE . 11.1 tp -63.69 -33.42 61.63 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.244 0 CA-C-N 119.463 1.029 . . . . 0.0 110.913 -177.421 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 23.8 pt20 -67.15 -30.22 70.15 Favored 'General case' 0 CA--C 1.531 0.237 0 C-N-CA 122.948 0.499 . . . . 0.0 110.03 178.523 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 5.8 mm-40 -74.12 -46.67 41.22 Favored 'General case' 0 N--CA 1.454 -0.245 0 C-N-CA 123.135 0.574 . . . . 0.0 110.425 177.708 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 81.6 mt -68.66 -33.58 74.24 Favored 'General case' 0 N--CA 1.455 -0.217 0 N-CA-C 110.045 -0.354 . . . . 0.0 110.045 -178.77 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 36.4 mt -65.25 -62.13 1.72 Allowed 'General case' 0 N--CA 1.449 -0.49 0 N-CA-C 109.332 -0.618 . . . . 0.0 109.332 175.171 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 25.7 t -58.13 -35.55 71.65 Favored 'General case' 0 C--N 1.338 0.107 0 N-CA-C 112.005 0.372 . . . . 0.0 112.005 -173.463 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 62.1 t0 -61.85 -44.02 97.66 Favored 'General case' 0 N--CA 1.45 -0.47 0 N-CA-C 108.979 -0.748 . . . . 0.0 108.979 176.643 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -71.47 -37.67 71.3 Favored 'General case' 0 N--CA 1.446 -0.646 0 CA-C-N 116.434 -0.348 . . . . 0.0 110.802 -178.861 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 113' ' ' ILE . . . . . 0.474 ' O ' ' HE3' ' A' ' 121' ' ' LYS . 32.9 mm -61.25 -43.59 96.78 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.259 0 N-CA-C 109.356 -0.609 . . . . 0.0 109.356 -179.403 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -74.56 -38.83 62.6 Favored 'General case' 0 N--CA 1.451 -0.422 0 N-CA-C 112.039 0.385 . . . . 0.0 112.039 -176.701 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -77.42 -34.44 54.7 Favored 'General case' 0 C--N 1.338 0.099 0 N-CA-C 112.106 0.41 . . . . 0.0 112.106 -177.585 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 116' ' ' SER . . . . . 0.513 ' HB2' ' CB ' ' A' ' 120' ' ' HIS . 29.3 p -87.72 157.55 19.03 Favored 'General case' 0 N--CA 1.454 -0.257 0 N-CA-C 113.084 0.772 . . . . 0.0 113.084 -169.43 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 53.2 t30 -75.48 167.8 21.22 Favored 'General case' 0 C--O 1.224 -0.268 0 C-N-CA 123.874 0.869 . . . . 0.0 111.052 -178.293 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 118' ' ' GLN . . . . . . . . . . . . . 19.6 mm100 -57.6 -32.51 67.26 Favored 'General case' 0 CA--C 1.527 0.085 0 C-N-CA 123.17 0.588 . . . . 0.0 111.405 -176.062 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 36.6 t0 -65.51 -45.37 83.81 Favored 'General case' 0 N--CA 1.454 -0.24 0 CA-C-O 121.701 0.762 . . . . 0.0 108.967 175.639 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 120' ' ' HIS . . . . . 0.513 ' CB ' ' HB2' ' A' ' 116' ' ' SER . 33.5 m170 -68.14 -37.31 80.92 Favored 'General case' 0 N--CA 1.449 -0.477 0 N-CA-C 109.731 -0.47 . . . . 0.0 109.731 179.852 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 121' ' ' LYS . . . . . 0.474 ' HE3' ' O ' ' A' ' 113' ' ' ILE . 61.6 mttp -60.21 -36.96 78.86 Favored 'General case' 0 CA--C 1.521 -0.17 0 N-CA-C 108.675 -0.861 . . . . 0.0 108.675 176.394 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 28.1 tt0 -65.43 -44.41 87.43 Favored 'General case' 0 N--CA 1.452 -0.359 0 C-N-CA 122.379 0.272 . . . . 0.0 110.791 -178.03 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 14.4 mptt -67.34 -36.4 81.33 Favored 'General case' 0 C--O 1.226 -0.149 0 C-N-CA 120.63 -0.428 . . . . 0.0 110.115 -179.209 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 124' ' ' ILE . . . . . . . . . . . . . 54.4 mt -68.67 -32.88 56.86 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.329 0 N-CA-C 109.07 -0.715 . . . . 0.0 109.07 176.474 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 125' ' ' ARG . . . . . 0.474 ' HA ' ' HD2' ' A' ' 125' ' ' ARG . 17.4 tpt85 -69.64 -35.49 75.26 Favored 'General case' 0 N--CA 1.447 -0.599 0 CA-C-O 119.214 -0.422 . . . . 0.0 111.889 -174.806 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 126' ' ' MET . . . . . . . . . . . . . 26.8 ptm -73.88 -38.69 64.32 Favored 'General case' 0 N--CA 1.453 -0.284 0 N-CA-C 109.19 -0.67 . . . . 0.0 109.19 175.656 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 6.4 mp -61.26 -36.33 79.7 Favored 'General case' 0 CA--C 1.53 0.175 0 N-CA-C 109.434 -0.58 . . . . 0.0 109.434 174.811 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 43.6 tp -65.73 -44.33 86.33 Favored 'General case' 0 N--CA 1.454 -0.273 0 O-C-N 122.108 -0.37 . . . . 0.0 110.941 -179.128 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 89.2 m-20 -68.0 -36.4 79.93 Favored 'General case' 0 N--CA 1.456 -0.158 0 N-CA-C 110.366 -0.235 . . . . 0.0 110.366 176.245 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 54.4 mt -63.13 -38.4 81.96 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.436 0 N-CA-C 109.316 -0.624 . . . . 0.0 109.316 177.733 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 131' ' ' TRP . . . . . . . . . . . . . 41.0 m0 . . . . . 0 N--CA 1.454 -0.269 0 CA-C-O 119.481 -0.295 . . . . 0.0 111.481 179.403 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 24.9 p-10 . . . . . 0 N--CA 1.455 -0.21 0 N-CA-C 109.429 -0.582 . . . . 0.0 109.429 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 7' ' ' PHE . . . . . 0.513 ' CD1' ' HD3' ' A' ' 45' ' ' LYS . 1.5 t80 -58.07 -36.48 72.88 Favored 'General case' 0 N--CA 1.446 -0.672 0 C-N-CA 123.173 0.589 . . . . 0.0 111.403 -176.972 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 51.7 tp60 -57.92 -32.17 67.5 Favored 'General case' 0 N--CA 1.453 -0.312 0 C-N-CA 122.689 0.395 . . . . 0.0 111.473 -176.959 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 49.6 t30 -69.44 -33.97 73.74 Favored 'General case' 0 N--CA 1.454 -0.264 0 N-CA-C 109.663 -0.495 . . . . 0.0 109.663 177.826 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 10' ' ' PHE . . . . . 0.506 ' CE2' ' HB2' ' A' ' 32' ' ' LEU . 12.0 t80 -70.33 -40.89 73.87 Favored 'General case' 0 N--CA 1.45 -0.446 0 N-CA-C 109.479 -0.563 . . . . 0.0 109.479 177.427 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 91.3 t -63.0 -55.63 22.4 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.372 0 N-CA-C 108.394 -0.965 . . . . 0.0 108.394 179.544 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -57.79 -29.44 64.87 Favored 'General case' 0 N--CA 1.451 -0.384 0 C-N-CA 122.847 0.459 . . . . 0.0 112.072 179.737 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 95.2 m -72.33 -41.05 66.95 Favored 'General case' 0 CA--C 1.529 0.162 0 CA-C-N 118.864 0.756 . . . . 0.0 109.297 177.208 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.523 ' HA ' ' CD1' ' A' ' 17' ' ' PHE . 10.8 tp -65.84 -42.65 90.22 Favored 'General case' 0 N--CA 1.454 -0.244 0 CA-C-O 121.053 0.454 . . . . 0.0 109.847 178.743 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 77.3 mm-40 -63.65 -32.8 74.39 Favored 'General case' 0 N--CA 1.452 -0.364 0 C-N-CA 123.947 0.899 . . . . 0.0 109.488 177.02 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 70.7 m -69.36 -22.43 63.74 Favored 'General case' 0 N--CA 1.451 -0.421 0 CA-C-O 119.011 -0.518 . . . . 0.0 110.422 177.149 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 17' ' ' PHE . . . . . 0.523 ' CD1' ' HA ' ' A' ' 14' ' ' LEU . 17.0 m-85 -74.49 -38.14 62.95 Favored 'General case' 0 C--N 1.343 0.324 0 CA-C-N 118.572 0.624 . . . . 0.0 110.83 170.303 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 18' ' ' LYS . . . . . 0.436 ' HG2' ' CE1' ' A' ' 53' ' ' TYR . 61.5 mttt -63.72 -23.51 67.39 Favored 'General case' 0 C--N 1.34 0.194 0 CA-C-O 120.786 0.327 . . . . 0.0 110.443 178.924 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 32.0 t0 -75.74 -9.47 58.62 Favored 'General case' 0 CA--C 1.538 0.488 0 C-N-CA 123.397 0.679 . . . . 0.0 112.711 176.315 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 20' ' ' LEU . . . . . 0.486 ' CD1' ' HB2' ' A' ' 25' ' ' SER . 66.9 mt -88.87 171.65 9.76 Favored 'General case' 0 N--CA 1.455 -0.188 0 O-C-N 121.556 -0.715 . . . . 0.0 112.865 -176.443 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 2.1 mppt? -77.79 -25.77 49.21 Favored 'General case' 0 N--CA 1.453 -0.295 0 CA-C-N 115.661 -0.7 . . . . 0.0 110.694 178.725 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 9.4 t -147.58 9.51 0.92 Allowed 'General case' 0 CA--C 1.522 -0.105 0 N-CA-C 113.166 0.802 . . . . 0.0 113.166 -175.879 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 70.23 -13.94 1.37 Allowed Glycine 0 CA--C 1.528 0.856 0 C-N-CA 123.819 0.723 . . . . 0.0 113.234 176.374 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 83.8 mt -65.95 129.31 30.16 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.196 0 N-CA-C 107.282 -1.377 . . . . 0.0 107.282 175.546 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 25' ' ' SER . . . . . 0.486 ' HB2' ' CD1' ' A' ' 20' ' ' LEU . 3.0 t -159.61 73.56 0.57 Allowed 'General case' 0 CA--C 1.518 -0.261 0 N-CA-C 110.198 -0.297 . . . . 0.0 110.198 -171.357 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -44.6 -51.14 8.09 Favored Glycine 0 CA--C 1.527 0.789 0 CA-C-O 118.838 -0.979 . . . . 0.0 114.126 -170.305 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 27' ' ' SER . . . . . 0.432 ' HA ' ' HE3' ' A' ' 30' ' ' LYS . 37.1 p -70.34 -39.03 74.94 Favored 'General case' 0 N--CA 1.455 -0.184 0 CA-C-N 119.615 1.707 . . . . 0.0 111.072 -173.913 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 87.5 mtt180 -74.18 -39.83 62.94 Favored 'General case' 0 N--CA 1.454 -0.259 0 CA-C-N 117.812 0.278 . . . . 0.0 110.715 -179.36 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 61.7 mt -56.63 -46.09 82.67 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.634 0 N-CA-C 108.782 -0.822 . . . . 0.0 108.782 173.753 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 30' ' ' LYS . . . . . 0.432 ' HE3' ' HA ' ' A' ' 27' ' ' SER . 51.4 mtmt -66.75 -29.08 68.97 Favored 'General case' 0 C--N 1.34 0.168 0 CA-C-O 118.984 -0.532 . . . . 0.0 111.332 179.261 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 31' ' ' LYS . . . . . 0.468 ' CE ' ' HA ' ' A' ' 31' ' ' LYS . 3.3 mmpt? -66.13 -55.64 15.41 Favored 'General case' 0 N--CA 1.458 -0.073 0 CA-C-N 118.795 0.725 . . . . 0.0 111.014 -179.075 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.506 ' HB2' ' CE2' ' A' ' 10' ' ' PHE . 1.6 pp -76.12 -18.88 58.96 Favored 'General case' 0 CA--C 1.532 0.264 0 C-N-CA 119.427 -0.909 . . . . 0.0 111.702 -179.71 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 33' ' ' THR . . . . . 0.468 ' N ' HD12 ' A' ' 32' ' ' LEU . 33.2 m -71.13 -40.69 71.24 Favored 'General case' 0 N--CA 1.456 -0.156 0 N-CA-C 108.746 -0.835 . . . . 0.0 108.746 174.834 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 97.9 m -66.75 -41.2 88.17 Favored 'General case' 0 N--CA 1.45 -0.444 0 N-CA-C 109.776 -0.453 . . . . 0.0 109.776 179.388 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 22.1 t80 -60.62 -34.97 75.03 Favored 'General case' 0 C--O 1.226 -0.145 0 N-CA-C 109.938 -0.393 . . . . 0.0 109.938 177.337 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -73.46 -28.45 61.95 Favored 'General case' 0 N--CA 1.449 -0.49 0 CA-C-O 119.25 -0.405 . . . . 0.0 111.522 178.817 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 2.6 mm? -82.38 -34.26 28.43 Favored 'General case' 0 CA--C 1.52 -0.193 0 N-CA-C 109.259 -0.645 . . . . 0.0 109.259 -177.564 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 83.0 m-20 -64.93 -26.74 68.44 Favored 'General case' 0 N--CA 1.442 -0.85 0 C-N-CA 123.829 0.852 . . . . 0.0 110.675 174.463 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 75.7 m80 -151.59 105.64 3.17 Favored 'General case' 0 N--CA 1.452 -0.329 0 C-N-CA 122.985 0.514 . . . . 0.0 111.264 -177.959 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 40' ' ' ILE . . . . . 0.6 ' H ' HD13 ' A' ' 40' ' ' ILE . 0.0 OUTLIER -81.22 -14.59 12.59 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.378 0 C-N-CA 123.323 0.649 . . . . 0.0 110.7 175.481 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 94.5 m-20 -61.35 -11.65 10.89 Favored 'General case' 0 CA--C 1.528 0.103 0 N-CA-C 112.924 0.713 . . . . 0.0 112.924 -178.366 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -111.12 16.15 8.08 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.163 0 C-N-CA 123.23 0.612 . . . . 0.0 111.33 176.17 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 3.0 pp20? -52.77 -32.56 44.23 Favored 'General case' 0 CA--C 1.531 0.228 0 O-C-N 121.649 -0.657 . . . . 0.0 110.668 177.236 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 40.7 t -58.71 -48.35 81.43 Favored 'General case' 0 C--O 1.234 0.267 0 N-CA-C 112.519 0.562 . . . . 0.0 112.519 -179.362 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 45' ' ' LYS . . . . . 0.513 ' HD3' ' CD1' ' A' ' 7' ' ' PHE . 18.7 ptpt -72.33 -25.9 61.72 Favored 'General case' 0 CA--C 1.53 0.187 0 CA-C-N 118.35 0.523 . . . . 0.0 110.193 179.69 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 70.4 mt -72.39 -48.8 46.2 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.257 0 N-CA-C 109.969 -0.382 . . . . 0.0 109.969 -178.236 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 39.6 mm -64.34 -35.67 74.89 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.232 0 N-CA-C 109.296 -0.631 . . . . 0.0 109.296 178.766 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 49.0 m -63.73 -38.93 92.95 Favored 'General case' 0 N--CA 1.453 -0.289 0 CA-C-N 116.836 -0.166 . . . . 0.0 111.1 179.993 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 35.7 mt -76.25 -32.81 59.08 Favored 'General case' 0 N--CA 1.45 -0.467 0 N-CA-C 113.545 0.943 . . . . 0.0 113.545 -178.917 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 15.5 pt -69.81 -40.62 79.23 Favored 'Isoleucine or valine' 0 CA--C 1.523 -0.089 0 CA-C-N 119.647 1.112 . . . . 0.0 110.298 179.294 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 25.8 pt -69.05 -38.53 78.45 Favored 'Isoleucine or valine' 0 CA--C 1.527 0.095 0 C-N-CA 120.068 -0.653 . . . . 0.0 110.528 178.838 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 95.9 m-20 -70.26 -39.36 75.02 Favored 'General case' 0 N--CA 1.456 -0.172 0 CA-C-O 119.281 -0.39 . . . . 0.0 112.007 177.848 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 53' ' ' TYR . . . . . 0.436 ' CE1' ' HG2' ' A' ' 18' ' ' LYS . 13.9 t80 -65.55 -46.61 78.86 Favored 'General case' 0 N--CA 1.453 -0.3 0 N-CA-C 108.707 -0.849 . . . . 0.0 108.707 177.384 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 23.1 m -61.71 -31.9 72.08 Favored 'General case' 0 N--CA 1.455 -0.218 0 O-C-N 123.096 0.248 . . . . 0.0 110.869 -178.327 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 56.2 ttp85 -75.43 -53.34 8.85 Favored 'General case' 0 N--CA 1.451 -0.381 0 C-N-CA 123.494 0.718 . . . . 0.0 112.023 -177.181 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 38.0 mt -76.1 -41.53 50.05 Favored 'General case' 0 N--CA 1.456 -0.158 0 N-CA-C 113.025 0.75 . . . . 0.0 113.025 -173.666 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 8.5 p -64.76 157.1 76.32 Favored Pre-proline 0 CA--C 1.535 0.37 0 N-CA-C 112.842 0.682 . . . . 0.0 112.842 -172.717 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 93.7 Cg_endo -74.66 175.85 10.56 Favored 'Trans proline' 0 N--CA 1.457 -0.664 0 C-N-CA 124.777 3.652 . . . . 0.0 111.131 178.945 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 23.1 p-10 -51.65 -50.06 61.09 Favored 'General case' 0 N--CA 1.456 -0.159 0 C-N-CA 124.31 1.044 . . . . 0.0 113.606 -172.061 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 81.9 p -64.92 -35.71 82.04 Favored 'General case' 0 N--CA 1.452 -0.351 0 C-N-CA 120.066 -0.654 . . . . 0.0 110.148 -177.299 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 48.3 m170 -74.04 -24.77 59.59 Favored 'General case' 0 N--CA 1.455 -0.18 0 CA-C-O 119.033 -0.508 . . . . 0.0 110.263 178.499 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 64.8 mttm -65.96 -34.74 78.8 Favored 'General case' 0 C--N 1.339 0.144 0 CA-C-N 118.791 0.723 . . . . 0.0 109.484 173.984 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -63.65 -48.68 76.27 Favored 'General case' 0 CA--C 1.531 0.248 0 N-CA-C 108.339 -0.985 . . . . 0.0 108.339 174.385 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -66.45 -26.88 72.82 Favored Glycine 0 CA--C 1.525 0.717 0 N-CA-C 111.732 -0.547 . . . . 0.0 111.732 -178.979 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 48.9 m -68.3 -40.35 81.77 Favored 'General case' 0 N--CA 1.452 -0.369 0 CA-C-N 117.654 0.727 . . . . 0.0 109.226 177.297 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 78.0 mt -70.05 -23.84 63.16 Favored 'General case' 0 N--CA 1.449 -0.51 0 CA-C-N 116.633 -0.258 . . . . 0.0 110.502 178.417 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 2.3 m-85 -69.54 -40.77 76.66 Favored 'General case' 0 N--CA 1.456 -0.149 0 CA-C-N 117.703 0.229 . . . . 0.0 111.23 173.041 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 68' ' ' ILE . . . . . 0.519 HD11 ' CD1' ' A' ' 17' ' ' PHE . 8.3 mt -67.43 -43.96 87.2 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.236 0 N-CA-C 109.123 -0.695 . . . . 0.0 109.123 178.772 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 88.9 mt -60.22 -30.69 46.54 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.251 0 C-N-CA 122.717 0.407 . . . . 0.0 111.059 175.887 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 19.4 t70 -70.09 -45.03 67.84 Favored 'General case' 0 N--CA 1.454 -0.262 0 CA-C-N 118.276 0.489 . . . . 0.0 111.603 179.346 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 95.0 p -70.88 -50.08 39.03 Favored 'General case' 0 N--CA 1.45 -0.444 0 C-N-CA 120.857 -0.337 . . . . 0.0 110.381 -176.404 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -75.72 -35.25 30.49 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.218 0 N-CA-C 110.234 -0.284 . . . . 0.0 110.234 -178.108 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -65.32 -51.78 46.21 Favored Glycine 0 C--N 1.335 0.476 0 N-CA-C 111.461 -0.656 . . . . 0.0 111.461 -175.132 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 36.8 mtm105 -71.26 -42.97 68.1 Favored 'General case' 0 N--CA 1.452 -0.351 0 C-N-CA 120.218 -0.593 . . . . 0.0 110.253 179.674 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -60.54 -28.26 68.29 Favored 'General case' 0 N--CA 1.45 -0.443 0 C-N-CA 120.024 -0.67 . . . . 0.0 110.193 -178.692 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 1.8 m-30 -70.36 -55.31 9.43 Favored 'General case' 0 N--CA 1.453 -0.275 0 CA-C-N 118.242 0.473 . . . . 0.0 110.865 174.993 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 6.9 tt -65.94 -43.67 87.33 Favored 'General case' 0 N--CA 1.451 -0.423 0 C-N-CA 117.661 -1.616 . . . . 0.0 109.331 -175.955 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 56.5 m-20 -55.82 -51.45 67.45 Favored 'General case' 0 CA--C 1.528 0.116 0 C-N-CA 122.471 0.308 . . . . 0.0 111.438 -179.028 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 15.2 tm-20 -66.23 -46.1 78.35 Favored 'General case' 0 N--CA 1.446 -0.666 0 N-CA-C 111.618 0.229 . . . . 0.0 111.618 -178.246 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 81.4 p -70.51 -21.51 62.74 Favored 'General case' 0 N--CA 1.451 -0.38 0 CA-C-O 119.711 -0.185 . . . . 0.0 111.341 -178.263 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -75.92 -33.21 59.86 Favored 'General case' 0 N--CA 1.453 -0.309 0 CA-C-N 117.858 0.299 . . . . 0.0 110.198 172.363 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 46.1 t . . . . . 0 N--CA 1.457 -0.118 0 N-CA-C 112.68 0.622 . . . . 0.0 112.68 -178.945 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 44.5 Cg_endo . . . . . 0 N--CA 1.45 -1.031 0 N-CA-C 106.35 -2.212 . . . . 0.0 106.35 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 92' ' ' GLY . . . . . 0.408 ' HA2' ' O ' ' A' ' 40' ' ' ILE . . . 156.9 19.51 0.04 OUTLIER Glycine 0 CA--C 1.529 0.932 0 CA-C-O 118.896 -0.947 . . . . 0.0 114.019 -170.803 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 1.3 p -155.2 165.49 36.51 Favored 'General case' 0 C--O 1.231 0.129 0 CA-C-N 118.617 1.209 . . . . 0.0 109.607 179.46 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 94' ' ' CYS . . . . . 0.512 ' SG ' HD13 ' A' ' 98' ' ' ILE . 2.3 t -51.46 -28.91 14.48 Favored 'General case' 0 N--CA 1.454 -0.233 0 C-N-CA 123.462 0.705 . . . . 0.0 110.722 175.372 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -54.56 -62.54 1.59 Allowed 'General case' 0 N--CA 1.451 -0.403 0 CA-C-N 117.821 0.282 . . . . 0.0 110.357 -179.001 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 66.2 t60 -71.54 -32.6 68.33 Favored 'General case' 0 N--CA 1.451 -0.38 0 O-C-N 122.29 -0.256 . . . . 0.0 110.65 -177.585 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -68.39 -51.74 40.69 Favored 'General case' 0 N--CA 1.451 -0.398 0 N-CA-C 111.579 0.214 . . . . 0.0 111.579 -175.528 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 98' ' ' ILE . . . . . 0.512 HD13 ' SG ' ' A' ' 94' ' ' CYS . 1.7 mp -69.43 -34.86 64.2 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.234 0 CA-C-O 119.35 -0.357 . . . . 0.0 110.116 -178.231 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 29.5 m-80 -70.89 -40.0 72.49 Favored 'General case' 0 N--CA 1.456 -0.131 0 C-N-CA 119.995 -0.682 . . . . 0.0 112.018 178.896 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 85.3 m -74.2 -25.02 59.45 Favored 'General case' 0 N--CA 1.457 -0.104 0 CA-C-N 118.348 0.522 . . . . 0.0 111.178 -177.151 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 64.6 tp -87.57 -40.73 13.99 Favored 'General case' 0 N--CA 1.451 -0.409 0 O-C-N 122.256 -0.278 . . . . 0.0 110.506 177.582 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -69.86 -20.29 75.91 Favored Glycine 0 CA--C 1.527 0.84 0 CA-C-O 119.579 -0.567 . . . . 0.0 112.52 -175.592 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 22.9 pt-20 -79.35 -4.66 51.96 Favored 'General case' 0 N--CA 1.453 -0.295 0 CA-C-N 118.168 0.984 . . . . 0.0 111.595 179.285 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 21.9 m -139.89 3.93 0.57 Allowed 'Isoleucine or valine' 0 N--CA 1.464 0.259 0 N-CA-C 112.538 0.57 . . . . 0.0 112.538 176.834 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 105' ' ' ILE . . . . . . . . . . . . . 10.9 tp -64.43 -31.04 51.9 Favored 'Isoleucine or valine' 0 C--O 1.227 -0.104 0 CA-C-N 118.912 0.778 . . . . 0.0 111.118 -175.352 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 11.7 pt20 -67.8 -28.69 67.81 Favored 'General case' 0 N--CA 1.454 -0.23 0 O-C-N 122.017 -0.427 . . . . 0.0 110.107 179.453 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 61.6 mm-40 -75.68 -42.22 51.71 Favored 'General case' 0 N--CA 1.454 -0.243 0 N-CA-C 109.791 -0.448 . . . . 0.0 109.791 -179.35 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 88.7 mt -71.37 -34.59 70.58 Favored 'General case' 0 N--CA 1.454 -0.226 0 CA-C-N 116.67 -0.241 . . . . 0.0 110.793 -178.993 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 77.2 mt -67.04 -49.44 65.19 Favored 'General case' 0 N--CA 1.452 -0.329 0 N-CA-C 109.682 -0.488 . . . . 0.0 109.682 174.967 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 47.8 m -53.67 -39.8 65.41 Favored 'General case' 0 C--O 1.232 0.173 0 C-N-CA 122.528 0.331 . . . . 0.0 110.98 -179.575 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 29.4 t0 -67.18 -41.39 86.01 Favored 'General case' 0 N--CA 1.451 -0.421 0 CA-C-O 120.916 0.389 . . . . 0.0 110.199 177.715 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -70.87 -36.96 73.04 Favored 'General case' 0 N--CA 1.449 -0.51 0 CA-C-N 116.287 -0.415 . . . . 0.0 111.316 -176.324 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 113' ' ' ILE . . . . . 0.44 ' O ' ' HE3' ' A' ' 121' ' ' LYS . 18.3 mm -68.99 -40.98 81.59 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.185 0 N-CA-C 109.441 -0.577 . . . . 0.0 109.441 179.898 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -69.63 -27.64 65.23 Favored 'General case' 0 N--CA 1.453 -0.282 0 N-CA-C 112.048 0.388 . . . . 0.0 112.048 -179.903 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -90.09 -38.17 13.73 Favored 'General case' 0 CA--C 1.529 0.139 0 N-CA-C 112.434 0.531 . . . . 0.0 112.434 -179.472 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 116' ' ' SER . . . . . 0.446 ' HB3' ' CB ' ' A' ' 120' ' ' HIS . 2.7 m -86.51 154.33 21.18 Favored 'General case' 0 CA--C 1.528 0.125 0 N-CA-C 112.227 0.454 . . . . 0.0 112.227 -170.307 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 49.1 t30 -77.72 170.56 16.38 Favored 'General case' 0 CA--C 1.531 0.229 0 C-N-CA 123.117 0.567 . . . . 0.0 111.302 -175.954 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 118' ' ' GLN . . . . . . . . . . . . . 20.8 mm100 -57.84 -34.05 69.3 Favored 'General case' 0 N--CA 1.457 -0.079 0 C-N-CA 123.237 0.615 . . . . 0.0 112.239 -173.631 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 9.5 p30 -70.39 -40.7 73.78 Favored 'General case' 0 N--CA 1.453 -0.29 0 N-CA-C 109.377 -0.601 . . . . 0.0 109.377 176.935 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 120' ' ' HIS . . . . . 0.446 ' CB ' ' HB3' ' A' ' 116' ' ' SER . 29.0 m170 -64.41 -39.47 93.91 Favored 'General case' 0 N--CA 1.45 -0.445 0 N-CA-C 109.746 -0.464 . . . . 0.0 109.746 176.486 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 121' ' ' LYS . . . . . 0.44 ' HE3' ' O ' ' A' ' 113' ' ' ILE . 64.5 mttp -59.73 -36.39 76.5 Favored 'General case' 0 C--N 1.342 0.257 0 N-CA-C 109.725 -0.472 . . . . 0.0 109.725 176.841 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 26.8 tt0 -65.74 -43.74 88.07 Favored 'General case' 0 N--CA 1.452 -0.341 0 C-N-CA 122.625 0.37 . . . . 0.0 110.651 -178.765 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 14.3 mptt -68.28 -30.02 68.94 Favored 'General case' 0 N--CA 1.457 -0.118 0 C-N-CA 120.486 -0.486 . . . . 0.0 110.221 -179.481 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 124' ' ' ILE . . . . . . . . . . . . . 67.6 mt -73.13 -39.64 57.12 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.365 0 N-CA-C 109.385 -0.598 . . . . 0.0 109.385 177.862 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 125' ' ' ARG . . . . . 0.426 ' HD2' ' HA ' ' A' ' 125' ' ' ARG . 8.1 mmm180 -61.54 -43.72 98.34 Favored 'General case' 0 N--CA 1.451 -0.416 0 CA-C-O 118.544 -0.741 . . . . 0.0 111.593 179.051 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 126' ' ' MET . . . . . . . . . . . . . 28.2 ptm -64.68 -38.93 92.67 Favored 'General case' 0 N--CA 1.454 -0.274 0 C-N-CA 118.77 -1.172 . . . . 0.0 108.897 177.816 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 4.2 mp -61.81 -44.08 97.57 Favored 'General case' 0 N--CA 1.455 -0.223 0 CA-C-N 118.076 0.398 . . . . 0.0 111.09 178.216 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 83.9 mt -65.36 -32.66 74.42 Favored 'General case' 0 N--CA 1.456 -0.145 0 CA-C-N 118.506 0.593 . . . . 0.0 111.465 -177.832 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 45.5 m-20 -75.63 -35.51 60.45 Favored 'General case' 0 N--CA 1.453 -0.31 0 CA-C-N 118.329 0.513 . . . . 0.0 109.863 177.011 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 66.9 mt -62.98 -33.3 59.84 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.25 0 N-CA-C 109.39 -0.596 . . . . 0.0 109.39 174.784 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 131' ' ' TRP . . . . . . . . . . . . . 43.0 m0 . . . . . 0 N--CA 1.452 -0.339 0 N-CA-C 112.164 0.431 . . . . 0.0 112.164 179.129 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 4.2 mpp? . . . . . 0 N--CA 1.475 0.786 0 CA-C-O 119.958 -0.067 . . . . 0.0 110.841 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 2.7 pm0 -136.17 -136.42 0.15 Allowed 'General case' 0 CA--C 1.532 0.263 0 N-CA-C 108.913 -0.773 . . . . 0.0 108.913 178.563 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 29.3 tp60 -75.96 45.25 0.34 Allowed 'General case' 0 CA--C 1.534 0.362 0 CA-C-O 121.262 0.553 . . . . 0.0 111.45 179.143 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 10.8 m-20 -83.86 -177.33 6.65 Favored 'General case' 0 N--CA 1.455 -0.192 0 C-N-CA 124.119 0.968 . . . . 0.0 110.603 177.696 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 29.8 p-10 -82.88 11.79 5.65 Favored 'General case' 0 N--CA 1.456 -0.136 0 CA-C-O 121.04 0.447 . . . . 0.0 110.48 174.999 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 30.6 p-10 -71.16 -28.92 64.6 Favored 'General case' 0 N--CA 1.453 -0.289 0 N-CA-C 108.762 -0.829 . . . . 0.0 108.762 179.248 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 7' ' ' PHE . . . . . 0.515 ' CD1' ' HD3' ' A' ' 45' ' ' LYS . 1.2 t80 -53.0 -36.37 60.38 Favored 'General case' 0 N--CA 1.447 -0.594 0 C-N-CA 124.982 1.313 . . . . 0.0 110.833 -178.263 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 51.5 tp60 -51.89 -35.27 44.67 Favored 'General case' 0 N--CA 1.454 -0.246 0 C-N-CA 123.978 0.911 . . . . 0.0 112.063 -176.947 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 31.1 m-80 -73.74 -33.48 64.34 Favored 'General case' 0 N--CA 1.453 -0.308 0 N-CA-C 110.076 -0.342 . . . . 0.0 110.076 -179.106 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 10' ' ' PHE . . . . . 0.426 ' CZ ' HG12 ' A' ' 46' ' ' ILE . 2.2 t80 -72.24 -36.45 69.1 Favored 'General case' 0 N--CA 1.452 -0.362 0 N-CA-C 108.896 -0.779 . . . . 0.0 108.896 177.298 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 95.7 t -68.0 -54.64 20.96 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.251 0 N-CA-C 108.81 -0.811 . . . . 0.0 108.81 178.157 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -58.67 -28.87 66.14 Favored 'General case' 0 N--CA 1.452 -0.329 0 N-CA-C 112.196 0.443 . . . . 0.0 112.196 -178.961 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 96.1 m -72.29 -41.99 66.02 Favored 'General case' 0 CA--C 1.532 0.268 0 N-CA-C 109.445 -0.576 . . . . 0.0 109.445 176.188 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.487 ' HA ' ' CD1' ' A' ' 17' ' ' PHE . 12.6 tp -62.98 -44.82 94.99 Favored 'General case' 0 N--CA 1.452 -0.329 0 N-CA-C 109.811 -0.44 . . . . 0.0 109.811 178.035 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 76.0 mm-40 -62.37 -32.1 72.84 Favored 'General case' 0 N--CA 1.45 -0.431 0 C-N-CA 124.588 1.155 . . . . 0.0 109.969 178.446 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 70.2 m -67.03 -29.58 69.43 Favored 'General case' 0 N--CA 1.453 -0.276 0 N-CA-C 109.726 -0.472 . . . . 0.0 109.726 177.473 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 17' ' ' PHE . . . . . 0.487 ' CD1' ' HA ' ' A' ' 14' ' ' LEU . 14.0 m-85 -69.11 -42.31 76.25 Favored 'General case' 0 N--CA 1.457 -0.109 0 C-N-CA 120.126 -0.629 . . . . 0.0 110.492 172.31 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 71.3 mttt -61.16 -27.6 68.52 Favored 'General case' 0 C--N 1.339 0.146 0 CA-C-O 120.583 0.23 . . . . 0.0 110.654 -177.389 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 42.3 t0 -73.56 -23.69 60.0 Favored 'General case' 0 CA--C 1.531 0.23 0 CA-C-N 115.866 -0.606 . . . . 0.0 112.245 -178.722 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 20' ' ' LEU . . . . . 0.404 ' C ' ' HE3' ' A' ' 21' ' ' LYS . 94.8 mt -79.16 159.86 27.23 Favored 'General case' 0 CA--C 1.528 0.126 0 O-C-N 121.836 -0.54 . . . . 0.0 110.858 -178.789 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 21' ' ' LYS . . . . . 0.49 ' H ' ' CG ' ' B' 2052 ' ' ASP . 0.0 OUTLIER -84.47 -34.95 23.3 Favored 'General case' 0 C--N 1.34 0.163 0 N-CA-C 109.415 -0.587 . . . . 0.0 109.415 176.027 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 83.9 p -82.02 -22.17 36.62 Favored 'General case' 0 C--N 1.34 0.187 0 C-N-CA 122.788 0.435 . . . . 0.0 111.017 177.937 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 71.59 -8.54 5.54 Favored Glycine 0 CA--C 1.529 0.921 0 C-N-CA 123.804 0.716 . . . . 0.0 112.889 179.282 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 44.9 mt -93.22 148.42 4.78 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.177 0 CA-C-N 117.751 0.776 . . . . 0.0 110.36 176.641 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 8.6 t -162.22 83.03 0.56 Allowed 'General case' 0 C--N 1.339 0.131 0 N-CA-C 109.543 -0.54 . . . . 0.0 109.543 -179.004 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -50.79 -44.9 49.13 Favored Glycine 0 CA--C 1.524 0.645 0 CA-C-O 118.725 -1.041 . . . . 0.0 115.067 -169.466 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 31.7 t -71.35 -42.05 68.98 Favored 'General case' 0 N--CA 1.455 -0.211 0 CA-C-N 119.945 1.872 . . . . 0.0 110.529 -177.469 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 80.4 mtt85 -66.68 -39.87 88.33 Favored 'General case' 0 N--CA 1.455 -0.208 0 N-CA-C 110.203 -0.295 . . . . 0.0 110.203 179.496 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 40.8 mt -55.98 -47.13 80.54 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.505 0 N-CA-C 108.254 -1.017 . . . . 0.0 108.254 174.815 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 78.8 mttt -65.7 -24.86 67.09 Favored 'General case' 0 C--N 1.34 0.172 0 CA-C-O 118.474 -0.774 . . . . 0.0 112.584 177.055 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 31' ' ' LYS . . . . . 0.528 ' HA ' ' HE3' ' A' ' 31' ' ' LYS . 0.0 OUTLIER -67.7 -56.1 10.61 Favored 'General case' 0 C--N 1.343 0.298 0 CA-C-N 119.704 1.138 . . . . 0.0 110.015 -179.915 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.454 HD12 ' N ' ' A' ' 33' ' ' THR . 2.4 pp -74.69 -19.18 60.36 Favored 'General case' 0 N--CA 1.455 -0.208 0 C-N-CA 119.201 -0.999 . . . . 0.0 111.101 -178.233 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 33' ' ' THR . . . . . 0.454 ' N ' HD12 ' A' ' 32' ' ' LEU . 46.2 m -72.74 -37.38 67.74 Favored 'General case' 0 N--CA 1.456 -0.163 0 N-CA-C 109.239 -0.652 . . . . 0.0 109.239 176.404 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 96.0 m -74.69 -37.8 62.55 Favored 'General case' 0 N--CA 1.452 -0.344 0 CA-C-N 116.784 -0.189 . . . . 0.0 110.53 -178.398 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 57.7 t80 -69.93 -30.93 68.44 Favored 'General case' 0 N--CA 1.456 -0.162 0 C-N-CA 120.458 -0.497 . . . . 0.0 109.886 177.927 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -69.67 -33.26 72.32 Favored 'General case' 0 N--CA 1.45 -0.434 0 N-CA-C 110.097 -0.334 . . . . 0.0 110.097 176.293 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 20.6 mt -73.55 -40.77 63.7 Favored 'General case' 0 CA--C 1.52 -0.19 0 C-N-CA 122.743 0.417 . . . . 0.0 110.657 177.685 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 42.4 t0 -63.08 -24.54 67.95 Favored 'General case' 0 N--CA 1.455 -0.202 0 C-N-CA 122.814 0.446 . . . . 0.0 110.64 176.825 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 39' ' ' HIS . . . . . 0.408 ' HB2' HD11 ' A' ' 42' ' ' ILE . 94.8 m-70 -149.75 95.63 2.35 Favored 'General case' 0 N--CA 1.454 -0.239 0 C-N-CA 122.896 0.479 . . . . 0.0 111.622 -177.52 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 40' ' ' ILE . . . . . 0.63 ' H ' HD13 ' A' ' 40' ' ' ILE . 0.0 OUTLIER -72.21 -13.44 16.62 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.345 0 N-CA-C 109.958 -0.386 . . . . 0.0 109.958 174.25 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 18.6 m-20 -58.45 -19.94 40.93 Favored 'General case' 0 CA--C 1.529 0.172 0 C-N-CA 123.24 0.616 . . . . 0.0 112.409 -176.316 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 42' ' ' ILE . . . . . 0.408 HD11 ' HB2' ' A' ' 39' ' ' HIS . 0.0 OUTLIER -107.57 15.07 7.8 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.186 0 N-CA-C 112.109 0.411 . . . . 0.0 112.109 176.78 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 3.0 pp20? -51.46 -33.38 30.79 Favored 'General case' 0 C--O 1.224 -0.241 0 CA-C-N 118.864 0.757 . . . . 0.0 110.69 178.479 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 29.8 t -58.11 -50.28 74.02 Favored 'General case' 0 CA--C 1.534 0.357 0 O-C-N 122.366 -0.209 . . . . 0.0 111.257 -177.245 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 45' ' ' LYS . . . . . 0.515 ' HD3' ' CD1' ' A' ' 7' ' ' PHE . 18.6 ptpt -73.81 -27.87 61.34 Favored 'General case' 0 C--N 1.34 0.161 0 O-C-N 122.034 -0.416 . . . . 0.0 110.658 -179.906 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 46' ' ' ILE . . . . . 0.426 HG12 ' CZ ' ' A' ' 10' ' ' PHE . 86.5 mt -69.55 -48.13 67.82 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.377 0 C-N-CA 122.48 0.312 . . . . 0.0 110.181 -178.85 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 40.6 mm -64.14 -34.69 70.41 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.385 0 N-CA-C 108.95 -0.759 . . . . 0.0 108.95 179.18 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 28.4 t -63.73 -36.65 84.56 Favored 'General case' 0 N--CA 1.451 -0.401 0 C-N-CA 120.397 -0.521 . . . . 0.0 111.085 177.98 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 16.0 mt -73.4 -36.1 65.98 Favored 'General case' 0 N--CA 1.451 -0.387 0 N-CA-C 113.11 0.781 . . . . 0.0 113.11 -179.416 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 50' ' ' ILE . . . . . 0.432 HD12 HG12 ' A' ' 69' ' ' ILE . 7.7 pt -71.0 -41.25 76.87 Favored 'Isoleucine or valine' 0 C--O 1.226 -0.152 0 CA-C-N 119.311 0.96 . . . . 0.0 110.68 -178.244 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 20.0 pt -68.71 -38.67 79.21 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.191 0 C-N-CA 120.155 -0.618 . . . . 0.0 110.374 179.403 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 92.0 m-20 -72.26 -39.14 68.63 Favored 'General case' 0 N--CA 1.454 -0.245 0 O-C-N 121.944 -0.472 . . . . 0.0 111.586 178.893 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 29.0 t80 -65.32 -51.18 62.34 Favored 'General case' 0 N--CA 1.454 -0.253 0 N-CA-C 108.844 -0.798 . . . . 0.0 108.844 176.533 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 24.0 t -62.29 -31.92 72.57 Favored 'General case' 0 N--CA 1.455 -0.214 0 C-N-CA 122.427 0.291 . . . . 0.0 111.731 -173.988 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 74.3 mtm180 -79.93 -43.56 21.92 Favored 'General case' 0 N--CA 1.453 -0.297 0 O-C-N 121.92 -0.488 . . . . 0.0 112.197 -178.703 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 56.4 mt -81.93 -42.77 19.01 Favored 'General case' 0 N--CA 1.461 0.08 0 N-CA-C 113.163 0.801 . . . . 0.0 113.163 -175.159 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 57' ' ' CYS . . . . . 0.459 ' O ' ' HE2' ' A' ' 62' ' ' LYS . 14.0 p -60.48 159.19 25.32 Favored Pre-proline 0 CA--C 1.534 0.358 0 N-CA-C 114.064 1.135 . . . . 0.0 114.064 -172.529 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 31.3 Cg_exo -59.7 172.77 1.94 Allowed 'Trans proline' 0 N--CA 1.456 -0.709 1 C-N-CA 125.56 4.174 . . . . 0.0 113.198 175.751 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 27.6 p-10 -60.85 -42.37 97.67 Favored 'General case' 0 C--N 1.329 -0.305 0 C-N-CA 124.068 0.947 . . . . 0.0 112.535 -173.039 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 95.1 p -70.06 -36.44 74.99 Favored 'General case' 0 N--CA 1.455 -0.22 0 N-CA-C 109.541 -0.54 . . . . 0.0 109.541 179.345 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 71.4 m80 -69.98 -28.03 65.2 Favored 'General case' 0 N--CA 1.451 -0.413 0 N-CA-C 110.114 -0.328 . . . . 0.0 110.114 177.707 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 62' ' ' LYS . . . . . 0.459 ' HE2' ' O ' ' A' ' 57' ' ' CYS . 64.6 mttm -64.39 -41.51 96.62 Favored 'General case' 0 C--N 1.339 0.142 0 N-CA-C 109.151 -0.685 . . . . 0.0 109.151 173.069 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -59.68 -45.41 92.15 Favored 'General case' 0 CA--C 1.533 0.319 0 N-CA-C 108.693 -0.854 . . . . 0.0 108.693 176.423 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -69.09 -28.29 73.03 Favored Glycine 0 C--N 1.337 0.635 0 N-CA-C 111.755 -0.538 . . . . 0.0 111.755 -179.425 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 38.0 p -67.15 -36.27 81.46 Favored 'General case' 0 N--CA 1.453 -0.324 0 CA-C-N 117.837 0.819 . . . . 0.0 109.151 177.672 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 81.6 mt -75.42 -26.54 58.43 Favored 'General case' 0 N--CA 1.45 -0.464 0 CA-C-O 119.398 -0.334 . . . . 0.0 110.756 -179.242 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 6.9 m-30 -67.39 -39.14 85.59 Favored 'General case' 0 C--O 1.233 0.189 0 CA-C-N 118.055 0.389 . . . . 0.0 110.686 172.098 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 68' ' ' ILE . . . . . 0.434 HD11 ' CE1' ' A' ' 17' ' ' PHE . 19.7 mt -68.32 -50.85 53.51 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.643 0 N-CA-C 108.761 -0.829 . . . . 0.0 108.761 179.474 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 69' ' ' ILE . . . . . 0.432 HG12 HD12 ' A' ' 50' ' ' ILE . 88.5 mt -56.93 -34.87 45.37 Favored 'Isoleucine or valine' 0 C--N 1.34 0.156 0 C-N-CA 124.103 0.961 . . . . 0.0 111.328 178.223 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 11.9 t70 -69.44 -41.5 76.21 Favored 'General case' 0 N--CA 1.451 -0.407 0 CA-C-N 118.146 0.43 . . . . 0.0 110.588 177.377 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 19.4 m -71.65 -52.88 15.67 Favored 'General case' 0 N--CA 1.452 -0.356 0 CA-C-N 116.603 -0.271 . . . . 0.0 110.423 -175.893 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -75.17 -31.61 24.87 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.244 0 N-CA-C 110.165 -0.309 . . . . 0.0 110.165 -178.136 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -68.74 -56.01 10.34 Favored Glycine 0 C--N 1.336 0.565 0 N-CA-C 110.811 -0.916 . . . . 0.0 110.811 -176.379 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 39.6 mtm105 -65.62 -42.87 91.06 Favored 'General case' 0 N--CA 1.449 -0.511 0 C-N-CA 120.345 -0.542 . . . . 0.0 110.154 -179.475 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -64.17 -28.8 70.0 Favored 'General case' 0 N--CA 1.449 -0.484 0 C-N-CA 119.969 -0.692 . . . . 0.0 110.614 -177.139 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 2.0 m-30 -68.89 -47.31 66.18 Favored 'General case' 0 CA--C 1.518 -0.253 0 CA-C-N 118.738 0.699 . . . . 0.0 110.523 175.527 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 7.3 tt -67.29 -44.61 78.86 Favored 'General case' 0 N--CA 1.449 -0.491 0 C-N-CA 118.041 -1.464 . . . . 0.0 108.726 -179.336 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 72.3 m-20 -57.86 -48.51 79.59 Favored 'General case' 0 CA--C 1.53 0.177 0 N-CA-C 112.353 0.501 . . . . 0.0 112.353 178.922 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 15.4 tm-20 -62.98 -47.02 84.96 Favored 'General case' 0 N--CA 1.452 -0.353 0 CA-C-N 118.343 0.52 . . . . 0.0 110.886 -178.368 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 80' ' ' THR . . . . . 0.493 HG21 ' HB3' ' A' ' 94' ' ' CYS . 69.7 p -67.72 -32.78 73.65 Favored 'General case' 0 N--CA 1.454 -0.23 0 N-CA-C 110.152 -0.314 . . . . 0.0 110.152 179.523 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 33.9 ttp180 -66.56 -24.0 66.29 Favored 'General case' 0 N--CA 1.45 -0.447 0 C-N-CA 123.434 0.694 . . . . 0.0 110.939 174.891 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 35.1 t -98.85 -6.11 29.72 Favored 'General case' 0 CA--C 1.53 0.179 0 C-N-CA 123.63 0.772 . . . . 0.0 113.015 179.089 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 24.7 t-20 -141.55 170.94 14.77 Favored 'General case' 0 CA--C 1.531 0.246 0 CA-C-O 121.364 0.602 . . . . 0.0 112.42 -170.355 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 39.0 t -71.11 -0.6 9.99 Favored 'General case' 0 N--CA 1.456 -0.163 0 C-N-CA 123.257 0.623 . . . . 0.0 111.956 -179.518 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 78.3 m-20 -70.45 -6.5 36.29 Favored 'General case' 0 N--CA 1.452 -0.341 0 O-C-N 122.078 -0.389 . . . . 0.0 111.135 178.565 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 47.7 p -88.82 2.67 53.2 Favored 'General case' 0 CA--C 1.53 0.185 0 C-N-CA 122.901 0.48 . . . . 0.0 111.074 174.135 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 96.2 p -139.59 65.01 1.44 Allowed 'General case' 0 N--CA 1.454 -0.24 0 N-CA-C 109.692 -0.484 . . . . 0.0 109.692 179.244 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 34.1 t -148.11 -171.8 3.92 Favored 'General case' 0 CA--C 1.531 0.248 0 C-N-CA 123.659 0.784 . . . . 0.0 109.536 -178.024 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -53.96 148.82 9.94 Favored 'General case' 0 CA--C 1.529 0.148 0 C-N-CA 122.804 0.442 . . . . 0.0 111.438 -178.615 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 64.4 tttp -58.94 -65.03 2.24 Favored Pre-proline 0 CA--C 1.531 0.249 0 CA-C-O 118.156 -0.926 . . . . 0.0 111.17 -174.869 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 73.1 Cg_endo -69.63 146.35 60.68 Favored 'Trans proline' 0 N--CA 1.449 -1.143 0 N-CA-C 107.716 -1.686 . . . . 0.0 107.716 174.259 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 90.46 21.39 37.82 Favored Glycine 0 CA--C 1.523 0.563 0 CA-C-O 119.57 -0.572 . . . . 0.0 111.795 -179.091 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 41.5 p -151.62 173.84 14.18 Favored 'General case' 0 N--CA 1.454 -0.259 0 C-N-CA 123.884 0.873 . . . . 0.0 110.112 176.632 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 94' ' ' CYS . . . . . 0.493 ' HB3' HG21 ' A' ' 80' ' ' THR . 17.4 p -62.81 -21.65 66.06 Favored 'General case' 0 N--CA 1.448 -0.559 0 CA-C-N 115.741 -0.663 . . . . 0.0 109.526 175.737 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -59.92 -58.59 7.87 Favored 'General case' 0 N--CA 1.447 -0.596 0 N-CA-C 109.373 -0.603 . . . . 0.0 109.373 -176.916 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 75.0 t60 -74.58 -28.05 60.75 Favored 'General case' 0 N--CA 1.45 -0.451 0 N-CA-C 111.583 0.216 . . . . 0.0 111.583 -179.405 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -68.45 -52.52 31.63 Favored 'General case' 0 N--CA 1.452 -0.339 0 CA-C-N 116.662 -0.245 . . . . 0.0 110.785 -178.154 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 98' ' ' ILE . . . . . 0.454 HD13 ' HB2' ' A' ' 94' ' ' CYS . 2.3 mp -69.49 -27.64 34.89 Favored 'Isoleucine or valine' 0 C--N 1.339 0.141 0 C-N-CA 120.266 -0.573 . . . . 0.0 109.889 177.749 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 99' ' ' ASN . . . . . 0.409 HD22 ' C ' ' A' ' 99' ' ' ASN . 0.3 OUTLIER -65.99 -42.81 89.32 Favored 'General case' 0 N--CA 1.452 -0.347 0 CA-C-N 118.03 0.377 . . . . 0.0 110.822 176.554 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 86.5 m -66.53 -43.72 84.42 Favored 'General case' 0 CA--C 1.518 -0.272 0 N-CA-C 110.16 -0.311 . . . . 0.0 110.16 -176.818 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 90.6 mt -69.24 -30.6 68.77 Favored 'General case' 0 N--CA 1.45 -0.431 0 C-N-CA 120.903 -0.319 . . . . 0.0 110.408 179.293 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -61.46 -14.82 43.59 Favored Glycine 0 CA--C 1.528 0.852 0 CA-C-O 119.132 -0.816 . . . . 0.0 112.749 -177.31 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 22.8 mt-10 -107.65 -12.78 15.18 Favored 'General case' 0 C--N 1.339 0.145 0 CA-C-N 118.359 1.079 . . . . 0.0 112.701 -177.981 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 13.2 m -130.03 -4.0 2.72 Favored 'Isoleucine or valine' 0 N--CA 1.461 0.118 0 N-CA-C 113.203 0.816 . . . . 0.0 113.203 -175.311 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 105' ' ' ILE . . . . . . . . . . . . . 10.5 tp -59.14 -23.44 24.59 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.173 0 CA-C-N 119.159 0.89 . . . . 0.0 109.991 178.828 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 25.4 pt20 -65.96 -30.74 71.36 Favored 'General case' 0 N--CA 1.453 -0.3 0 C-N-CA 123.059 0.543 . . . . 0.0 110.27 177.088 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 69.7 mt-10 -75.03 -44.65 46.69 Favored 'General case' 0 N--CA 1.451 -0.403 0 N-CA-C 109.638 -0.505 . . . . 0.0 109.638 -179.563 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 8.3 mp -66.36 -49.53 66.58 Favored 'General case' 0 N--CA 1.452 -0.353 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.624 -176.438 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 8.8 mp -70.13 -54.23 13.85 Favored 'General case' 0 N--CA 1.45 -0.459 0 CA-C-O 119.22 -0.419 . . . . 0.0 110.595 -176.741 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 32.3 t -55.9 -41.84 75.1 Favored 'General case' 0 N--CA 1.455 -0.192 0 CA-C-N 118.461 0.573 . . . . 0.0 111.464 -175.626 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 45.8 t0 -68.58 -41.02 80.27 Favored 'General case' 0 N--CA 1.451 -0.396 0 N-CA-C 109.495 -0.557 . . . . 0.0 109.495 178.013 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -65.33 -35.02 79.71 Favored 'General case' 0 N--CA 1.446 -0.634 0 CA-C-O 119.345 -0.36 . . . . 0.0 110.849 -177.298 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 113' ' ' ILE . . . . . 0.451 ' O ' ' HE3' ' A' ' 121' ' ' LYS . 21.1 mm -68.4 -43.13 84.34 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.32 0 CA-C-N 118.714 0.688 . . . . 0.0 109.17 177.81 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -69.07 -32.76 72.45 Favored 'General case' 0 N--CA 1.451 -0.388 0 N-CA-C 112.178 0.436 . . . . 0.0 112.178 -179.845 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 115' ' ' LYS . . . . . 0.495 ' N ' ' HZ2' ' A' ' 115' ' ' LYS . 0.0 OUTLIER -85.12 -39.6 17.72 Favored 'General case' 0 C--N 1.34 0.153 0 N-CA-C 112.619 0.6 . . . . 0.0 112.619 -178.258 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 116' ' ' SER . . . . . 0.452 ' HB2' ' CB ' ' A' ' 120' ' ' HIS . 49.5 p -85.31 157.16 20.63 Favored 'General case' 0 N--CA 1.455 -0.221 0 N-CA-C 112.257 0.466 . . . . 0.0 112.257 -171.556 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 50.8 t30 -79.97 170.69 16.11 Favored 'General case' 0 N--CA 1.454 -0.237 0 C-N-CA 123.243 0.617 . . . . 0.0 111.102 -178.226 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 118' ' ' GLN . . . . . . . . . . . . . 16.0 mm100 -56.92 -35.98 69.66 Favored 'General case' 0 CA--C 1.527 0.064 0 C-N-CA 123.199 0.6 . . . . 0.0 112.542 -173.634 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 10.0 p-10 -68.93 -40.1 79.22 Favored 'General case' 0 N--CA 1.454 -0.242 0 N-CA-C 109.358 -0.608 . . . . 0.0 109.358 178.299 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 120' ' ' HIS . . . . . 0.452 ' CB ' ' HB2' ' A' ' 116' ' ' SER . 27.8 m170 -66.47 -39.38 88.76 Favored 'General case' 0 N--CA 1.452 -0.352 0 CA-C-N 116.376 -0.375 . . . . 0.0 110.091 176.819 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 121' ' ' LYS . . . . . 0.451 ' HE3' ' O ' ' A' ' 113' ' ' ILE . 64.6 mttp -57.88 -36.18 72.03 Favored 'General case' 0 C--N 1.34 0.158 0 N-CA-C 109.537 -0.542 . . . . 0.0 109.537 176.795 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 40.3 tp10 -72.63 -36.56 68.05 Favored 'General case' 0 N--CA 1.452 -0.349 0 CA-C-O 119.746 -0.168 . . . . 0.0 111.448 -179.902 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 35.6 mmtp -63.43 -39.42 94.43 Favored 'General case' 0 N--CA 1.457 -0.103 0 N-CA-C 109.23 -0.656 . . . . 0.0 109.23 177.738 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 124' ' ' ILE . . . . . . . . . . . . . 65.7 mt -66.9 -34.93 73.18 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.37 0 N-CA-C 108.62 -0.881 . . . . 0.0 108.62 178.211 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 125' ' ' ARG . . . . . 0.462 ' HD2' ' HA ' ' A' ' 125' ' ' ARG . 20.5 tpt85 -68.18 -41.76 80.95 Favored 'General case' 0 N--CA 1.441 -0.877 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.988 -174.993 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 126' ' ' MET . . . . . . . . . . . . . 26.8 ptm -66.7 -32.4 73.68 Favored 'General case' 0 N--CA 1.453 -0.291 0 N-CA-C 108.811 -0.811 . . . . 0.0 108.811 174.809 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 4.7 mp -63.13 -33.83 76.32 Favored 'General case' 0 CA--C 1.531 0.239 0 CA-C-O 118.75 -0.643 . . . . 0.0 110.683 174.852 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 39.5 mt -68.77 -40.94 79.44 Favored 'General case' 0 C--N 1.34 0.162 0 CA-C-N 119.507 1.048 . . . . 0.0 110.148 179.007 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 51.9 m-20 -63.7 -39.2 93.73 Favored 'General case' 0 CA--C 1.522 -0.116 0 C-N-CA 120.353 -0.539 . . . . 0.0 109.911 176.322 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 58.3 mt -64.24 -33.31 61.72 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.256 0 C-N-CA 123.029 0.531 . . . . 0.0 109.959 178.178 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 131' ' ' TRP . . . . . . . . . . . . . 45.9 m0 -75.35 -29.47 59.94 Favored 'General case' 0 N--CA 1.455 -0.188 0 N-CA-C 112.055 0.391 . . . . 0.0 112.055 176.379 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 71.5 m-20 -74.98 -24.08 58.38 Favored 'General case' 0 C--N 1.333 -0.121 0 CA-C-N 118.126 0.421 . . . . 0.0 110.547 176.043 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 3.7 mtt180 -75.44 -38.34 59.81 Favored 'General case' 0 N--CA 1.453 -0.315 0 C-N-CA 123.129 0.572 . . . . 0.0 110.325 173.919 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 34.1 t -75.74 -31.9 59.78 Favored 'General case' 0 N--CA 1.456 -0.154 0 C-N-CA 122.312 0.245 . . . . 0.0 111.377 178.651 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 135' ' ' GLY . . . . . . . . . . . . . . . 91.98 16.92 49.6 Favored Glycine 0 CA--C 1.529 0.949 0 CA-C-O 119.353 -0.693 . . . . 0.0 112.85 178.882 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 136' ' ' LEU . . . . . . . . . . . . . 33.3 mt -56.59 133.18 53.43 Favored 'General case' 0 C--N 1.339 0.122 0 CA-C-N 118.401 1.1 . . . . 0.0 109.498 177.02 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 137' ' ' PHE . . . . . . . . . . . . . 81.4 t80 -76.33 -6.79 53.09 Favored 'General case' 0 CA--C 1.533 0.292 0 N-CA-C 113.286 0.847 . . . . 0.0 113.286 -173.979 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 138' ' ' GLN . . . . . . . . . . . . . 16.7 pt20 -73.39 32.67 0.07 Allowed 'General case' 0 CA--C 1.537 0.457 0 C-N-CA 123.013 0.525 . . . . 0.0 112.24 -177.422 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 139' ' ' LYS . . . . . . . . . . . . . 49.0 mttm -78.35 46.8 0.65 Allowed 'General case' 0 C--N 1.338 0.101 0 C-N-CA 124.079 0.952 . . . . 0.0 112.46 -176.598 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 140' ' ' SER . . . . . . . . . . . . . 43.5 t -73.8 51.24 0.37 Allowed 'General case' 0 CA--C 1.533 0.3 0 C-N-CA 123.495 0.718 . . . . 0.0 110.199 177.251 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 141' ' ' TYR . . . . . . . . . . . . . 16.5 m-30 -72.47 45.21 0.13 Allowed 'General case' 0 CA--C 1.531 0.237 0 C-N-CA 125.571 1.549 . . . . 0.0 112.538 -175.918 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 142' ' ' LEU . . . . . . . . . . . . . 80.9 mt -66.9 172.61 4.24 Favored 'General case' 0 N--CA 1.455 -0.194 0 C-N-CA 123.836 0.854 . . . . 0.0 110.446 177.243 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 14.6 p30 -63.25 -19.29 64.42 Favored 'General case' 0 CA--C 1.533 0.29 0 O-C-N 122.106 -0.371 . . . . 0.0 111.379 -178.101 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . -63.92 -30.02 71.14 Favored 'General case' 0 N--CA 1.453 -0.313 0 N-CA-C 109.654 -0.498 . . . . 0.0 109.654 177.605 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 145' ' ' ILE . . . . . . . . . . . . . 33.3 mm -72.71 -25.73 22.84 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.406 0 C-N-CA 122.565 0.346 . . . . 0.0 110.37 177.398 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 146' ' ' ARG . . . . . . . . . . . . . 42.9 mmt-85 -73.59 -28.9 62.07 Favored 'General case' 0 N--CA 1.457 -0.105 0 N-CA-C 109.103 -0.703 . . . . 0.0 109.103 176.968 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 147' ' ' SER . . . . . . . . . . . . . 43.4 t 53.25 30.38 9.91 Favored 'General case' 0 C--N 1.34 0.188 0 C-N-CA 123.264 0.626 . . . . 0.0 112.254 173.64 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.58 -17.08 29.93 Favored 'General case' 0 CA--C 1.533 0.304 0 C-N-CA 123.404 0.682 . . . . 0.0 112.651 -177.994 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 149' ' ' CYS . . . . . . . . . . . . . 61.3 m -69.23 -51.15 40.54 Favored 'General case' 0 N--CA 1.456 -0.143 0 N-CA-C 109.38 -0.6 . . . . 0.0 109.38 179.014 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 150' ' ' PHE . . . . . . . . . . . . . 95.9 m-85 -70.43 -16.55 62.95 Favored 'General case' 0 N--CA 1.451 -0.416 0 N-CA-C 110.673 -0.121 . . . . 0.0 110.673 -179.988 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 151' ' ' ALA . . . . . . . . . . . . . . . -75.27 -36.49 61.22 Favored 'General case' 0 N--CA 1.452 -0.373 0 N-CA-C 109.839 -0.43 . . . . 0.0 109.839 174.777 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 152' ' ' MET . . . . . . . . . . . . . 71.6 mtm -75.81 -22.88 55.91 Favored 'General case' 0 CA--C 1.53 0.179 0 CA-C-N 117.562 0.165 . . . . 0.0 111.177 176.043 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 153' ' ' ASP . . . . . . . . . . . . . 62.1 m-20 -73.94 -4.79 37.27 Favored 'General case' 0 CA--C 1.529 0.162 0 C-N-CA 122.77 0.428 . . . . 0.0 111.945 176.492 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 154' ' ' LEU . . . . . . . . . . . . . 75.9 mt -130.72 161.65 31.2 Favored 'General case' 0 N--CA 1.455 -0.198 0 C-N-CA 123.023 0.529 . . . . 0.0 110.695 -177.721 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 155' ' ' GLU . . . . . . . . . . . . . 79.5 mm-40 -73.0 151.11 41.92 Favored 'General case' 0 N--CA 1.454 -0.231 0 CA-C-O 120.843 0.354 . . . . 0.0 110.693 178.333 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 156' ' ' HIS . . . . . . . . . . . . . 79.6 t60 -158.88 156.24 29.22 Favored 'General case' 0 N--CA 1.453 -0.282 0 C-N-CA 122.851 0.46 . . . . 0.0 109.86 179.272 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 157' ' ' HIS . . . . . . . . . . . . . 70.6 t60 -155.84 145.2 20.87 Favored 'General case' 0 N--CA 1.451 -0.412 0 N-CA-C 109.622 -0.51 . . . . 0.0 109.622 176.616 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 158' ' ' HIS . . . . . . . . . . . . . 0.9 OUTLIER -159.17 28.64 0.21 Allowed 'General case' 0 CA--C 1.53 0.179 0 C-N-CA 122.359 0.264 . . . . 0.0 110.826 -179.771 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 159' ' ' HIS . . . . . . . . . . . . . 42.2 p-80 . . . . . 0 C--O 1.25 1.131 0 CA-C-O 116.928 -1.511 . . . . 0.0 110.438 -175.752 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' B' B 2052 ' ' ASP . . . . . 0.49 ' CG ' ' H ' ' A' ' 21' ' ' LYS . 0.2 OUTLIER . . . . . 0 N--CA 1.475 0.81 0 N-CA-C 109.552 -0.536 . . . . 0.0 109.552 . . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B 2053 ' ' ASP . . . . . . . . . . . . . 32.3 t0 -83.46 175.29 9.92 Favored 'General case' 0 N--CA 1.453 -0.309 0 C-N-CA 124.795 1.238 . . . . 0.0 109.513 175.046 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B 2054 ' ' ASP . . . . . . . . . . . . . 43.6 t0 61.8 -173.3 0.14 Allowed 'General case' 0 CA--C 1.533 0.319 0 C-N-CA 123.571 0.748 . . . . 0.0 112.672 174.91 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B 2055 ' ' GLU . . . . . . . . . . . . . 93.9 mt-10 -66.14 68.1 0.05 Allowed 'General case' 0 N--CA 1.452 -0.347 0 C-N-CA 125.489 1.515 . . . . 0.0 109.267 173.0 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B 2056 ' ' ASP . . . . . . . . . . . . . 31.4 t0 -61.15 151.31 31.65 Favored 'General case' 0 N--CA 1.451 -0.386 0 C-N-CA 122.919 0.488 . . . . 0.0 110.141 178.788 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B 2057 ' ' ASP . . . . . . . . . . . . . 38.9 t0 48.76 51.55 15.59 Favored 'General case' 0 N--CA 1.454 -0.271 0 C-N-CA 123.766 0.826 . . . . 0.0 112.594 -174.609 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B 2058 ' ' TYR . . . . . . . . . . . . . 7.6 t80 -50.55 152.25 2.01 Favored 'General case' 0 CA--C 1.534 0.354 0 C-N-CA 123.813 0.845 . . . . 0.0 110.599 173.593 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B 2059 ' ' THR . . . . . . . . . . . . . 68.0 p -138.11 110.45 8.45 Favored Pre-proline 0 C--O 1.232 0.182 0 O-C-N 122.111 -0.368 . . . . 0.0 111.292 -177.979 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B 2060 ' ' PRO . . . . . . . . . . . . . 97.3 Cg_endo -74.52 161.18 40.4 Favored 'Trans proline' 0 N--CA 1.452 -0.953 0 C-N-CA 123.106 2.537 . . . . 0.0 108.937 169.82 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B 2061 ' ' SER . . . . . . . . . . . . . 97.8 p -158.62 154.49 26.59 Favored 'General case' 0 N--CA 1.455 -0.221 0 O-C-N 122.044 -0.41 . . . . 0.0 111.063 179.807 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B 2062 ' ' ILE . . . . . . . . . . . . . 56.1 mt -151.53 148.1 14.92 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.364 0 C-N-CA 124.995 1.318 . . . . 0.0 107.769 177.789 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B 2063 ' ' SER . . . . . . . . . . . . . 90.5 p . . . . . 0 C--O 1.252 1.19 0 CA-C-O 117.048 -1.453 . . . . 0.0 109.377 173.789 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 89.9 mmm . . . . . 0 N--CA 1.474 0.732 0 CA-C-O 120.471 0.177 . . . . 0.0 110.61 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 22.7 mp0 -144.71 -170.86 3.49 Favored 'General case' 0 CA--C 1.531 0.238 0 N-CA-C 108.693 -0.854 . . . . 0.0 108.693 -178.219 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 59.3 tt0 -60.87 -21.2 63.03 Favored 'General case' 0 CA--C 1.528 0.128 0 N-CA-C 109.718 -0.475 . . . . 0.0 109.718 175.198 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 8.8 p30 -150.15 125.07 9.88 Favored 'General case' 0 N--CA 1.448 -0.527 0 C-N-CA 124.728 1.211 . . . . 0.0 108.347 173.819 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 85.1 m-20 -81.97 17.98 1.44 Allowed 'General case' 0 N--CA 1.455 -0.176 0 N-CA-C 114.019 1.118 . . . . 0.0 114.019 -173.538 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 16.0 p-10 -80.94 -34.03 33.57 Favored 'General case' 0 C--N 1.331 -0.219 0 N-CA-C 106.692 -1.596 . . . . 0.0 106.692 171.467 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 7' ' ' PHE . . . . . 0.503 ' CD1' ' HD3' ' A' ' 45' ' ' LYS . 1.1 t80 -63.01 -32.45 73.82 Favored 'General case' 0 N--CA 1.444 -0.764 0 C-N-CA 125.063 1.345 . . . . 0.0 110.141 -179.662 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 58.2 tp60 -48.38 -39.49 22.52 Favored 'General case' 0 N--CA 1.454 -0.229 0 C-N-CA 124.322 1.049 . . . . 0.0 111.765 -177.948 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 16.2 m-80 -71.75 -35.17 70.02 Favored 'General case' 0 N--CA 1.455 -0.177 0 N-CA-C 110.145 -0.317 . . . . 0.0 110.145 -178.261 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 1.7 t80 -72.29 -38.97 68.64 Favored 'General case' 0 N--CA 1.449 -0.483 0 C-N-CA 123.731 0.812 . . . . 0.0 109.514 178.148 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 93.0 t -66.24 -52.1 51.52 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.271 0 N-CA-C 108.608 -0.886 . . . . 0.0 108.608 178.601 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -60.36 -29.27 68.8 Favored 'General case' 0 N--CA 1.452 -0.367 0 C-N-CA 122.665 0.386 . . . . 0.0 111.848 179.902 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 59.8 m -73.96 -36.62 64.61 Favored 'General case' 0 CA--C 1.53 0.207 0 N-CA-C 109.055 -0.72 . . . . 0.0 109.055 176.484 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.529 ' HA ' ' CD1' ' A' ' 17' ' ' PHE . 4.8 tp -66.57 -46.53 75.71 Favored 'General case' 0 N--CA 1.453 -0.287 0 CA-C-O 121.284 0.564 . . . . 0.0 109.776 177.899 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 67.8 mm-40 -62.01 -28.09 69.33 Favored 'General case' 0 N--CA 1.447 -0.579 0 C-N-CA 124.167 0.987 . . . . 0.0 109.189 178.485 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 48.2 t -70.99 -28.5 64.48 Favored 'General case' 0 N--CA 1.449 -0.517 0 CA-C-N 116.109 -0.496 . . . . 0.0 109.856 177.31 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 17' ' ' PHE . . . . . 0.529 ' CD1' ' HA ' ' A' ' 14' ' ' LEU . 19.4 m-85 -72.42 -35.55 68.39 Favored 'General case' 0 N--CA 1.455 -0.19 0 CA-C-N 118.584 0.629 . . . . 0.0 110.951 171.161 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 18' ' ' LYS . . . . . 0.464 ' HA ' ' CE1' ' A' ' 61' ' ' HIS . 84.7 mttt -62.93 -26.47 68.83 Favored 'General case' 0 C--N 1.339 0.132 0 N-CA-C 109.643 -0.503 . . . . 0.0 109.643 177.521 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 43.6 t0 -76.71 -15.28 59.82 Favored 'General case' 0 CA--C 1.537 0.478 0 CA-C-N 115.17 -0.923 . . . . 0.0 111.837 176.348 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 87.8 mt -86.06 144.68 27.43 Favored 'General case' 0 N--CA 1.45 -0.432 0 O-C-N 121.243 -0.91 . . . . 0.0 111.276 -179.143 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 21' ' ' LYS . . . . . 0.582 ' HE2' ' H ' ' A' ' 21' ' ' LYS . 1.6 mppt? -83.51 15.04 3.29 Favored 'General case' 0 CA--C 1.531 0.219 0 CA-C-N 115.116 -0.947 . . . . 0.0 108.849 177.316 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 86.0 p -141.73 -26.05 0.68 Allowed 'General case' 0 N--CA 1.454 -0.263 0 C-N-CA 124.735 1.214 . . . . 0.0 111.796 -175.416 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 75.83 -15.46 4.98 Favored Glycine 0 CA--C 1.526 0.731 0 C-N-CA 123.804 0.716 . . . . 0.0 113.141 175.965 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 81.5 mt -97.07 147.07 6.63 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.383 0 C-N-CA 123.395 0.678 . . . . 0.0 109.904 176.948 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 41.4 t -166.03 99.1 0.64 Allowed 'General case' 0 N--CA 1.455 -0.213 0 N-CA-C 109.055 -0.721 . . . . 0.0 109.055 171.296 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -55.2 -48.71 66.93 Favored Glycine 0 CA--C 1.523 0.544 0 CA-C-O 119.428 -0.651 . . . . 0.0 112.591 -172.65 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 27' ' ' SER . . . . . 0.434 ' HA ' ' HE3' ' A' ' 30' ' ' LYS . 16.5 m -63.05 -43.17 99.37 Favored 'General case' 0 N--CA 1.454 -0.251 0 CA-C-N 118.546 1.173 . . . . 0.0 111.08 -177.346 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 81.2 mtt180 -69.55 -42.31 74.77 Favored 'General case' 0 N--CA 1.457 -0.11 0 C-N-CA 122.509 0.324 . . . . 0.0 110.507 -179.888 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 62.6 mt -58.11 -41.78 81.47 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.616 0 N-CA-C 108.467 -0.938 . . . . 0.0 108.467 175.29 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 30' ' ' LYS . . . . . 0.434 ' HE3' ' HA ' ' A' ' 27' ' ' SER . 46.9 mtmt -69.37 -22.11 63.75 Favored 'General case' 0 N--CA 1.456 -0.171 0 CA-C-O 118.427 -0.797 . . . . 0.0 111.979 177.853 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 31' ' ' LYS . . . . . 0.574 ' HE2' ' HA ' ' A' ' 31' ' ' LYS . 8.3 mmpt? -67.1 -56.6 9.34 Favored 'General case' 0 C--N 1.34 0.172 0 CA-C-N 119.621 1.1 . . . . 0.0 109.295 175.352 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 4.6 pp -70.88 -25.73 62.92 Favored 'General case' 0 CA--C 1.528 0.107 0 C-N-CA 120.121 -0.632 . . . . 0.0 110.914 -177.603 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 60.4 m -71.72 -35.61 70.24 Favored 'General case' 0 N--CA 1.457 -0.103 0 N-CA-C 109.94 -0.392 . . . . 0.0 109.94 178.855 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 76.2 m -73.41 -37.33 65.97 Favored 'General case' 0 N--CA 1.454 -0.236 0 N-CA-C 110.414 -0.217 . . . . 0.0 110.414 -178.251 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 42.8 t80 -68.43 -33.22 73.81 Favored 'General case' 0 N--CA 1.457 -0.089 0 C-N-CA 119.852 -0.739 . . . . 0.0 110.087 176.619 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -69.4 -33.6 73.25 Favored 'General case' 0 N--CA 1.448 -0.567 0 CA-C-O 119.775 -0.155 . . . . 0.0 110.617 177.951 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 16.7 mt -73.14 -39.48 65.66 Favored 'General case' 0 N--CA 1.455 -0.209 0 C-N-CA 122.513 0.325 . . . . 0.0 110.684 177.919 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 44.3 t0 -63.61 -26.24 68.59 Favored 'General case' 0 N--CA 1.452 -0.356 0 C-N-CA 122.267 0.227 . . . . 0.0 110.78 176.39 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 39' ' ' HIS . . . . . 0.424 ' HB2' HD11 ' A' ' 42' ' ' ILE . 97.1 m-70 -149.38 99.84 2.95 Favored 'General case' 0 N--CA 1.454 -0.261 0 C-N-CA 122.658 0.383 . . . . 0.0 111.476 -177.028 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 40' ' ' ILE . . . . . 0.6 ' H ' HD13 ' A' ' 40' ' ' ILE . 0.0 OUTLIER -75.39 -19.26 15.97 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.485 0 CA-C-O 118.844 -0.598 . . . . 0.0 110.79 178.0 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 71.1 m-20 -62.21 -9.16 6.97 Favored 'General case' 0 CA--C 1.531 0.212 0 N-CA-C 113.455 0.909 . . . . 0.0 113.455 -175.567 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 42' ' ' ILE . . . . . 0.424 HD11 ' HB2' ' A' ' 39' ' ' HIS . 0.0 OUTLIER -110.4 13.9 8.52 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.168 0 CA-C-N 118.187 0.449 . . . . 0.0 111.655 173.447 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 3.1 pp20? -52.89 -33.4 49.95 Favored 'General case' 0 CA--C 1.529 0.143 0 O-C-N 121.507 -0.746 . . . . 0.0 111.306 177.61 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 3.3 m -64.9 -40.69 95.47 Favored 'General case' 0 CA--C 1.533 0.304 0 CA-C-O 119.053 -0.499 . . . . 0.0 111.911 -176.369 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 45' ' ' LYS . . . . . 0.503 ' HD3' ' CD1' ' A' ' 7' ' ' PHE . 15.3 ptpt -73.17 -27.06 61.43 Favored 'General case' 0 C--N 1.341 0.236 0 CA-C-N 119.346 0.975 . . . . 0.0 109.51 176.803 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 78.7 mt -72.34 -47.15 54.03 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.396 0 C-N-CA 122.715 0.406 . . . . 0.0 110.036 -177.427 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 42.2 mm -65.24 -38.16 81.93 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.203 0 N-CA-C 109.658 -0.497 . . . . 0.0 109.658 179.41 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 37.6 t -65.7 -32.49 74.07 Favored 'General case' 0 N--CA 1.455 -0.192 0 C-N-CA 120.38 -0.528 . . . . 0.0 110.478 177.513 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 49' ' ' LEU . . . . . 0.497 HD22 ' CE1' ' A' ' 7' ' ' PHE . 29.4 tp -75.87 -32.71 59.84 Favored 'General case' 0 N--CA 1.452 -0.364 0 N-CA-C 112.691 0.626 . . . . 0.0 112.691 -177.061 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 50' ' ' ILE . . . . . 0.405 HD12 HG12 ' A' ' 69' ' ' ILE . 11.6 pt -73.97 -38.5 49.74 Favored 'Isoleucine or valine' 0 C--N 1.338 0.098 0 CA-C-N 118.995 0.816 . . . . 0.0 110.956 177.819 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 46.9 pt -66.31 -37.06 78.86 Favored 'Isoleucine or valine' 0 C--O 1.227 -0.084 0 C-N-CA 119.484 -0.886 . . . . 0.0 109.991 178.351 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 95.1 m-20 -67.39 -36.91 82.27 Favored 'General case' 0 N--CA 1.454 -0.263 0 CA-C-N 117.559 0.163 . . . . 0.0 111.113 176.415 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 53' ' ' TYR . . . . . 0.411 ' CE1' ' HB3' ' A' ' 61' ' ' HIS . 18.5 t80 -67.67 -36.55 80.91 Favored 'General case' 0 C--O 1.226 -0.154 0 N-CA-C 109.908 -0.404 . . . . 0.0 109.908 176.172 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 15.2 m -75.59 -22.3 57.06 Favored 'General case' 0 N--CA 1.452 -0.352 0 C-N-CA 122.503 0.321 . . . . 0.0 111.532 -178.464 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 28.9 ttp-105 -86.69 -47.01 9.51 Favored 'General case' 0 N--CA 1.455 -0.199 0 N-CA-C 112.666 0.617 . . . . 0.0 112.666 -177.354 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 46.7 mt -84.95 -47.19 10.52 Favored 'General case' 0 N--CA 1.455 -0.196 0 N-CA-C 112.728 0.64 . . . . 0.0 112.728 -174.242 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 57' ' ' CYS . . . . . 0.542 ' HB3' ' HD2' ' A' ' 58' ' ' PRO . 59.5 m -74.62 160.01 81.99 Favored Pre-proline 0 CA--C 1.534 0.338 0 C-N-CA 122.97 0.508 . . . . 0.0 112.176 -173.573 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 58' ' ' PRO . . . . . 0.542 ' HD2' ' HB3' ' A' ' 57' ' ' CYS . 68.0 Cg_endo -79.01 -176.17 3.14 Favored 'Trans proline' 0 N--CA 1.455 -0.775 0 C-N-CA 125.174 3.916 . . . . 0.0 112.252 -170.073 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 59' ' ' ASP . . . . . 0.458 ' HB2' ' HA ' ' A' ' 116' ' ' SER . 26.0 p-10 -51.15 -50.13 59.5 Favored 'General case' 0 N--CA 1.457 -0.083 0 C-N-CA 124.605 1.162 . . . . 0.0 113.439 -172.837 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 24.5 m -66.18 -33.75 76.48 Favored 'General case' 0 N--CA 1.453 -0.309 0 N-CA-C 109.881 -0.415 . . . . 0.0 109.881 -175.405 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 61' ' ' HIS . . . . . 0.464 ' CE1' ' HA ' ' A' ' 18' ' ' LYS . 33.6 m170 -75.92 -27.44 57.64 Favored 'General case' 0 N--CA 1.451 -0.42 0 N-CA-C 110.051 -0.351 . . . . 0.0 110.051 179.283 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 62' ' ' LYS . . . . . 0.408 ' HB3' ' HE3' ' A' ' 62' ' ' LYS . 29.4 mtpp -73.58 -34.83 65.29 Favored 'General case' 0 C--N 1.339 0.115 0 N-CA-C 110.008 -0.367 . . . . 0.0 110.008 174.48 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -62.85 -43.77 97.91 Favored 'General case' 0 CA--C 1.535 0.402 0 N-CA-C 107.733 -1.21 . . . . 0.0 107.733 175.894 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -70.01 -24.74 76.31 Favored Glycine 0 C--N 1.34 0.751 0 CA-C-N 116.032 -0.531 . . . . 0.0 111.78 179.071 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 42.9 t -69.29 -37.44 77.83 Favored 'General case' 0 N--CA 1.452 -0.348 0 CA-C-N 117.972 0.886 . . . . 0.0 109.707 175.546 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 77.0 mt -72.96 -25.05 60.88 Favored 'General case' 0 N--CA 1.451 -0.412 0 CA-C-O 119.41 -0.329 . . . . 0.0 110.341 178.789 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 3.1 m-30 -70.23 -37.43 74.98 Favored 'General case' 0 CA--C 1.52 -0.204 0 CA-C-N 118.078 0.399 . . . . 0.0 110.5 171.016 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 68' ' ' ILE . . . . . 0.501 HD11 ' CE1' ' A' ' 17' ' ' PHE . 32.2 mt -67.4 -52.94 36.73 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.6 0 N-CA-C 108.389 -0.967 . . . . 0.0 108.389 178.189 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 69' ' ' ILE . . . . . 0.405 HG12 HD12 ' A' ' 50' ' ' ILE . 71.6 mt -52.86 -35.42 21.78 Favored 'Isoleucine or valine' 0 C--N 1.339 0.145 0 C-N-CA 123.6 0.76 . . . . 0.0 111.6 175.88 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 18.4 t70 -69.61 -41.2 76.0 Favored 'General case' 0 C--N 1.333 -0.113 0 CA-C-N 118.538 0.608 . . . . 0.0 110.73 177.907 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 20.2 m -70.66 -56.5 6.29 Favored 'General case' 0 N--CA 1.45 -0.439 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.251 -176.509 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 72' ' ' ILE . . . . . 0.462 HD11 ' CZ ' ' A' ' 76' ' ' TYR . 0.0 OUTLIER -75.01 -29.89 22.73 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.247 0 N-CA-C 110.077 -0.342 . . . . 0.0 110.077 -176.85 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -69.72 -56.72 7.97 Favored Glycine 0 C--N 1.336 0.562 0 N-CA-C 111.533 -0.627 . . . . 0.0 111.533 -176.421 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 39.7 mtm105 -68.94 -38.46 79.5 Favored 'General case' 0 N--CA 1.453 -0.288 0 CA-C-N 117.48 0.64 . . . . 0.0 110.309 -179.395 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -64.36 -29.47 70.54 Favored 'General case' 0 N--CA 1.45 -0.449 0 C-N-CA 119.6 -0.84 . . . . 0.0 110.468 -179.219 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 76' ' ' TYR . . . . . 0.462 ' CZ ' HD11 ' A' ' 72' ' ' ILE . 2.1 m-30 -71.78 -46.36 58.57 Favored 'General case' 0 N--CA 1.455 -0.203 0 CA-C-N 118.427 0.558 . . . . 0.0 110.847 176.65 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -65.07 -41.21 95.3 Favored 'General case' 0 N--CA 1.45 -0.432 0 C-N-CA 118.427 -1.309 . . . . 0.0 107.896 -178.357 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 94.3 m-20 -65.55 -42.54 91.76 Favored 'General case' 0 C--O 1.23 0.064 0 N-CA-C 113.377 0.88 . . . . 0.0 113.377 178.161 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 15.5 tm-20 -64.29 -41.86 96.68 Favored 'General case' 0 N--CA 1.448 -0.541 0 CA-C-N 118.45 0.568 . . . . 0.0 110.746 178.322 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 80' ' ' THR . . . . . 0.45 HG21 ' HB3' ' A' ' 94' ' ' CYS . 71.5 p -74.36 -21.34 59.72 Favored 'General case' 0 N--CA 1.456 -0.146 0 CA-C-O 119.783 -0.151 . . . . 0.0 111.057 -179.737 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 64.6 mtt180 -68.35 -36.81 79.8 Favored 'General case' 0 CA--C 1.526 0.054 0 N-CA-C 109.835 -0.432 . . . . 0.0 109.835 169.124 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 35.4 t -88.37 -8.45 55.04 Favored 'General case' 0 N--CA 1.457 -0.105 0 C-N-CA 123.958 0.903 . . . . 0.0 113.226 -176.19 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 33.8 t-20 -130.59 156.32 45.06 Favored 'General case' 0 N--CA 1.456 -0.154 0 CA-C-N 118.047 0.385 . . . . 0.0 111.346 -171.767 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 37.7 t -82.09 7.87 12.29 Favored 'General case' 0 N--CA 1.452 -0.345 0 C-N-CA 123.464 0.706 . . . . 0.0 111.895 -177.985 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 48.2 p30 -77.11 1.47 18.07 Favored 'General case' 0 CA--C 1.533 0.303 0 C-N-CA 122.69 0.396 . . . . 0.0 111.754 -179.733 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 41.4 t -55.88 145.23 25.4 Favored 'General case' 0 N--CA 1.456 -0.171 0 CA-C-O 120.594 0.235 . . . . 0.0 110.531 -179.634 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 67.5 m -152.98 -179.93 8.11 Favored 'General case' 0 N--CA 1.456 -0.154 0 C-N-CA 123.305 0.642 . . . . 0.0 109.955 -174.405 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 79.0 p -148.52 -2.72 0.49 Allowed 'General case' 0 N--CA 1.454 -0.252 0 N-CA-C 111.959 0.355 . . . . 0.0 111.959 178.724 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 10.7 m120 -147.96 32.02 0.85 Allowed 'General case' 0 CA--C 1.531 0.215 0 C-N-CA 122.655 0.382 . . . . 0.0 111.216 -174.932 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 49.4 tttm -142.4 127.69 10.35 Favored Pre-proline 0 CA--C 1.53 0.197 0 CA-C-O 119.282 -0.39 . . . . 0.0 111.398 -176.356 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 71.9 Cg_endo -71.97 143.0 39.79 Favored 'Trans proline' 0 N--CA 1.451 -1.012 0 C-N-CA 122.869 2.38 . . . . 0.0 106.435 168.657 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 92' ' ' GLY . . . . . 0.449 ' HA2' ' O ' ' A' ' 40' ' ' ILE . . . 105.98 24.98 6.66 Favored Glycine 0 CA--C 1.527 0.81 0 C-N-CA 120.386 -0.911 . . . . 0.0 112.436 -172.902 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 37.9 p -153.94 171.93 18.22 Favored 'General case' 0 CA--C 1.522 -0.121 0 CA-C-N 117.908 0.854 . . . . 0.0 109.951 177.09 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 94' ' ' CYS . . . . . 0.454 ' HB2' HD13 ' A' ' 98' ' ' ILE . 19.6 p -62.24 -22.46 65.99 Favored 'General case' 0 N--CA 1.448 -0.541 0 N-CA-C 109.183 -0.673 . . . . 0.0 109.183 176.381 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -63.16 -58.03 8.59 Favored 'General case' 0 N--CA 1.445 -0.691 0 N-CA-C 109.352 -0.61 . . . . 0.0 109.352 -175.609 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 65.2 t60 -71.51 -33.38 69.16 Favored 'General case' 0 N--CA 1.45 -0.459 0 N-CA-C 110.228 -0.286 . . . . 0.0 110.228 -179.973 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -65.88 -53.95 32.96 Favored 'General case' 0 N--CA 1.448 -0.537 0 CA-C-O 119.831 -0.128 . . . . 0.0 111.104 -176.741 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 98' ' ' ILE . . . . . 0.454 HD13 ' HB2' ' A' ' 94' ' ' CYS . 2.5 mp -70.29 -29.57 39.78 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.336 0 C-N-CA 120.474 -0.49 . . . . 0.0 110.926 -178.375 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 13.4 m-80 -70.45 -38.15 74.44 Favored 'General case' 0 N--CA 1.456 -0.165 0 CA-C-N 118.737 0.698 . . . . 0.0 111.522 176.53 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 89.2 m -67.18 -31.93 72.66 Favored 'General case' 0 CA--C 1.519 -0.221 0 N-CA-C 109.577 -0.527 . . . . 0.0 109.577 179.528 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 83.5 mt -72.22 -42.15 66.05 Favored 'General case' 0 N--CA 1.446 -0.656 0 N-CA-C 109.124 -0.695 . . . . 0.0 109.124 174.874 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -59.38 -14.66 28.0 Favored Glycine 0 CA--C 1.526 0.76 0 CA-C-O 119.155 -0.803 . . . . 0.0 112.849 -177.392 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 21.6 pt-20 -104.28 -2.93 24.91 Favored 'General case' 0 CA--C 1.533 0.289 0 CA-C-N 118.557 1.178 . . . . 0.0 113.502 -177.56 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 34.9 m -143.58 -7.6 0.27 Allowed 'Isoleucine or valine' 0 N--CA 1.466 0.325 0 CA-C-N 118.977 0.808 . . . . 0.0 113.133 176.557 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 105' ' ' ILE . . . . . . . . . . . . . 10.8 tp -64.39 -24.87 36.64 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.169 0 CA-C-N 118.741 0.7 . . . . 0.0 111.018 -176.339 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 106' ' ' GLN . . . . . 0.405 ' HA ' ' CD1' ' A' ' 145' ' ' ILE . 23.0 pt20 -69.72 -40.36 76.28 Favored 'General case' 0 N--CA 1.452 -0.33 0 CA-C-O 119.557 -0.258 . . . . 0.0 111.299 -175.591 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 76.4 mm-40 -80.1 -24.97 40.2 Favored 'General case' 0 N--CA 1.453 -0.313 0 CA-C-N 118.401 0.546 . . . . 0.0 110.8 175.958 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 9.1 tt -68.2 -41.62 81.1 Favored 'General case' 0 N--CA 1.452 -0.337 0 N-CA-C 108.908 -0.775 . . . . 0.0 108.908 177.195 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 55.6 mt -68.91 -52.25 31.42 Favored 'General case' 0 N--CA 1.453 -0.298 0 N-CA-C 109.016 -0.735 . . . . 0.0 109.016 174.893 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 34.5 t -42.28 -48.67 5.02 Favored 'General case' 0 C--O 1.234 0.24 0 C-N-CA 123.455 0.702 . . . . 0.0 112.527 175.333 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 35.6 t0 -67.8 -41.25 83.46 Favored 'General case' 0 N--CA 1.455 -0.224 0 N-CA-C 109.937 -0.394 . . . . 0.0 109.937 179.26 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -67.69 -32.94 73.95 Favored 'General case' 0 N--CA 1.446 -0.674 0 C-N-CA 120.848 -0.341 . . . . 0.0 110.794 -176.981 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 113' ' ' ILE . . . . . . . . . . . . . 40.9 mm -70.21 -38.82 75.8 Favored 'Isoleucine or valine' 0 C--N 1.339 0.144 0 CA-C-N 118.474 0.579 . . . . 0.0 109.941 178.766 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -74.27 -47.73 33.09 Favored 'General case' 0 N--CA 1.453 -0.322 0 N-CA-C 111.469 0.174 . . . . 0.0 111.469 179.792 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 115' ' ' LYS . . . . . 0.408 ' HE3' ' HB2' ' A' ' 115' ' ' LYS . 30.4 ttmt -76.98 -30.83 56.14 Favored 'General case' 0 N--CA 1.452 -0.331 0 C-N-CA 124.262 1.025 . . . . 0.0 113.619 -172.492 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 116' ' ' SER . . . . . 0.458 ' HA ' ' HB2' ' A' ' 59' ' ' ASP . 1.5 m -90.05 150.57 22.04 Favored 'General case' 0 CA--C 1.528 0.134 0 CA-C-N 118.177 0.444 . . . . 0.0 111.383 -174.185 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 19.1 t30 -71.21 169.31 15.42 Favored 'General case' 0 C--O 1.225 -0.213 0 C-N-CA 122.802 0.441 . . . . 0.0 110.685 -174.2 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 118' ' ' GLN . . . . . . . . . . . . . 17.1 mt-30 -55.39 -36.23 66.17 Favored 'General case' 0 CA--C 1.528 0.103 0 N-CA-C 111.947 0.351 . . . . 0.0 111.947 -173.616 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -66.59 -34.29 77.56 Favored 'General case' 0 N--CA 1.456 -0.14 0 N-CA-C 109.64 -0.504 . . . . 0.0 109.64 178.331 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 120' ' ' HIS . . . . . 0.455 ' CB ' ' HB3' ' A' ' 116' ' ' SER . 19.4 m170 -75.48 -41.3 55.86 Favored 'General case' 0 N--CA 1.448 -0.549 0 N-CA-C 109.178 -0.675 . . . . 0.0 109.178 179.07 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 49.4 mttm -54.75 -43.6 72.86 Favored 'General case' 0 N--CA 1.456 -0.165 0 N-CA-C 108.824 -0.806 . . . . 0.0 108.824 177.2 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 39.1 tp10 -66.17 -41.81 89.82 Favored 'General case' 0 N--CA 1.454 -0.266 0 CA-C-O 119.62 -0.228 . . . . 0.0 110.633 -179.269 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 88.9 mttt -66.6 -28.64 68.66 Favored 'General case' 0 N--CA 1.452 -0.342 0 C-N-CA 119.721 -0.792 . . . . 0.0 111.112 178.801 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 124' ' ' ILE . . . . . . . . . . . . . 58.1 mt -72.27 -38.22 61.1 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.198 0 CA-C-N 118.52 0.6 . . . . 0.0 109.897 177.906 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 27.9 mmt180 -64.62 -40.37 95.36 Favored 'General case' 0 N--CA 1.455 -0.216 0 O-C-N 121.887 -0.508 . . . . 0.0 110.819 -179.744 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 126' ' ' MET . . . . . . . . . . . . . 28.3 ptm -71.8 -30.69 65.79 Favored 'General case' 0 CA--C 1.528 0.117 0 C-N-CA 120.181 -0.608 . . . . 0.0 110.827 -179.648 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 66.7 mt -64.74 -35.85 82.4 Favored 'General case' 0 N--CA 1.456 -0.128 0 CA-C-N 118.392 0.542 . . . . 0.0 110.103 175.347 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 95.4 mt -69.4 -35.74 76.07 Favored 'General case' 0 CA--C 1.529 0.159 0 CA-C-N 118.193 0.451 . . . . 0.0 110.64 178.12 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 14.9 t0 -63.29 -44.52 94.8 Favored 'General case' 0 N--CA 1.456 -0.172 0 N-CA-C 109.367 -0.605 . . . . 0.0 109.367 176.368 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 65.4 mt -60.93 -34.27 58.95 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.251 0 N-CA-C 109.993 -0.373 . . . . 0.0 109.993 -179.981 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 131' ' ' TRP . . . . . . . . . . . . . 43.4 m0 -75.31 -33.1 61.13 Favored 'General case' 0 N--CA 1.452 -0.334 0 C-N-CA 120.057 -0.657 . . . . 0.0 112.617 -179.271 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 94.2 m-20 -74.64 -27.42 60.43 Favored 'General case' 0 N--CA 1.454 -0.25 0 CA-C-N 118.352 0.524 . . . . 0.0 111.171 178.651 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 133' ' ' ARG . . . . . 0.509 HH21 ' C ' ' B' 2063 ' ' SER . 13.4 mtp180 -72.58 -35.74 68.01 Favored 'General case' 0 N--CA 1.456 -0.154 0 N-CA-C 109.097 -0.705 . . . . 0.0 109.097 174.557 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 38.1 t -76.88 -14.62 59.86 Favored 'General case' 0 CA--C 1.533 0.317 0 C-N-CA 122.969 0.508 . . . . 0.0 111.138 176.856 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 135' ' ' GLY . . . . . . . . . . . . . . . 82.64 16.14 71.53 Favored Glycine 0 CA--C 1.53 0.992 0 CA-C-O 118.929 -0.928 . . . . 0.0 114.579 172.659 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 136' ' ' LEU . . . . . . . . . . . . . 9.4 mp -70.99 168.19 17.57 Favored 'General case' 0 CA--C 1.537 0.46 0 CA-C-N 119.16 1.48 . . . . 0.0 110.42 178.931 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 137' ' ' PHE . . . . . . . . . . . . . 8.4 m-30 -83.55 12.34 5.82 Favored 'General case' 0 CA--C 1.533 0.317 0 N-CA-C 115.636 1.717 . . . . 0.0 115.636 -169.103 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 138' ' ' GLN . . . . . . . . . . . . . 27.2 mp0 -73.07 31.88 0.07 Allowed 'General case' 0 CA--C 1.537 0.459 0 CA-C-N 120.231 1.378 . . . . 0.0 112.384 178.866 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 139' ' ' LYS . . . . . . . . . . . . . 45.9 mmtm -73.8 15.96 0.25 Allowed 'General case' 0 CA--C 1.532 0.271 0 C-N-CA 124.384 1.073 . . . . 0.0 112.403 -177.894 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 140' ' ' SER . . . . . 0.402 ' C ' ' H ' ' A' ' 142' ' ' LEU . 95.8 p -75.35 63.31 1.4 Allowed 'General case' 0 N--CA 1.455 -0.198 0 C-N-CA 123.97 0.908 . . . . 0.0 110.406 179.007 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 141' ' ' TYR . . . . . . . . . . . . . 42.7 m-85 -67.23 27.52 0.02 OUTLIER 'General case' 0 CA--C 1.533 0.311 0 C-N-CA 124.267 1.027 . . . . 0.0 113.312 -179.583 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 142' ' ' LEU . . . . . 0.402 ' H ' ' C ' ' A' ' 140' ' ' SER . 76.1 mt -70.13 168.22 16.09 Favored 'General case' 0 N--CA 1.451 -0.39 0 CA-C-N 118.045 0.384 . . . . 0.0 110.553 -178.316 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 4.3 m120 -57.58 -15.05 6.27 Favored 'General case' 0 C--O 1.231 0.129 0 C-N-CA 123.055 0.542 . . . . 0.0 111.36 179.609 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . -61.45 -40.66 95.31 Favored 'General case' 0 N--CA 1.449 -0.513 0 N-CA-C 109.328 -0.619 . . . . 0.0 109.328 177.101 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 145' ' ' ILE . . . . . 0.405 ' CD1' ' HA ' ' A' ' 106' ' ' GLN . 17.3 mm -75.55 -24.1 16.99 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.219 0 CA-C-N 118.234 0.47 . . . . 0.0 110.393 -178.273 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 146' ' ' ARG . . . . . 0.402 HH21 ' CE1' ' A' ' 157' ' ' HIS . 16.9 tpt180 -74.71 -14.82 60.78 Favored 'General case' 0 N--CA 1.455 -0.223 0 N-CA-C 109.17 -0.678 . . . . 0.0 109.17 171.717 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 147' ' ' SER . . . . . . . . . . . . . 25.2 t 61.87 72.12 0.52 Allowed 'General case' 0 N--CA 1.452 -0.358 0 C-N-CA 125.351 1.46 . . . . 0.0 110.822 178.699 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 148' ' ' LYS . . . . . 0.623 ' HD3' ' H ' ' A' ' 148' ' ' LYS . 0.0 OUTLIER -46.99 -26.43 1.01 Allowed 'General case' 0 N--CA 1.452 -0.355 0 CA-C-N 114.532 -1.213 . . . . 0.0 111.861 174.282 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 149' ' ' CYS . . . . . . . . . . . . . 50.5 t -69.6 -48.96 58.31 Favored 'General case' 0 N--CA 1.452 -0.332 0 N-CA-C 109.291 -0.633 . . . . 0.0 109.291 179.04 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 150' ' ' PHE . . . . . . . . . . . . . 33.2 t80 -63.94 -28.82 70.08 Favored 'General case' 0 N--CA 1.453 -0.302 0 N-CA-C 110.449 -0.204 . . . . 0.0 110.449 -178.074 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 151' ' ' ALA . . . . . . . . . . . . . . . -75.64 -27.32 58.35 Favored 'General case' 0 N--CA 1.452 -0.374 0 C-N-CA 122.692 0.397 . . . . 0.0 111.226 177.545 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 152' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER -83.05 -27.17 30.49 Favored 'General case' 0 N--CA 1.455 -0.179 0 O-C-N 122.233 -0.292 . . . . 0.0 110.43 173.85 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 153' ' ' ASP . . . . . . . . . . . . . 69.0 m-20 -74.58 -44.2 51.99 Favored 'General case' 0 N--CA 1.454 -0.253 0 C-N-CA 123.024 0.529 . . . . 0.0 111.022 178.175 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 154' ' ' LEU . . . . . . . . . . . . . 47.4 mt -143.82 155.77 44.25 Favored 'General case' 0 C--N 1.339 0.124 0 C-N-CA 123.886 0.874 . . . . 0.0 110.59 -179.457 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 155' ' ' GLU . . . . . . . . . . . . . 37.3 mp0 -75.14 13.78 0.65 Allowed 'General case' 0 CA--C 1.531 0.217 0 C-N-CA 123.667 0.787 . . . . 0.0 111.73 -179.905 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 156' ' ' HIS . . . . . . . . . . . . . 39.9 m170 -68.59 137.66 54.44 Favored 'General case' 0 N--CA 1.454 -0.27 0 CA-C-O 121.003 0.43 . . . . 0.0 112.004 -175.487 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 157' ' ' HIS . . . . . 0.402 ' CE1' HH21 ' A' ' 146' ' ' ARG . 85.9 t60 -143.67 1.88 1.2 Allowed 'General case' 0 CA--C 1.529 0.143 0 C-N-CA 123.66 0.784 . . . . 0.0 110.534 178.457 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 158' ' ' HIS . . . . . . . . . . . . . 40.7 p-80 -79.59 40.43 0.44 Allowed 'General case' 0 CA--C 1.53 0.211 0 C-N-CA 123.873 0.869 . . . . 0.0 110.396 178.068 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 159' ' ' HIS . . . . . . . . . . . . . 32.0 p80 . . . . . 0 C--O 1.249 1.037 0 CA-C-O 117.558 -1.21 . . . . 0.0 109.721 -176.631 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' B' B 2052 ' ' ASP . . . . . 0.445 ' HA ' ' OD1' ' B' 2056 ' ' ASP . 1.5 m-20 . . . . . 0 N--CA 1.471 0.615 0 CA-C-O 119.397 -0.335 . . . . 0.0 110.248 . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B 2053 ' ' ASP . . . . . . . . . . . . . 5.7 m-20 -118.72 -28.8 5.54 Favored 'General case' 0 CA--C 1.531 0.218 0 O-C-N 123.344 0.402 . . . . 0.0 111.219 -178.662 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B 2054 ' ' ASP . . . . . . . . . . . . . 67.7 t0 -166.47 89.31 0.38 Allowed 'General case' 0 CA--C 1.53 0.205 0 CA-C-N 118.092 0.405 . . . . 0.0 110.851 -177.965 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B 2055 ' ' GLU . . . . . . . . . . . . . 68.1 tt0 53.34 45.51 28.28 Favored 'General case' 0 CA--C 1.531 0.243 0 C-N-CA 123.731 0.812 . . . . 0.0 111.766 177.113 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B 2056 ' ' ASP . . . . . 0.445 ' OD1' ' HA ' ' B' 2052 ' ' ASP . 1.0 OUTLIER -66.1 16.15 0.03 OUTLIER 'General case' 0 CA--C 1.534 0.365 0 N-CA-C 114.769 1.396 . . . . 0.0 114.769 -175.98 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B 2057 ' ' ASP . . . . . . . . . . . . . 27.3 t0 -153.04 65.71 0.78 Allowed 'General case' 0 N--CA 1.455 -0.205 0 CA-C-N 119.385 0.993 . . . . 0.0 111.723 175.252 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B 2058 ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -52.33 124.96 14.58 Favored 'General case' 0 N--CA 1.453 -0.293 0 N-CA-C 108.435 -0.95 . . . . 0.0 108.435 173.467 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B 2059 ' ' THR . . . . . . . . . . . . . 55.1 m -108.75 110.02 61.2 Favored Pre-proline 0 N--CA 1.453 -0.315 0 N-CA-C 109.214 -0.662 . . . . 0.0 109.214 -177.881 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B 2060 ' ' PRO . . . . . . . . . . . . . 31.6 Cg_exo -61.52 166.81 10.83 Favored 'Trans proline' 0 N--CA 1.452 -0.955 0 C-N-CA 123.574 2.85 . . . . 0.0 112.155 177.51 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B 2061 ' ' SER . . . . . . . . . . . . . 72.4 m -147.72 134.21 19.73 Favored 'General case' 0 N--CA 1.452 -0.352 0 N-CA-C 107.844 -1.169 . . . . 0.0 107.844 175.19 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B 2062 ' ' ILE . . . . . . . . . . . . . 19.0 tt -163.06 152.65 3.16 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.219 0 CA-C-O 120.492 0.187 . . . . 0.0 110.599 -176.256 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B 2063 ' ' SER . . . . . 0.509 ' C ' HH21 ' A' ' 133' ' ' ARG . 40.8 m . . . . . 0 C--O 1.247 0.972 0 CA-C-O 116.917 -1.516 . . . . 0.0 109.703 175.846 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 4.0 mpp? . . . . . 0 N--CA 1.472 0.632 0 N-CA-C 110.078 -0.341 . . . . 0.0 110.078 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 4.4 pm0 -152.16 -28.04 0.17 Allowed 'General case' 0 N--CA 1.454 -0.262 0 CA-C-N 116.846 -0.161 . . . . 0.0 111.289 179.955 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 3' ' ' GLN . . . . . 0.444 ' C ' ' H ' ' A' ' 5' ' ' ASP . 46.7 tp60 -157.01 24.41 0.31 Allowed 'General case' 0 N--CA 1.454 -0.253 0 CA-C-O 121.739 0.78 . . . . 0.0 108.919 178.205 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 4' ' ' ASP . . . . . 0.408 ' N ' ' OD1' ' A' ' 4' ' ' ASP . 0.1 OUTLIER -75.31 29.58 0.1 Allowed 'General case' 0 N--CA 1.454 -0.24 0 C-N-CA 125.377 1.471 . . . . 0.0 110.684 -178.247 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 5' ' ' ASP . . . . . 0.444 ' H ' ' C ' ' A' ' 3' ' ' GLN . 48.0 m-20 57.85 18.55 5.03 Favored 'General case' 0 N--CA 1.455 -0.191 0 C-N-CA 125.167 1.387 . . . . 0.0 110.378 -168.291 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 20.7 p-10 -78.61 -26.65 45.41 Favored 'General case' 0 N--CA 1.449 -0.488 0 CA-C-N 115.196 -0.911 . . . . 0.0 108.928 175.806 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 7' ' ' PHE . . . . . 0.474 ' CD1' ' HD3' ' A' ' 45' ' ' LYS . 1.5 t80 -49.73 -39.6 37.87 Favored 'General case' 0 N--CA 1.456 -0.145 0 C-N-CA 124.028 0.931 . . . . 0.0 110.089 177.416 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 50.8 tp60 -51.79 -34.63 40.67 Favored 'General case' 0 N--CA 1.455 -0.189 0 C-N-CA 124.061 0.944 . . . . 0.0 111.919 -177.183 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 30.7 m-80 -74.2 -30.7 62.33 Favored 'General case' 0 N--CA 1.451 -0.394 0 N-CA-C 109.916 -0.401 . . . . 0.0 109.916 -179.175 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 10' ' ' PHE . . . . . 0.42 ' CE2' ' HB2' ' A' ' 32' ' ' LEU . 3.2 t80 -71.04 -38.99 72.53 Favored 'General case' 0 N--CA 1.451 -0.414 0 N-CA-C 109.125 -0.695 . . . . 0.0 109.125 176.221 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 65.2 t -64.69 -56.47 15.85 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.307 0 N-CA-C 108.948 -0.76 . . . . 0.0 108.948 178.409 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -59.49 -27.17 65.89 Favored 'General case' 0 N--CA 1.451 -0.393 0 C-N-CA 123.109 0.564 . . . . 0.0 112.247 -179.933 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 81.8 m -73.38 -41.4 63.42 Favored 'General case' 0 N--CA 1.456 -0.162 0 CA-C-N 118.785 0.721 . . . . 0.0 109.262 177.163 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.498 ' HA ' ' CD1' ' A' ' 17' ' ' PHE . 11.8 tp -64.06 -48.0 77.94 Favored 'General case' 0 N--CA 1.452 -0.345 0 CA-C-O 121.357 0.599 . . . . 0.0 109.643 177.728 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 61.7 mm-40 -62.33 -30.48 71.19 Favored 'General case' 0 N--CA 1.452 -0.359 0 C-N-CA 124.209 1.003 . . . . 0.0 109.886 179.303 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 31.4 t -67.84 -31.42 71.24 Favored 'General case' 0 N--CA 1.45 -0.458 0 CA-C-O 119.011 -0.519 . . . . 0.0 110.033 177.476 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 17' ' ' PHE . . . . . 0.498 ' CD1' ' HA ' ' A' ' 14' ' ' LEU . 13.8 m-85 -67.85 -39.91 83.74 Favored 'General case' 0 C--N 1.339 0.132 0 CA-C-N 118.495 0.589 . . . . 0.0 110.439 172.999 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 18' ' ' LYS . . . . . 0.442 ' HG2' ' CE1' ' A' ' 53' ' ' TYR . 65.8 mttt -64.8 -27.88 69.19 Favored 'General case' 0 C--N 1.338 0.106 0 CA-C-O 120.468 0.175 . . . . 0.0 110.864 -178.008 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 36.3 t0 -75.29 -14.72 60.52 Favored 'General case' 0 CA--C 1.533 0.293 0 C-N-CA 123.634 0.774 . . . . 0.0 112.186 179.865 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 48.7 mt -77.12 168.84 19.39 Favored 'General case' 0 N--CA 1.457 -0.124 0 O-C-N 121.714 -0.616 . . . . 0.0 111.758 -178.992 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 8.3 mtmp? -99.41 -27.19 13.86 Favored 'General case' 0 N--CA 1.455 -0.215 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.049 174.698 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 80.7 p -90.56 -25.33 20.27 Favored 'General case' 0 CA--C 1.529 0.167 0 C-N-CA 122.913 0.485 . . . . 0.0 110.597 176.03 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 77.47 -22.28 2.7 Favored Glycine 0 CA--C 1.529 0.93 0 C-N-CA 123.631 0.634 . . . . 0.0 113.793 176.155 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 66.6 mt -84.72 151.86 3.76 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.215 0 CA-C-N 118.086 0.943 . . . . 0.0 108.912 172.927 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 5.1 t -159.09 79.84 0.76 Allowed 'General case' 0 N--CA 1.453 -0.312 0 CA-C-N 118.46 0.573 . . . . 0.0 110.895 -179.52 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 26' ' ' GLY . . . . . 0.442 ' O ' ' HE2' ' A' ' 30' ' ' LYS . . . -47.11 -51.22 14.56 Favored Glycine 0 CA--C 1.524 0.606 0 CA-C-O 118.932 -0.927 . . . . 0.0 114.059 -171.954 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 14.6 m -63.98 -49.04 74.04 Favored 'General case' 0 CA--C 1.52 -0.19 0 CA-C-N 119.044 1.422 . . . . 0.0 110.647 -175.511 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 15.2 mtm180 -70.38 -34.04 72.11 Favored 'General case' 0 C--O 1.234 0.26 0 CA-C-O 119.704 -0.189 . . . . 0.0 111.128 -176.737 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 29' ' ' ILE . . . . . 0.41 HG12 ' CG1' ' A' ' 68' ' ' ILE . 54.4 mt -58.73 -45.84 90.89 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.592 0 N-CA-C 108.006 -1.109 . . . . 0.0 108.006 173.133 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 30' ' ' LYS . . . . . 0.442 ' HE2' ' O ' ' A' ' 26' ' ' GLY . 53.1 mtmt -67.25 -23.6 65.72 Favored 'General case' 0 CA--C 1.529 0.166 0 CA-C-O 118.776 -0.63 . . . . 0.0 111.592 178.579 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 31' ' ' LYS . . . . . 0.593 ' HE2' ' HA ' ' A' ' 31' ' ' LYS . 8.4 mmpt? -67.85 -58.39 4.66 Favored 'General case' 0 C--N 1.342 0.25 0 CA-C-N 119.218 0.917 . . . . 0.0 110.595 178.047 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.467 HD12 ' N ' ' A' ' 33' ' ' THR . 1.8 pp -74.94 -17.32 60.58 Favored 'General case' 0 CA--C 1.531 0.247 0 C-N-CA 119.286 -0.966 . . . . 0.0 111.552 -177.329 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 33' ' ' THR . . . . . 0.467 ' N ' HD12 ' A' ' 32' ' ' LEU . 54.2 m -74.44 -38.13 63.1 Favored 'General case' 0 N--CA 1.455 -0.225 0 N-CA-C 109.509 -0.552 . . . . 0.0 109.509 177.211 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 98.4 m -73.15 -38.07 66.37 Favored 'General case' 0 N--CA 1.45 -0.46 0 N-CA-C 110.153 -0.314 . . . . 0.0 110.153 -178.555 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 27.3 t80 -64.23 -37.08 86.21 Favored 'General case' 0 N--CA 1.456 -0.149 0 N-CA-C 109.942 -0.392 . . . . 0.0 109.942 175.997 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -72.03 -38.63 69.51 Favored 'General case' 0 N--CA 1.448 -0.529 0 CA-C-O 119.462 -0.304 . . . . 0.0 111.429 178.081 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 9.9 mt -67.71 -36.1 80.0 Favored 'General case' 0 C--O 1.231 0.1 0 CA-C-N 118.217 0.462 . . . . 0.0 110.796 -179.757 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 42.6 t0 -71.0 -20.03 62.46 Favored 'General case' 0 N--CA 1.453 -0.291 0 C-N-CA 122.451 0.3 . . . . 0.0 111.358 177.199 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 39' ' ' HIS . . . . . 0.403 ' HB2' HD11 ' A' ' 42' ' ' ILE . 97.9 m-70 -148.69 97.74 2.77 Favored 'General case' 0 C--N 1.339 0.125 0 C-N-CA 122.852 0.461 . . . . 0.0 111.34 -175.036 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 40' ' ' ILE . . . . . 0.61 ' H ' HD13 ' A' ' 40' ' ' ILE . 0.0 OUTLIER -76.02 -12.29 14.42 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.454 0 C-N-CA 123.205 0.602 . . . . 0.0 110.866 176.551 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 19.7 m-20 -58.56 -21.11 51.73 Favored 'General case' 0 C--N 1.339 0.111 0 C-N-CA 122.925 0.49 . . . . 0.0 112.295 -176.793 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 42' ' ' ILE . . . . . 0.403 HD11 ' HB2' ' A' ' 39' ' ' HIS . 0.0 OUTLIER -104.1 12.93 7.61 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.208 0 C-N-CA 123.104 0.562 . . . . 0.0 112.211 178.353 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 2.9 pp20? -50.37 -33.32 20.09 Favored 'General case' 0 CA--C 1.53 0.21 0 CA-C-N 118.587 0.631 . . . . 0.0 111.766 -179.764 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 39.5 t -62.05 -49.93 74.01 Favored 'General case' 0 C--O 1.233 0.184 0 N-CA-C 111.912 0.338 . . . . 0.0 111.912 -178.047 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 45' ' ' LYS . . . . . 0.474 ' HD3' ' CD1' ' A' ' 7' ' ' PHE . 18.8 ptpt -70.98 -28.18 64.26 Favored 'General case' 0 C--N 1.339 0.128 0 O-C-N 121.85 -0.531 . . . . 0.0 109.778 -179.531 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 46' ' ' ILE . . . . . 0.414 HG12 ' CZ ' ' A' ' 10' ' ' PHE . 88.1 mt -68.7 -45.03 81.92 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.205 0 N-CA-C 110.049 -0.352 . . . . 0.0 110.049 -178.559 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 30.5 mm -62.72 -36.58 75.97 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.257 0 N-CA-C 109.024 -0.732 . . . . 0.0 109.024 177.309 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 39.4 t -64.63 -31.74 73.1 Favored 'General case' 0 CA--C 1.531 0.224 0 C-N-CA 120.984 -0.286 . . . . 0.0 111.729 179.023 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 6.7 mp -80.04 -31.97 39.5 Favored 'General case' 0 N--CA 1.451 -0.409 0 N-CA-C 113.265 0.839 . . . . 0.0 113.265 -179.698 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 12.5 pt -72.32 -38.46 61.45 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.207 0 CA-C-N 119.874 1.215 . . . . 0.0 110.708 177.558 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 24.4 pt -68.62 -35.22 69.13 Favored 'Isoleucine or valine' 0 CA--C 1.528 0.115 0 C-N-CA 120.336 -0.545 . . . . 0.0 110.032 176.981 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 21.0 t70 -59.3 -53.25 60.39 Favored 'General case' 0 C--N 1.339 0.134 0 CA-C-N 118.417 0.553 . . . . 0.0 110.053 174.858 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 53' ' ' TYR . . . . . 0.442 ' CE1' ' HG2' ' A' ' 18' ' ' LYS . 8.5 t80 -61.63 -44.53 96.81 Favored 'General case' 0 N--CA 1.451 -0.422 0 N-CA-C 109.836 -0.431 . . . . 0.0 109.836 -177.323 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 15.5 m -71.14 -23.03 62.0 Favored 'General case' 0 N--CA 1.453 -0.305 0 N-CA-C 112.196 0.443 . . . . 0.0 112.196 -175.264 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 18.4 tpp180 -84.11 -38.33 20.88 Favored 'General case' 0 N--CA 1.455 -0.216 0 CA-C-N 118.219 0.463 . . . . 0.0 110.642 179.359 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 95.9 mt -85.01 -50.01 7.82 Favored 'General case' 0 N--CA 1.452 -0.333 0 N-CA-C 113.188 0.81 . . . . 0.0 113.188 -175.884 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 5.8 p -66.33 153.87 91.71 Favored Pre-proline 0 CA--C 1.534 0.358 0 N-CA-C 113.647 0.981 . . . . 0.0 113.647 -170.39 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 67.8 Cg_endo -76.87 -170.72 0.96 Allowed 'Trans proline' 0 N--CA 1.455 -0.741 0 C-N-CA 124.837 3.691 . . . . 0.0 111.474 178.866 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 23.6 p-10 -53.82 -60.0 3.89 Favored 'General case' 0 CA--C 1.53 0.189 0 N-CA-C 114.55 1.315 . . . . 0.0 114.55 -170.732 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 22.6 t -67.64 -32.48 73.21 Favored 'General case' 0 N--CA 1.456 -0.134 0 CA-C-N 118.038 0.381 . . . . 0.0 110.947 -173.679 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 39.4 m80 -72.46 -26.55 61.86 Favored 'General case' 0 N--CA 1.453 -0.279 0 N-CA-C 110.035 -0.357 . . . . 0.0 110.035 177.131 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 17.1 ttmt -75.59 -28.52 58.96 Favored 'General case' 0 N--CA 1.451 -0.391 0 N-CA-C 110.113 -0.328 . . . . 0.0 110.113 177.041 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -65.05 -44.36 89.3 Favored 'General case' 0 N--CA 1.454 -0.227 0 N-CA-C 107.479 -1.304 . . . . 0.0 107.479 172.312 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -68.93 -25.3 75.42 Favored Glycine 0 C--N 1.34 0.758 0 N-CA-C 111.398 -0.681 . . . . 0.0 111.398 178.532 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 22.8 t -72.97 -40.32 65.42 Favored 'General case' 0 N--CA 1.452 -0.352 0 CA-C-N 117.782 0.791 . . . . 0.0 109.977 175.843 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 60.0 mt -68.57 -27.39 66.03 Favored 'General case' 0 N--CA 1.452 -0.342 0 N-CA-C 109.813 -0.44 . . . . 0.0 109.813 177.892 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 3.0 m-30 -66.01 -41.39 91.05 Favored 'General case' 0 CA--C 1.518 -0.269 0 N-CA-C 109.918 -0.401 . . . . 0.0 109.918 171.839 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 68' ' ' ILE . . . . . 0.41 ' CG1' HG12 ' A' ' 29' ' ' ILE . 21.0 mt -67.24 -45.32 86.49 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.585 0 N-CA-C 109.261 -0.644 . . . . 0.0 109.261 178.539 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 86.9 mt -58.87 -36.01 59.2 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.321 0 C-N-CA 123.273 0.629 . . . . 0.0 111.62 178.595 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 28.2 t70 -72.58 -40.82 66.29 Favored 'General case' 0 CA--C 1.517 -0.302 0 CA-C-N 119.015 0.825 . . . . 0.0 109.309 174.007 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 42.3 m -59.58 -66.63 0.48 Allowed 'General case' 0 N--CA 1.448 -0.547 0 N-CA-C 108.926 -0.768 . . . . 0.0 108.926 -178.36 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 72' ' ' ILE . . . . . 0.461 HD11 ' CZ ' ' A' ' 76' ' ' TYR . 0.0 OUTLIER -73.98 -44.4 50.86 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.363 0 CA-C-N 117.845 0.293 . . . . 0.0 111.014 -176.372 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -72.22 -49.8 19.55 Favored Glycine 0 CA--C 1.521 0.446 0 N-CA-C 112.418 -0.273 . . . . 0.0 112.418 -171.207 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 7.8 tmm_? -79.38 -30.26 42.46 Favored 'General case' 0 N--CA 1.445 -0.711 0 C-N-CA 119.814 -0.754 . . . . 0.0 110.256 -176.95 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -70.36 -25.54 63.32 Favored 'General case' 0 C--N 1.342 0.268 0 C-N-CA 118.646 -1.222 . . . . 0.0 109.795 173.458 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 76' ' ' TYR . . . . . 0.461 ' CZ ' HD11 ' A' ' 72' ' ' ILE . 1.4 m-30 -64.84 -49.3 71.15 Favored 'General case' 0 CA--C 1.515 -0.373 0 CA-C-N 118.75 0.704 . . . . 0.0 109.811 175.023 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 77' ' ' LEU . . . . . 0.462 ' O ' HD13 ' A' ' 77' ' ' LEU . 2.2 tm? -66.2 -43.95 85.33 Favored 'General case' 0 N--CA 1.447 -0.587 0 C-N-CA 118.219 -1.393 . . . . 0.0 108.711 -178.892 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 88.2 m-20 -59.3 -46.27 89.02 Favored 'General case' 0 CA--C 1.529 0.171 0 N-CA-C 112.318 0.488 . . . . 0.0 112.318 178.895 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 15.1 tm-20 -67.44 -48.89 65.91 Favored 'General case' 0 N--CA 1.45 -0.428 0 CA-C-N 118.34 0.518 . . . . 0.0 112.034 -178.081 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 64.4 p -64.57 -26.98 68.65 Favored 'General case' 0 N--CA 1.456 -0.147 0 CA-C-N 117.709 0.232 . . . . 0.0 111.312 179.965 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 11.9 ttm105 -75.5 -30.73 59.94 Favored 'General case' 0 N--CA 1.451 -0.392 0 CA-C-N 117.757 0.253 . . . . 0.0 110.341 175.383 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 35.3 t -80.45 -38.01 30.83 Favored 'General case' 0 N--CA 1.455 -0.207 0 N-CA-C 112.408 0.521 . . . . 0.0 112.408 179.702 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 9.1 m-20 -134.06 147.87 50.97 Favored 'General case' 0 N--CA 1.454 -0.227 0 CA-C-O 120.742 0.306 . . . . 0.0 111.732 -170.405 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 77.9 p -86.29 119.8 26.95 Favored 'General case' 0 N--CA 1.454 -0.274 0 N-CA-C 109.72 -0.474 . . . . 0.0 109.72 177.719 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 22.9 p30 -156.55 26.58 0.34 Allowed 'General case' 0 N--CA 1.456 -0.16 0 C-N-CA 122.928 0.491 . . . . 0.0 110.662 179.964 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 20.9 m -60.76 144.34 52.59 Favored 'General case' 0 N--CA 1.452 -0.326 0 C-N-CA 122.719 0.407 . . . . 0.0 112.067 -175.05 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 90.6 p -78.32 172.98 12.8 Favored 'General case' 0 N--CA 1.451 -0.386 0 C-N-CA 123.475 0.71 . . . . 0.0 110.146 177.624 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 67.7 p -76.68 2.89 12.89 Favored 'General case' 0 CA--C 1.53 0.204 0 C-N-CA 123.389 0.676 . . . . 0.0 112.293 179.509 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 10.4 m120 -147.8 179.62 7.57 Favored 'General case' 0 N--CA 1.456 -0.165 0 CA-C-N 118.367 0.53 . . . . 0.0 110.113 -174.624 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 90' ' ' LYS . . . . . 0.444 ' N ' ' HD2' ' A' ' 91' ' ' PRO . 60.5 tttm -64.79 -51.01 60.68 Favored Pre-proline 0 CA--C 1.535 0.38 0 CA-C-O 118.716 -0.659 . . . . 0.0 111.582 177.878 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 91' ' ' PRO . . . . . 0.444 ' HD2' ' N ' ' A' ' 90' ' ' LYS . 73.5 Cg_endo -68.4 161.03 46.61 Favored 'Trans proline' 0 N--CA 1.455 -0.775 0 C-N-CA 122.46 2.107 . . . . 0.0 110.237 174.771 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 89.7 19.48 47.98 Favored Glycine 0 CA--C 1.527 0.79 0 CA-C-O 119.362 -0.688 . . . . 0.0 112.242 179.925 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 20.3 p -153.16 168.87 24.49 Favored 'General case' 0 CA--C 1.521 -0.162 0 CA-C-N 117.89 0.845 . . . . 0.0 110.75 178.052 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 94' ' ' CYS . . . . . 0.417 ' HB2' HD13 ' A' ' 98' ' ' ILE . 29.5 p -57.94 -23.67 54.56 Favored 'General case' 0 N--CA 1.449 -0.515 0 CA-C-N 115.698 -0.683 . . . . 0.0 110.176 174.402 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -58.95 -57.85 11.23 Favored 'General case' 0 N--CA 1.451 -0.42 0 N-CA-C 109.361 -0.607 . . . . 0.0 109.361 -177.339 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 62.2 t60 -75.74 -32.01 59.81 Favored 'General case' 0 N--CA 1.451 -0.376 0 C-N-CA 121.094 -0.242 . . . . 0.0 111.639 -179.506 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -65.36 -48.88 71.42 Favored 'General case' 0 N--CA 1.45 -0.457 0 O-C-N 122.959 0.162 . . . . 0.0 111.053 -178.895 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 98' ' ' ILE . . . . . 0.417 HD13 ' HB2' ' A' ' 94' ' ' CYS . 1.8 mp -74.44 -27.71 21.63 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.162 0 CA-C-O 119.507 -0.282 . . . . 0.0 110.583 -179.886 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 3.9 m120 -64.23 -48.9 74.05 Favored 'General case' 0 N--CA 1.452 -0.339 0 CA-C-N 118.605 0.639 . . . . 0.0 110.163 173.902 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 26.4 m -74.64 -27.52 60.48 Favored 'General case' 0 N--CA 1.456 -0.164 0 N-CA-C 110.553 -0.166 . . . . 0.0 110.553 -175.947 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 57.0 tp -75.46 -47.97 24.79 Favored 'General case' 0 N--CA 1.448 -0.534 0 N-CA-C 110.272 -0.27 . . . . 0.0 110.272 177.027 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -65.81 -14.48 60.84 Favored Glycine 0 CA--C 1.528 0.846 0 CA-C-O 119.521 -0.6 . . . . 0.0 113.063 -173.33 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 24.2 pt-20 -95.98 -7.51 36.25 Favored 'General case' 0 CA--C 1.531 0.229 0 CA-C-N 118.297 1.049 . . . . 0.0 112.5 -178.482 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 27.3 m -129.97 -14.3 2.12 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.147 0 CA-C-N 118.542 0.61 . . . . 0.0 112.264 176.911 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 105' ' ' ILE . . . . . . . . . . . . . 9.7 tp -61.24 -22.62 27.86 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.137 0 CA-C-N 118.473 0.579 . . . . 0.0 110.7 -179.938 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 22.9 pt20 -64.79 -33.06 75.08 Favored 'General case' 0 N--CA 1.452 -0.359 0 C-N-CA 122.912 0.485 . . . . 0.0 110.445 177.145 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 82.9 mt-10 -75.61 -36.04 60.37 Favored 'General case' 0 N--CA 1.455 -0.218 0 CA-C-O 120.769 0.319 . . . . 0.0 110.171 177.991 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 50.2 mt -75.37 -37.42 60.61 Favored 'General case' 0 N--CA 1.448 -0.549 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.925 -177.359 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 67.0 mt -69.55 -57.13 5.59 Favored 'General case' 0 N--CA 1.452 -0.361 0 N-CA-C 109.909 -0.404 . . . . 0.0 109.909 177.377 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 6.4 p -46.07 -53.35 10.39 Favored 'General case' 0 CA--C 1.522 -0.121 0 C-N-CA 122.606 0.362 . . . . 0.0 111.434 179.294 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 34.4 t0 -61.66 -43.74 98.29 Favored 'General case' 0 N--CA 1.443 -0.784 0 N-CA-C 109.987 -0.375 . . . . 0.0 109.987 -179.954 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -65.6 -32.92 74.76 Favored 'General case' 0 N--CA 1.446 -0.636 0 C-N-CA 120.038 -0.665 . . . . 0.0 110.895 -176.984 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 113' ' ' ILE . . . . . . . . . . . . . 27.8 mm -68.28 -41.55 83.83 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.115 0 CA-C-N 118.984 0.811 . . . . 0.0 109.944 179.931 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -75.95 -39.39 56.15 Favored 'General case' 0 N--CA 1.454 -0.268 0 N-CA-C 112.033 0.383 . . . . 0.0 112.033 -179.711 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 1.3 tppp? -77.13 -33.03 56.8 Favored 'General case' 0 N--CA 1.449 -0.477 0 C-N-CA 123.966 0.906 . . . . 0.0 113.148 -175.086 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 116' ' ' SER . . . . . 0.467 ' HB2' ' CB ' ' A' ' 120' ' ' HIS . 51.7 p -84.89 160.68 20.1 Favored 'General case' 0 CA--C 1.53 0.2 0 N-CA-C 111.952 0.353 . . . . 0.0 111.952 -174.082 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 48.9 t30 -80.03 167.71 20.09 Favored 'General case' 0 CA--C 1.534 0.349 0 C-N-CA 122.901 0.48 . . . . 0.0 110.445 -179.618 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 118' ' ' GLN . . . . . . . . . . . . . 24.6 mm100 -52.64 -42.83 65.01 Favored 'General case' 0 CA--C 1.529 0.144 0 N-CA-C 112.954 0.724 . . . . 0.0 112.954 -173.047 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 11.1 p-10 -66.39 -35.71 81.01 Favored 'General case' 0 N--CA 1.456 -0.165 0 N-CA-C 110.223 -0.288 . . . . 0.0 110.223 179.296 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 120' ' ' HIS . . . . . 0.467 ' CB ' ' HB2' ' A' ' 116' ' ' SER . 25.6 m170 -68.98 -41.65 77.6 Favored 'General case' 0 N--CA 1.451 -0.423 0 CA-C-N 116.416 -0.357 . . . . 0.0 110.092 177.351 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 45.9 mttm -58.57 -39.24 79.74 Favored 'General case' 0 C--N 1.34 0.184 0 N-CA-C 109.371 -0.603 . . . . 0.0 109.371 178.813 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 1.8 tm-20 -65.51 -46.0 81.34 Favored 'General case' 0 N--CA 1.452 -0.331 0 C-N-CA 122.885 0.474 . . . . 0.0 110.756 -179.115 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 62.8 mttp -66.3 -31.45 72.25 Favored 'General case' 0 N--CA 1.455 -0.215 0 CA-C-N 117.741 0.246 . . . . 0.0 111.31 -179.782 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 124' ' ' ILE . . . . . . . . . . . . . 61.7 mt -74.59 -32.94 30.77 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.239 0 O-C-N 121.952 -0.468 . . . . 0.0 109.9 176.473 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -71.7 -36.86 70.68 Favored 'General case' 0 N--CA 1.455 -0.209 0 CA-C-O 119.163 -0.446 . . . . 0.0 111.492 179.032 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 126' ' ' MET . . . . . . . . . . . . . 28.2 ptm -68.14 -32.68 73.12 Favored 'General case' 0 CA--C 1.53 0.184 0 C-N-CA 119.148 -1.021 . . . . 0.0 109.243 174.648 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 4.0 mp -65.24 -32.73 74.55 Favored 'General case' 0 C--N 1.342 0.247 0 CA-C-O 119.474 -0.298 . . . . 0.0 110.321 171.926 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 44.2 tp -68.24 -43.09 78.68 Favored 'General case' 0 N--CA 1.455 -0.208 0 CA-C-N 118.165 0.439 . . . . 0.0 109.83 179.098 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 35.6 m-20 -60.06 -41.54 92.57 Favored 'General case' 0 N--CA 1.455 -0.208 0 N-CA-C 109.889 -0.411 . . . . 0.0 109.889 176.511 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 130' ' ' ILE . . . . . 0.464 ' HA ' ' HD3' ' A' ' 133' ' ' ARG . 65.0 mt -63.26 -36.7 77.12 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.273 0 N-CA-C 109.989 -0.374 . . . . 0.0 109.989 179.116 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 131' ' ' TRP . . . . . . . . . . . . . 42.2 m0 -75.8 -30.77 59.17 Favored 'General case' 0 N--CA 1.451 -0.406 0 N-CA-C 112.589 0.589 . . . . 0.0 112.589 -179.382 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 70.7 m-20 -70.31 -30.15 67.07 Favored 'General case' 0 CA--C 1.533 0.318 0 CA-C-N 118.443 0.565 . . . . 0.0 109.928 175.861 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 133' ' ' ARG . . . . . 0.464 ' HD3' ' HA ' ' A' ' 130' ' ' ILE . 21.9 mtp180 -75.49 -35.16 60.87 Favored 'General case' 0 N--CA 1.454 -0.23 0 C-N-CA 123.68 0.792 . . . . 0.0 111.628 178.587 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 46.0 t -73.14 -19.0 61.22 Favored 'General case' 0 N--CA 1.454 -0.242 0 N-CA-C 111.794 0.294 . . . . 0.0 111.794 -176.992 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 135' ' ' GLY . . . . . . . . . . . . . . . 93.5 15.3 50.91 Favored Glycine 0 CA--C 1.529 0.907 0 N-CA-C 111.965 -0.454 . . . . 0.0 111.965 -178.381 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 136' ' ' LEU . . . . . . . . . . . . . 86.5 mt -69.34 172.5 6.98 Favored 'General case' 0 CA--C 1.532 0.284 0 CA-C-N 117.373 0.587 . . . . 0.0 110.09 176.808 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 137' ' ' PHE . . . . . . . . . . . . . 63.7 m-85 -127.1 39.84 3.83 Favored 'General case' 0 C--O 1.232 0.163 0 N-CA-C 112.711 0.634 . . . . 0.0 112.711 -172.604 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 138' ' ' GLN . . . . . 0.521 ' CD ' ' H ' ' A' ' 138' ' ' GLN . 7.9 pm0 -66.5 17.13 0.02 OUTLIER 'General case' 0 CA--C 1.534 0.346 0 C-N-CA 124.631 1.172 . . . . 0.0 113.637 178.36 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 139' ' ' LYS . . . . . . . . . . . . . 43.0 mmtm 56.35 41.91 28.41 Favored 'General case' 0 N--CA 1.456 -0.155 0 C-N-CA 123.466 0.707 . . . . 0.0 112.343 176.974 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 140' ' ' SER . . . . . . . . . . . . . 17.2 m -56.0 -19.35 12.25 Favored 'General case' 0 CA--C 1.528 0.119 0 C-N-CA 122.927 0.491 . . . . 0.0 112.076 -179.631 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 141' ' ' TYR . . . . . . . . . . . . . 54.5 m-85 -79.87 -8.46 59.31 Favored 'General case' 0 N--CA 1.453 -0.287 0 C-N-CA 122.83 0.452 . . . . 0.0 112.061 179.73 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 142' ' ' LEU . . . . . 0.538 ' HG ' ' H ' ' A' ' 144' ' ' ALA . 48.1 tp -87.2 144.35 26.87 Favored 'General case' 0 N--CA 1.455 -0.217 0 CA-C-N 118.398 0.544 . . . . 0.0 110.538 -177.924 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 84.4 m-20 -66.55 -15.25 63.27 Favored 'General case' 0 N--CA 1.456 -0.151 0 N-CA-C 111.806 0.298 . . . . 0.0 111.806 -178.316 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 144' ' ' ALA . . . . . 0.538 ' H ' ' HG ' ' A' ' 142' ' ' LEU . . . -67.51 -34.21 76.65 Favored 'General case' 0 N--CA 1.452 -0.368 0 CA-C-N 117.737 0.244 . . . . 0.0 110.675 -179.096 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 145' ' ' ILE . . . . . . . . . . . . . 13.2 mm -75.33 -29.71 21.7 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.298 0 CA-C-N 117.677 0.217 . . . . 0.0 110.797 -179.738 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 146' ' ' ARG . . . . . . . . . . . . . 49.1 mtm-85 -74.91 -39.89 61.18 Favored 'General case' 0 N--CA 1.455 -0.193 0 N-CA-C 109.51 -0.552 . . . . 0.0 109.51 176.545 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 147' ' ' SER . . . . . . . . . . . . . 46.9 t 55.69 44.96 25.51 Favored 'General case' 0 N--CA 1.456 -0.149 0 C-N-CA 124.083 0.953 . . . . 0.0 112.105 172.642 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 148' ' ' LYS . . . . . 0.527 ' HA ' ' HE2' ' A' ' 148' ' ' LYS . 7.1 mmpt? -60.86 -14.27 20.97 Favored 'General case' 0 N--CA 1.454 -0.237 0 C-N-CA 123.552 0.741 . . . . 0.0 112.131 -178.139 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 149' ' ' CYS . . . . . . . . . . . . . 59.4 m -60.21 -31.69 70.4 Favored 'General case' 0 N--CA 1.452 -0.359 0 CA-C-N 118.252 0.478 . . . . 0.0 110.15 177.978 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 150' ' ' PHE . . . . . . . . . . . . . 52.0 t80 -66.44 -32.61 74.08 Favored 'General case' 0 N--CA 1.453 -0.282 0 N-CA-C 110.062 -0.348 . . . . 0.0 110.062 178.538 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 151' ' ' ALA . . . . . . . . . . . . . . . -75.75 -25.71 56.76 Favored 'General case' 0 N--CA 1.453 -0.314 0 C-N-CA 122.426 0.29 . . . . 0.0 111.022 179.272 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 152' ' ' MET . . . . . . . . . . . . . 97.1 mmm -76.48 -31.84 57.99 Favored 'General case' 0 N--CA 1.455 -0.188 0 N-CA-C 110.165 -0.309 . . . . 0.0 110.165 173.954 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 153' ' ' ASP . . . . . . . . . . . . . 74.4 m-20 -75.97 -46.32 30.29 Favored 'General case' 0 N--CA 1.453 -0.286 0 C-N-CA 123.143 0.577 . . . . 0.0 111.971 178.752 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 154' ' ' LEU . . . . . . . . . . . . . 48.7 mt -142.81 161.94 36.77 Favored 'General case' 0 N--CA 1.457 -0.1 0 C-N-CA 123.722 0.809 . . . . 0.0 110.063 -177.643 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 155' ' ' GLU . . . . . . . . . . . . . 20.3 pt-20 -70.88 162.2 29.68 Favored 'General case' 0 N--CA 1.454 -0.226 0 N-CA-C 109.756 -0.461 . . . . 0.0 109.756 176.501 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 156' ' ' HIS . . . . . . . . . . . . . 56.8 p-80 -137.34 16.67 2.96 Favored 'General case' 0 CA--C 1.529 0.169 0 N-CA-C 111.787 0.291 . . . . 0.0 111.787 -176.208 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 157' ' ' HIS . . . . . . . . . . . . . 69.0 m-70 -72.87 -12.14 60.86 Favored 'General case' 0 CA--C 1.53 0.206 0 N-CA-C 112.104 0.409 . . . . 0.0 112.104 -177.414 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 158' ' ' HIS . . . . . . . . . . . . . 90.3 m-70 -84.67 163.73 19.05 Favored 'General case' 0 C--O 1.231 0.103 0 C-N-CA 122.989 0.515 . . . . 0.0 111.398 -179.193 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 159' ' ' HIS . . . . . . . . . . . . . 20.5 t-160 . . . . . 0 C--O 1.249 1.032 0 CA-C-O 116.776 -1.583 . . . . 0.0 109.561 179.741 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' B' B 2052 ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 N--CA 1.473 0.703 0 CA-C-O 120.565 0.221 . . . . 0.0 110.448 . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B 2053 ' ' ASP . . . . . . . . . . . . . 17.4 p-10 -80.62 31.51 0.3 Allowed 'General case' 0 CA--C 1.533 0.31 0 C-N-CA 125.217 1.407 . . . . 0.0 111.065 178.273 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B 2054 ' ' ASP . . . . . . . . . . . . . 29.8 t0 -152.62 -177.12 6.04 Favored 'General case' 0 N--CA 1.454 -0.27 0 N-CA-C 109.337 -0.616 . . . . 0.0 109.337 -175.622 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B 2055 ' ' GLU . . . . . . . . . . . . . 85.3 mt-10 -59.16 -23.38 62.15 Favored 'General case' 0 N--CA 1.454 -0.234 0 C-N-CA 123.749 0.82 . . . . 0.0 111.213 179.308 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B 2056 ' ' ASP . . . . . . . . . . . . . 10.6 m-20 48.12 16.67 0.09 Allowed 'General case' 0 C--N 1.341 0.226 0 C-N-CA 124.882 1.273 . . . . 0.0 113.777 -176.105 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B 2057 ' ' ASP . . . . . . . . . . . . . 35.0 t0 -154.0 169.27 23.91 Favored 'General case' 0 N--CA 1.447 -0.588 0 N-CA-C 109.171 -0.677 . . . . 0.0 109.171 174.684 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B 2058 ' ' TYR . . . . . . . . . . . . . 0.9 OUTLIER -153.97 136.61 15.18 Favored 'General case' 0 N--CA 1.452 -0.367 0 N-CA-C 108.714 -0.847 . . . . 0.0 108.714 -178.841 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B 2059 ' ' THR . . . . . . . . . . . . . 63.5 m -108.16 106.71 59.15 Favored Pre-proline 0 N--CA 1.452 -0.349 0 C-N-CA 123.192 0.597 . . . . 0.0 109.48 -178.461 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B 2060 ' ' PRO . . . . . . . . . . . . . 24.0 Cg_exo -65.87 164.62 26.42 Favored 'Trans proline' 0 N--CA 1.451 -0.971 0 C-N-CA 123.242 2.628 . . . . 0.0 112.055 177.42 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B 2061 ' ' SER . . . . . . . . . . . . . 93.7 p -150.29 137.96 19.9 Favored 'General case' 0 N--CA 1.451 -0.414 0 N-CA-C 108.696 -0.853 . . . . 0.0 108.696 173.082 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B 2062 ' ' ILE . . . . . . . . . . . . . 13.7 tt -167.27 150.27 1.46 Allowed 'Isoleucine or valine' 0 N--CA 1.454 -0.253 0 C-N-CA 123.424 0.69 . . . . 0.0 109.296 -178.777 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B 2063 ' ' SER . . . . . . . . . . . . . 42.9 t . . . . . 0 C--O 1.25 1.107 0 CA-C-O 116.938 -1.506 . . . . 0.0 111.149 176.913 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 49.6 tpp . . . . . 0 N--CA 1.472 0.63 0 N-CA-C 110.28 -0.267 . . . . 0.0 110.28 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 12.6 pt20 53.4 24.86 4.18 Favored 'General case' 0 CA--C 1.529 0.166 0 C-N-CA 125.583 1.553 . . . . 0.0 113.49 176.517 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 20.9 pt20 -143.87 28.2 1.43 Allowed 'General case' 0 CA--C 1.532 0.252 0 C-N-CA 122.992 0.517 . . . . 0.0 110.01 177.077 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 51.8 m-20 58.38 16.37 4.06 Favored 'General case' 0 C--N 1.338 0.079 0 C-N-CA 125.617 1.567 . . . . 0.0 115.049 179.003 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 40.1 p-10 -88.66 -5.23 58.27 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 122.161 0.982 . . . . 0.0 109.8 171.646 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 3.8 p30 -97.12 -33.72 11.41 Favored 'General case' 0 N--CA 1.447 -0.607 0 CA-C-N 113.848 -1.524 . . . . 0.0 107.13 175.669 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 7' ' ' PHE . . . . . 0.489 ' HB2' ' HZ3' ' A' ' 45' ' ' LYS . 1.3 t80 -62.55 -34.21 76.49 Favored 'General case' 0 N--CA 1.45 -0.475 0 C-N-CA 124.482 1.113 . . . . 0.0 108.998 172.657 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 51.5 tp60 -49.64 -36.37 24.33 Favored 'General case' 0 N--CA 1.453 -0.281 0 C-N-CA 124.953 1.301 . . . . 0.0 112.167 -177.481 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 22.9 m-80 -71.8 -34.48 69.41 Favored 'General case' 0 N--CA 1.454 -0.264 0 CA-C-O 120.801 0.334 . . . . 0.0 110.176 -179.524 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 10' ' ' PHE . . . . . 0.439 ' CZ ' HG12 ' A' ' 46' ' ' ILE . 1.6 t80 -70.98 -39.57 72.43 Favored 'General case' 0 N--CA 1.45 -0.45 0 C-N-CA 123.787 0.835 . . . . 0.0 109.107 177.451 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 95.2 t -66.42 -52.21 49.3 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.353 0 N-CA-C 109.164 -0.68 . . . . 0.0 109.164 178.666 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -59.12 -31.16 68.68 Favored 'General case' 0 N--CA 1.451 -0.389 0 C-N-CA 122.428 0.291 . . . . 0.0 111.486 -178.86 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 78.6 m -69.88 -37.45 76.05 Favored 'General case' 0 CA--C 1.531 0.214 0 N-CA-C 108.753 -0.832 . . . . 0.0 108.753 176.061 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.495 HD21 ' HB2' ' A' ' 53' ' ' TYR . 6.2 tp -66.73 -41.43 87.89 Favored 'General case' 0 N--CA 1.455 -0.203 0 CA-C-O 121.485 0.66 . . . . 0.0 110.488 178.742 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 63.3 mm-40 -64.82 -27.79 69.12 Favored 'General case' 0 N--CA 1.451 -0.417 0 C-N-CA 123.698 0.799 . . . . 0.0 109.08 178.027 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 5.3 p -71.75 -29.3 64.35 Favored 'General case' 0 N--CA 1.452 -0.346 0 N-CA-C 109.966 -0.383 . . . . 0.0 109.966 177.596 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 17' ' ' PHE . . . . . 0.502 ' CE1' HD11 ' A' ' 68' ' ' ILE . 24.3 m-85 -68.85 -34.32 75.27 Favored 'General case' 0 N--CA 1.457 -0.124 0 C-N-CA 119.718 -0.793 . . . . 0.0 110.395 171.536 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 18' ' ' LYS . . . . . 0.422 ' HA ' ' CE1' ' A' ' 61' ' ' HIS . 55.1 mttt -65.76 -26.3 67.66 Favored 'General case' 0 C--N 1.338 0.103 0 C-N-CA 120.395 -0.522 . . . . 0.0 110.153 176.112 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 40.3 t0 -73.48 -43.73 59.54 Favored 'General case' 0 CA--C 1.532 0.26 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.637 177.137 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 87.6 mt -65.12 146.66 54.69 Favored 'General case' 0 N--CA 1.456 -0.148 0 O-C-N 121.862 -0.524 . . . . 0.0 110.001 179.546 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -81.54 -32.5 32.25 Favored 'General case' 0 C--N 1.334 -0.076 0 N-CA-C 109.737 -0.468 . . . . 0.0 109.737 -179.916 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 14.1 m -79.22 -21.55 46.1 Favored 'General case' 0 N--CA 1.453 -0.289 0 C-N-CA 123.166 0.586 . . . . 0.0 110.738 175.487 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 72.74 -26.93 0.75 Allowed Glycine 0 CA--C 1.527 0.826 0 C-N-CA 124.578 1.085 . . . . 0.0 112.328 -178.792 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 74.3 mt -81.61 147.37 6.23 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.441 0 C-N-CA 123.396 0.678 . . . . 0.0 110.413 178.916 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 37.8 t -165.67 97.4 0.66 Allowed 'General case' 0 CA--C 1.517 -0.305 0 N-CA-C 108.42 -0.956 . . . . 0.0 108.42 173.606 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 26' ' ' GLY . . . . . 0.467 ' O ' ' HE2' ' A' ' 30' ' ' LYS . . . -55.84 -36.83 67.35 Favored Glycine 0 CA--C 1.527 0.796 0 N-CA-C 110.313 -1.115 . . . . 0.0 110.313 -176.497 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 27' ' ' SER . . . . . 0.465 ' H ' ' HB3' ' B' 2055 ' ' GLU . 88.5 p -62.27 -51.76 66.41 Favored 'General case' 0 N--CA 1.454 -0.274 0 CA-C-N 117.502 0.651 . . . . 0.0 110.123 -177.817 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 83.7 mtt180 -70.86 -40.97 72.0 Favored 'General case' 0 N--CA 1.455 -0.188 0 C-N-CA 123.626 0.77 . . . . 0.0 110.737 -178.71 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 64.0 mt -56.43 -42.01 73.74 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.707 0 N-CA-C 109.101 -0.703 . . . . 0.0 109.101 174.861 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 30' ' ' LYS . . . . . 0.467 ' HE2' ' O ' ' A' ' 26' ' ' GLY . 48.8 mtmt -67.81 -26.88 66.29 Favored 'General case' 0 C--N 1.34 0.194 0 CA-C-O 118.79 -0.624 . . . . 0.0 111.385 177.554 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 31' ' ' LYS . . . . . 0.49 ' HA ' ' HE3' ' A' ' 31' ' ' LYS . 0.0 OUTLIER -63.93 -56.56 14.32 Favored 'General case' 0 C--N 1.339 0.112 0 CA-C-N 119.187 0.903 . . . . 0.0 110.146 176.568 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.439 HD12 ' N ' ' A' ' 33' ' ' THR . 3.3 pp -75.21 -20.63 59.17 Favored 'General case' 0 CA--C 1.531 0.222 0 C-N-CA 119.662 -0.815 . . . . 0.0 111.419 -177.532 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 33' ' ' THR . . . . . 0.439 ' N ' HD12 ' A' ' 32' ' ' LEU . 31.3 m -69.8 -41.68 74.71 Favored 'General case' 0 C--O 1.231 0.107 0 N-CA-C 108.28 -1.007 . . . . 0.0 108.28 175.96 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 97.5 m -68.44 -41.82 79.75 Favored 'General case' 0 N--CA 1.45 -0.46 0 N-CA-C 109.876 -0.416 . . . . 0.0 109.876 -178.751 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 52.7 t80 -62.89 -32.12 73.32 Favored 'General case' 0 C--N 1.337 0.046 0 N-CA-C 109.972 -0.381 . . . . 0.0 109.972 177.475 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -72.97 -28.72 62.57 Favored 'General case' 0 N--CA 1.447 -0.62 0 CA-C-O 119.491 -0.29 . . . . 0.0 111.061 178.999 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 2.2 mm? -79.78 -33.93 40.14 Favored 'General case' 0 CA--C 1.519 -0.224 0 N-CA-C 109.009 -0.737 . . . . 0.0 109.009 -178.371 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 81.2 m-20 -66.32 -17.25 64.65 Favored 'General case' 0 N--CA 1.443 -0.818 0 C-N-CA 123.892 0.877 . . . . 0.0 111.188 173.966 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 96.5 m-70 -152.52 90.78 1.52 Allowed 'General case' 0 N--CA 1.453 -0.286 0 C-N-CA 123.904 0.882 . . . . 0.0 110.681 -176.87 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 40' ' ' ILE . . . . . 0.567 ' H ' HD13 ' A' ' 40' ' ' ILE . 0.0 OUTLIER -71.23 -18.39 20.4 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.29 0 CA-C-N 119.235 0.925 . . . . 0.0 108.526 172.374 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 7.7 m-20 -44.84 -41.78 7.36 Favored 'General case' 0 N--CA 1.455 -0.212 0 C-N-CA 125.817 1.647 . . . . 0.0 112.806 -179.525 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 42' ' ' ILE . . . . . 0.402 HD13 HD11 ' A' ' 46' ' ' ILE . 1.4 pp -101.07 16.73 4.14 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.57 0 C-N-CA 124.151 0.98 . . . . 0.0 111.742 -173.283 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 43' ' ' GLU . . . . . 0.44 ' HA ' HD12 ' A' ' 46' ' ' ILE . 3.0 pp20? -52.97 -32.96 48.95 Favored 'General case' 0 CA--C 1.529 0.14 0 O-C-N 122.076 -0.39 . . . . 0.0 111.205 176.759 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 47.8 t -59.71 -46.14 90.0 Favored 'General case' 0 CA--C 1.53 0.211 0 O-C-N 122.273 -0.267 . . . . 0.0 111.654 -177.326 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 45' ' ' LYS . . . . . 0.489 ' HZ3' ' HB2' ' A' ' 7' ' ' PHE . 18.4 ptpt -75.09 -23.03 57.91 Favored 'General case' 0 C--N 1.341 0.223 0 C-N-CA 121.006 -0.278 . . . . 0.0 110.547 179.434 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 46' ' ' ILE . . . . . 0.44 HD12 ' HA ' ' A' ' 43' ' ' GLU . 77.0 mt -73.88 -50.13 30.67 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.253 0 N-CA-C 110.18 -0.304 . . . . 0.0 110.18 -179.92 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 46.0 mm -67.32 -37.25 78.69 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.431 0 O-C-N 123.357 0.41 . . . . 0.0 110.364 -177.302 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 22.6 t -67.5 -39.7 85.19 Favored 'General case' 0 N--CA 1.452 -0.346 0 C-N-CA 119.351 -0.94 . . . . 0.0 109.818 176.939 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 49' ' ' LEU . . . . . 0.467 ' HG ' HD22 ' A' ' 14' ' ' LEU . 53.4 tp -69.33 -35.48 75.98 Favored 'General case' 0 N--CA 1.449 -0.507 0 CA-C-O 119.162 -0.447 . . . . 0.0 111.832 -174.444 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 50' ' ' ILE . . . . . 0.472 HD12 HG12 ' A' ' 69' ' ' ILE . 3.9 pt -72.07 -44.68 65.36 Favored 'Isoleucine or valine' 0 C--N 1.34 0.163 0 CA-C-N 118.834 0.743 . . . . 0.0 110.855 178.032 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 30.9 pt -66.16 -39.06 83.35 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.141 0 C-N-CA 119.559 -0.856 . . . . 0.0 111.064 179.628 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 88.9 m-20 -64.86 -45.21 87.01 Favored 'General case' 0 N--CA 1.452 -0.338 0 CA-C-N 117.958 0.344 . . . . 0.0 110.749 178.959 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 53' ' ' TYR . . . . . 0.495 ' HB2' HD21 ' A' ' 14' ' ' LEU . 3.2 t80 -65.04 -34.79 79.27 Favored 'General case' 0 N--CA 1.456 -0.16 0 N-CA-C 109.326 -0.62 . . . . 0.0 109.326 175.867 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 28.7 t -62.37 -34.72 77.24 Favored 'General case' 0 N--CA 1.454 -0.261 0 CA-C-N 117.878 0.308 . . . . 0.0 111.082 -178.692 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 55' ' ' ARG . . . . . 0.431 ' NE ' ' HA ' ' A' ' 55' ' ' ARG . 11.8 mmp_? -75.42 -46.41 32.94 Favored 'General case' 0 C--N 1.34 0.183 0 CA-C-N 118.489 0.586 . . . . 0.0 111.525 177.709 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 30.5 mt -75.23 -41.25 57.98 Favored 'General case' 0 C--O 1.227 -0.085 0 N-CA-C 112.92 0.711 . . . . 0.0 112.92 -173.253 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 13.2 p -63.66 155.53 75.93 Favored Pre-proline 0 CA--C 1.535 0.391 0 N-CA-C 112.607 0.595 . . . . 0.0 112.607 -174.857 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 87.2 Cg_endo -74.57 173.04 15.0 Favored 'Trans proline' 0 N--CA 1.453 -0.876 0 C-N-CA 124.746 3.631 . . . . 0.0 111.668 -179.433 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -46.57 -52.8 12.71 Favored 'General case' 0 N--CA 1.452 -0.328 0 C-N-CA 125.407 1.483 . . . . 0.0 113.952 -170.744 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 95.1 p -68.14 -31.86 71.74 Favored 'General case' 0 N--CA 1.457 -0.089 0 O-C-N 121.915 -0.491 . . . . 0.0 110.111 -177.154 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 61' ' ' HIS . . . . . 0.422 ' CE1' ' HA ' ' A' ' 18' ' ' LYS . 37.0 m170 -75.34 -24.93 57.43 Favored 'General case' 0 N--CA 1.45 -0.431 0 N-CA-C 109.923 -0.399 . . . . 0.0 109.923 179.395 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 67.7 mttm -67.05 -40.4 87.14 Favored 'General case' 0 C--N 1.34 0.184 0 N-CA-C 109.246 -0.65 . . . . 0.0 109.246 173.292 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -60.79 -40.8 93.97 Favored 'General case' 0 CA--C 1.533 0.29 0 N-CA-C 108.458 -0.941 . . . . 0.0 108.458 175.548 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -67.62 -30.58 74.94 Favored Glycine 0 CA--C 1.528 0.876 0 N-CA-C 111.727 -0.549 . . . . 0.0 111.727 178.442 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 35.6 p -66.94 -35.12 79.27 Favored 'General case' 0 N--CA 1.456 -0.153 0 CA-C-N 117.805 0.803 . . . . 0.0 109.637 178.217 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 66' ' ' LEU . . . . . 0.434 HD21 ' CD2' ' A' ' 108' ' ' LEU . 43.0 mt -73.94 -30.51 62.59 Favored 'General case' 0 N--CA 1.453 -0.277 0 C-N-CA 122.346 0.258 . . . . 0.0 110.579 177.424 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 2.6 m-85 -68.93 -36.44 77.97 Favored 'General case' 0 CA--C 1.518 -0.265 0 CA-C-N 117.75 0.25 . . . . 0.0 110.776 176.577 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 68' ' ' ILE . . . . . 0.502 HD11 ' CE1' ' A' ' 17' ' ' PHE . 16.3 mt -69.51 -51.52 41.15 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.484 0 C-N-CA 119.631 -0.827 . . . . 0.0 108.776 178.536 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 69' ' ' ILE . . . . . 0.472 HG12 HD12 ' A' ' 50' ' ' ILE . 77.2 mt -48.47 -37.45 7.98 Favored 'Isoleucine or valine' 0 C--N 1.341 0.224 0 O-C-N 123.574 0.546 . . . . 0.0 111.161 172.355 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 19.9 t70 -70.9 -48.16 55.23 Favored 'General case' 0 C--O 1.233 0.202 0 CA-C-N 118.863 0.756 . . . . 0.0 111.096 179.418 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 30.8 t -65.11 -51.45 61.25 Favored 'General case' 0 N--CA 1.451 -0.404 0 C-N-CA 122.447 0.299 . . . . 0.0 111.251 -176.4 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 72' ' ' ILE . . . . . 0.422 HD11 ' CZ ' ' A' ' 76' ' ' TYR . 0.0 OUTLIER -75.82 -32.62 24.25 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.234 0 N-CA-C 109.89 -0.411 . . . . 0.0 109.89 -178.557 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -69.19 -46.49 57.56 Favored Glycine 0 CA--C 1.523 0.558 0 N-CA-C 111.419 -0.672 . . . . 0.0 111.419 -176.531 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 37.5 mtm105 -69.47 -42.01 75.41 Favored 'General case' 0 CA--C 1.515 -0.395 0 CA-C-N 117.694 0.747 . . . . 0.0 110.09 177.641 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -62.83 -31.32 72.31 Favored 'General case' 0 N--CA 1.448 -0.528 0 C-N-CA 119.996 -0.682 . . . . 0.0 110.306 -179.194 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 76' ' ' TYR . . . . . 0.422 ' CZ ' HD11 ' A' ' 72' ' ' ILE . 2.3 m-30 -72.29 -56.38 5.6 Favored 'General case' 0 CA--C 1.518 -0.281 0 CA-C-N 118.149 0.431 . . . . 0.0 111.065 175.428 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 53.8 tp -63.87 -40.88 97.58 Favored 'General case' 0 N--CA 1.447 -0.577 0 C-N-CA 117.885 -1.526 . . . . 0.0 109.948 -175.265 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 95.8 m-20 -60.69 -50.97 71.35 Favored 'General case' 0 N--CA 1.454 -0.24 0 CA-C-O 118.693 -0.67 . . . . 0.0 112.389 -179.843 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 68.0 mm-40 -72.52 -35.73 68.16 Favored 'General case' 0 N--CA 1.455 -0.196 0 CA-C-N 119.385 0.993 . . . . 0.0 112.078 -177.357 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 80.5 p -72.11 -30.63 65.26 Favored 'General case' 0 N--CA 1.451 -0.404 0 C-N-CA 120.18 -0.608 . . . . 0.0 110.579 179.493 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 7.4 ttm105 -82.71 -29.6 29.74 Favored 'General case' 0 CA--C 1.531 0.224 0 C-N-CA 123.649 0.78 . . . . 0.0 112.159 177.76 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 44.2 m -79.21 -15.11 58.55 Favored 'General case' 0 CA--C 1.528 0.111 0 N-CA-C 112.645 0.609 . . . . 0.0 112.645 -179.102 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 50.1 m-80 -130.22 -1.59 4.53 Favored 'General case' 0 N--CA 1.455 -0.213 0 N-CA-C 112.304 0.483 . . . . 0.0 112.304 -174.93 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 47.8 t -162.85 179.18 7.81 Favored 'General case' 0 N--CA 1.451 -0.384 0 N-CA-C 110.005 -0.369 . . . . 0.0 110.005 -179.842 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 59.1 m-20 -76.92 3.26 12.51 Favored 'General case' 0 CA--C 1.533 0.303 0 C-N-CA 122.676 0.391 . . . . 0.0 110.97 176.451 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 33.4 p 62.26 -9.58 0.09 Allowed 'General case' 0 CA--C 1.533 0.297 0 C-N-CA 126.315 1.846 . . . . 0.0 114.259 -177.749 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 48.2 t 58.69 175.69 0.07 Allowed 'General case' 0 CA--C 1.534 0.339 0 C-N-CA 124.468 1.107 . . . . 0.0 112.533 -178.912 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 47.9 t -139.56 5.87 2.25 Favored 'General case' 0 N--CA 1.455 -0.191 0 C-N-CA 123.553 0.741 . . . . 0.0 110.931 179.306 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 70.4 m-80 -145.52 173.46 12.01 Favored 'General case' 0 CA--C 1.531 0.225 0 C-N-CA 124.486 1.114 . . . . 0.0 109.752 179.969 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 90' ' ' LYS . . . . . 0.409 ' HB3' ' HE3' ' A' ' 90' ' ' LYS . 20.2 ttpp 67.72 134.59 0.04 OUTLIER Pre-proline 0 CA--C 1.536 0.406 0 C-N-CA 125.926 1.691 . . . . 0.0 113.386 -179.51 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 82.1 Cg_endo -70.3 168.92 20.87 Favored 'Trans proline' 0 N--CA 1.454 -0.809 0 C-N-CA 124.31 3.34 . . . . 0.0 110.522 173.894 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 83.59 20.63 59.66 Favored Glycine 0 CA--C 1.526 0.773 0 CA-C-O 119.775 -0.458 . . . . 0.0 112.448 177.442 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -158.28 167.16 30.51 Favored 'General case' 0 N--CA 1.451 -0.392 0 C-N-CA 124.281 1.033 . . . . 0.0 109.528 179.94 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 94' ' ' CYS . . . . . 0.569 ' SG ' HD13 ' A' ' 98' ' ' ILE . 2.0 t -52.37 -28.06 18.07 Favored 'General case' 0 N--CA 1.454 -0.241 0 C-N-CA 123.82 0.848 . . . . 0.0 110.816 175.176 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -52.94 -62.57 1.57 Allowed 'General case' 0 N--CA 1.448 -0.548 0 O-C-N 122.497 -0.127 . . . . 0.0 111.086 -178.239 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 76.4 t60 -73.56 -32.98 64.45 Favored 'General case' 0 N--CA 1.453 -0.323 0 O-C-N 122.27 -0.269 . . . . 0.0 110.954 -178.308 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -64.04 -53.58 47.66 Favored 'General case' 0 N--CA 1.451 -0.397 0 O-C-N 122.934 0.147 . . . . 0.0 111.183 -177.252 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 98' ' ' ILE . . . . . 0.569 HD13 ' SG ' ' A' ' 94' ' ' CYS . 1.7 mp -69.88 -34.55 60.77 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.166 0 N-CA-C 109.83 -0.433 . . . . 0.0 109.83 -179.81 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 59.6 m-20 -62.07 -42.39 99.15 Favored 'General case' 0 N--CA 1.456 -0.168 0 O-C-N 122.163 -0.336 . . . . 0.0 110.6 178.102 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 98.0 m -64.23 -41.28 97.08 Favored 'General case' 0 N--CA 1.454 -0.249 0 N-CA-C 109.9 -0.407 . . . . 0.0 109.9 -178.653 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 90.8 mt -68.98 -24.1 64.2 Favored 'General case' 0 N--CA 1.452 -0.329 0 CA-C-N 116.426 -0.352 . . . . 0.0 111.389 179.882 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -73.73 -25.59 71.63 Favored Glycine 0 CA--C 1.527 0.833 0 CA-C-O 119.551 -0.583 . . . . 0.0 113.518 -178.212 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 74.1 mm-40 -81.08 -45.55 16.32 Favored 'General case' 0 N--CA 1.453 -0.294 0 CA-C-N 118.3 1.05 . . . . 0.0 111.996 179.35 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 18.1 m -85.26 6.69 2.19 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.14 0 C-N-CA 123.641 0.777 . . . . 0.0 111.097 -175.79 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 105' ' ' ILE . . . . . . . . . . . . . 9.7 tp -62.0 -37.0 77.25 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.354 0 C-N-CA 122.125 0.17 . . . . 0.0 110.795 -174.464 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 16.5 pt20 -76.05 -35.67 59.35 Favored 'General case' 0 N--CA 1.451 -0.404 0 CA-C-O 119.14 -0.457 . . . . 0.0 111.153 -177.231 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 59.3 mp0 -74.7 -39.36 61.99 Favored 'General case' 0 N--CA 1.451 -0.382 0 CA-C-N 118.814 0.734 . . . . 0.0 110.449 -179.684 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 108' ' ' LEU . . . . . 0.434 ' CD2' HD21 ' A' ' 66' ' ' LEU . 7.6 tt -73.5 -41.38 63.17 Favored 'General case' 0 N--CA 1.45 -0.475 0 CA-C-O 119.672 -0.204 . . . . 0.0 111.326 -174.774 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 9.6 mp -73.43 -49.9 24.53 Favored 'General case' 0 C--O 1.225 -0.203 0 C-N-CA 120.534 -0.466 . . . . 0.0 110.012 179.148 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 23.3 t -55.32 -39.47 70.0 Favored 'General case' 0 N--CA 1.454 -0.231 0 CA-C-N 118.334 0.515 . . . . 0.0 111.109 -177.452 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 36.9 t0 -62.4 -49.33 75.94 Favored 'General case' 0 N--CA 1.454 -0.264 0 N-CA-C 109.067 -0.716 . . . . 0.0 109.067 175.423 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -66.69 -35.72 80.8 Favored 'General case' 0 N--CA 1.446 -0.657 0 CA-C-O 119.031 -0.509 . . . . 0.0 112.097 -175.457 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 113' ' ' ILE . . . . . . . . . . . . . 20.6 mm -70.26 -40.71 78.28 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.213 0 CA-C-N 119.315 0.961 . . . . 0.0 110.209 -178.936 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -74.35 -40.38 62.19 Favored 'General case' 0 N--CA 1.451 -0.377 0 C-N-CA 121.288 -0.165 . . . . 0.0 111.385 -179.421 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 115' ' ' LYS . . . . . 0.614 ' HE2' ' HA ' ' A' ' 115' ' ' LYS . 0.6 OUTLIER -75.58 -39.31 58.25 Favored 'General case' 0 N--CA 1.449 -0.485 0 N-CA-C 113.341 0.867 . . . . 0.0 113.341 -178.516 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 116' ' ' SER . . . . . 0.477 ' HB2' ' CB ' ' A' ' 120' ' ' HIS . 44.4 p -80.5 161.3 24.91 Favored 'General case' 0 N--CA 1.455 -0.198 0 N-CA-C 112.425 0.528 . . . . 0.0 112.425 -172.52 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 22.6 m120 -88.64 178.02 6.61 Favored 'General case' 0 C--O 1.227 -0.1 0 C-N-CA 123.435 0.694 . . . . 0.0 112.59 -177.367 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 118' ' ' GLN . . . . . . . . . . . . . 2.9 pt20 -49.21 -55.09 13.65 Favored 'General case' 0 N--CA 1.456 -0.128 0 C-N-CA 123.633 0.773 . . . . 0.0 112.937 -177.661 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 21.9 t70 -56.59 -33.98 66.75 Favored 'General case' 0 C--O 1.23 0.052 0 CA-C-N 118.451 0.569 . . . . 0.0 110.104 -179.993 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 120' ' ' HIS . . . . . 0.477 ' CB ' ' HB2' ' A' ' 116' ' ' SER . 15.9 m170 -75.05 -41.41 59.17 Favored 'General case' 0 N--CA 1.449 -0.489 0 N-CA-C 109.932 -0.395 . . . . 0.0 109.932 -177.571 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 62.1 mttp -58.08 -37.97 75.48 Favored 'General case' 0 N--CA 1.455 -0.202 0 N-CA-C 110.228 -0.286 . . . . 0.0 110.228 179.88 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 81.6 mm-40 -68.86 -46.24 69.0 Favored 'General case' 0 N--CA 1.449 -0.486 0 C-N-CA 122.72 0.408 . . . . 0.0 110.299 179.033 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 97.4 mttt -64.55 -31.33 72.5 Favored 'General case' 0 N--CA 1.453 -0.307 0 CA-C-N 115.75 -0.659 . . . . 0.0 111.07 -178.698 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 124' ' ' ILE . . . . . . . . . . . . . 58.4 mt -75.62 -38.47 38.4 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.242 0 O-C-N 121.791 -0.568 . . . . 0.0 110.132 176.761 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 22.9 mtp180 -67.49 -33.11 74.44 Favored 'General case' 0 N--CA 1.453 -0.277 0 N-CA-C 112.385 0.513 . . . . 0.0 112.385 178.14 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 126' ' ' MET . . . . . . . . . . . . . 28.1 ptm -72.5 -33.82 67.2 Favored 'General case' 0 N--CA 1.455 -0.207 0 C-N-CA 119.489 -0.884 . . . . 0.0 108.686 174.328 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 2.6 mp -63.33 -38.23 90.34 Favored 'General case' 0 C--N 1.34 0.163 0 N-CA-C 109.896 -0.409 . . . . 0.0 109.896 175.19 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 57.4 tp -64.24 -42.62 96.45 Favored 'General case' 0 N--CA 1.453 -0.285 0 CA-C-N 117.747 0.249 . . . . 0.0 110.335 179.614 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 18.9 t0 -63.82 -46.64 84.19 Favored 'General case' 0 N--CA 1.455 -0.178 0 N-CA-C 109.855 -0.424 . . . . 0.0 109.855 177.697 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 54.8 mt -56.37 -35.81 44.72 Favored 'Isoleucine or valine' 0 C--O 1.235 0.296 0 N-CA-C 110.257 -0.275 . . . . 0.0 110.257 179.931 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 131' ' ' TRP . . . . . . . . . . . . . 47.6 m0 -73.17 -43.72 61.0 Favored 'General case' 0 N--CA 1.45 -0.462 0 N-CA-C 112.635 0.606 . . . . 0.0 112.635 -179.536 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 76.7 m-20 -64.83 -27.56 68.96 Favored 'General case' 0 N--CA 1.453 -0.279 0 CA-C-N 118.462 0.574 . . . . 0.0 110.916 -179.088 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 12.3 mtp180 -75.67 -36.59 60.06 Favored 'General case' 0 C--O 1.226 -0.137 0 C-N-CA 123.313 0.645 . . . . 0.0 110.551 177.079 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 39.7 m -75.13 -13.95 60.52 Favored 'General case' 0 N--CA 1.455 -0.177 0 C-N-CA 123.019 0.528 . . . . 0.0 112.272 -178.246 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 135' ' ' GLY . . . . . . . . . . . . . . . 94.03 5.69 62.31 Favored Glycine 0 CA--C 1.529 0.944 0 N-CA-C 110.969 -0.853 . . . . 0.0 110.969 -175.183 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 136' ' ' LEU . . . . . . . . . . . . . 81.5 mt -82.65 12.62 4.47 Favored 'General case' 0 N--CA 1.454 -0.271 0 C-N-CA 123.743 0.817 . . . . 0.0 111.253 177.76 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 137' ' ' PHE . . . . . . . . . . . . . 21.6 p90 -59.03 151.08 23.0 Favored 'General case' 0 C--N 1.341 0.208 0 CA-C-N 118.217 0.462 . . . . 0.0 110.409 -178.898 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 138' ' ' GLN . . . . . . . . . . . . . 70.7 mm-40 -137.58 173.45 11.65 Favored 'General case' 0 CA--C 1.523 -0.061 0 CA-C-O 121.445 0.641 . . . . 0.0 111.333 -176.145 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 139' ' ' LYS . . . . . . . . . . . . . 63.2 pttt -79.43 174.92 11.08 Favored 'General case' 0 N--CA 1.452 -0.333 0 CA-C-N 114.983 -1.008 . . . . 0.0 111.335 178.926 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 140' ' ' SER . . . . . 0.471 ' C ' ' H ' ' A' ' 142' ' ' LEU . 9.5 t 59.51 37.87 22.69 Favored 'General case' 0 CA--C 1.533 0.316 0 N-CA-C 114.358 1.244 . . . . 0.0 114.358 174.719 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 141' ' ' TYR . . . . . . . . . . . . . 9.9 m-30 -73.24 35.72 0.08 Allowed 'General case' 0 CA--C 1.535 0.402 0 O-C-N 121.71 -0.619 . . . . 0.0 110.159 171.084 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 142' ' ' LEU . . . . . 0.471 ' H ' ' C ' ' A' ' 140' ' ' SER . 82.0 mt -80.25 -174.68 4.68 Favored 'General case' 0 N--CA 1.454 -0.24 0 C-N-CA 124.539 1.136 . . . . 0.0 111.531 -175.722 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 68.5 m-80 -55.71 -17.26 5.52 Favored 'General case' 0 N--CA 1.456 -0.171 0 C-N-CA 123.828 0.851 . . . . 0.0 112.566 -179.7 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . -66.2 -30.89 71.44 Favored 'General case' 0 N--CA 1.452 -0.369 0 CA-C-N 118.245 0.475 . . . . 0.0 110.416 179.587 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 145' ' ' ILE . . . . . . . . . . . . . 47.6 mm -74.6 -35.83 39.11 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.233 0 N-CA-C 110.048 -0.353 . . . . 0.0 110.048 179.678 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 146' ' ' ARG . . . . . . . . . . . . . 15.3 mmm180 -75.9 -22.87 55.64 Favored 'General case' 0 N--CA 1.453 -0.299 0 O-C-N 122.243 -0.286 . . . . 0.0 110.86 179.278 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 147' ' ' SER . . . . . . . . . . . . . 74.4 p 42.36 48.96 4.5 Favored 'General case' 0 C--N 1.341 0.221 0 C-N-CA 124.892 1.277 . . . . 0.0 112.642 174.625 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 148' ' ' LYS . . . . . 0.571 ' H ' ' CD ' ' A' ' 148' ' ' LYS . 0.0 OUTLIER -55.35 -14.93 2.11 Favored 'General case' 0 N--CA 1.453 -0.278 0 C-N-CA 124.047 0.939 . . . . 0.0 112.587 178.586 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 149' ' ' CYS . . . . . . . . . . . . . 59.6 m -60.88 -30.52 70.2 Favored 'General case' 0 N--CA 1.451 -0.402 0 O-C-N 121.804 -0.56 . . . . 0.0 109.72 175.887 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 150' ' ' PHE . . . . . . . . . . . . . 92.7 t80 -65.0 -29.45 70.37 Favored 'General case' 0 N--CA 1.454 -0.233 0 N-CA-C 110.018 -0.364 . . . . 0.0 110.018 178.774 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 151' ' ' ALA . . . . . . . . . . . . . . . -75.9 -33.76 59.92 Favored 'General case' 0 N--CA 1.449 -0.502 0 C-N-CA 122.401 0.28 . . . . 0.0 110.752 177.024 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 152' ' ' MET . . . . . . . . . . . . . 89.4 mtp -73.96 -31.04 62.83 Favored 'General case' 0 N--CA 1.454 -0.259 0 N-CA-C 110.225 -0.287 . . . . 0.0 110.225 178.454 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 153' ' ' ASP . . . . . . . . . . . . . 79.7 m-20 -75.42 -23.91 57.05 Favored 'General case' 0 N--CA 1.454 -0.23 0 N-CA-C 113.105 0.78 . . . . 0.0 113.105 -179.571 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 154' ' ' LEU . . . . . . . . . . . . . 84.3 mt -131.32 18.13 4.9 Favored 'General case' 0 C--N 1.339 0.119 0 C-N-CA 123.032 0.533 . . . . 0.0 111.891 -174.176 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 155' ' ' GLU . . . . . . . . . . . . . 94.0 mt-10 51.53 8.99 0.06 Allowed 'General case' 0 CA--C 1.535 0.381 0 C-N-CA 126.19 1.796 . . . . 0.0 114.227 -179.054 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 156' ' ' HIS . . . . . . . . . . . . . 73.2 t60 -161.96 145.92 12.38 Favored 'General case' 0 N--CA 1.454 -0.235 0 N-CA-C 108.169 -1.048 . . . . 0.0 108.169 -178.638 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 157' ' ' HIS . . . . . . . . . . . . . 62.1 t60 -98.47 -25.23 14.85 Favored 'General case' 0 C--N 1.338 0.103 0 N-CA-C 113.326 0.861 . . . . 0.0 113.326 -172.955 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 158' ' ' HIS . . . . . . . . . . . . . 88.1 m-70 -91.37 40.92 1.05 Allowed 'General case' 0 N--CA 1.455 -0.204 0 N-CA-C 112.97 0.73 . . . . 0.0 112.97 -171.911 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 159' ' ' HIS . . . . . . . . . . . . . 97.6 m-70 . . . . . 0 C--O 1.251 1.134 0 CA-C-O 117.759 -1.115 . . . . 0.0 108.956 169.097 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' B' B 2052 ' ' ASP . . . . . . . . . . . . . 23.9 m-20 . . . . . 0 N--CA 1.47 0.541 0 N-CA-C 109.637 -0.505 . . . . 0.0 109.637 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' B' B 2053 ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER 57.43 35.28 25.74 Favored 'General case' 0 N--CA 1.454 -0.243 0 N-CA-C 113.415 0.894 . . . . 0.0 113.415 168.582 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B 2054 ' ' ASP . . . . . . . . . . . . . 55.2 t0 -142.18 69.16 1.32 Allowed 'General case' 0 CA--C 1.533 0.293 0 C-N-CA 123.047 0.539 . . . . 0.0 110.05 -177.03 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B 2055 ' ' GLU . . . . . 0.465 ' HB3' ' H ' ' A' ' 27' ' ' SER . 60.9 tt0 55.11 49.02 18.35 Favored 'General case' 0 CA--C 1.531 0.224 0 C-N-CA 124.319 1.048 . . . . 0.0 110.42 -177.209 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B 2056 ' ' ASP . . . . . . . . . . . . . 17.1 m-20 -57.96 -6.66 0.6 Allowed 'General case' 0 C--N 1.341 0.199 0 C-N-CA 125.231 1.412 . . . . 0.0 114.675 -172.77 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B 2057 ' ' ASP . . . . . . . . . . . . . 24.6 t0 -150.62 112.43 4.52 Favored 'General case' 0 N--CA 1.452 -0.339 0 CA-C-N 119.166 0.893 . . . . 0.0 110.267 173.621 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B 2058 ' ' TYR . . . . . . . . . . . . . 3.4 t80 -66.99 -25.27 66.23 Favored 'General case' 0 N--CA 1.455 -0.219 0 C-N-CA 125.19 1.396 . . . . 0.0 110.451 179.112 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B 2059 ' ' THR . . . . . . . . . . . . . 8.1 t 34.33 55.38 1.76 Allowed Pre-proline 0 C--N 1.344 0.357 0 C-N-CA 124.984 1.314 . . . . 0.0 112.315 178.924 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B 2060 ' ' PRO . . . . . . . . . . . . . 42.1 Cg_endo -62.22 157.71 43.55 Favored 'Trans proline' 0 N--CA 1.451 -1.001 0 C-N-CA 123.257 2.638 . . . . 0.0 111.735 -171.194 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B 2061 ' ' SER . . . . . . . . . . . . . 45.7 t -149.45 168.45 23.4 Favored 'General case' 0 N--CA 1.452 -0.352 0 CA-C-N 115.703 -0.68 . . . . 0.0 109.725 -178.207 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B 2062 ' ' ILE . . . . . . . . . . . . . 11.6 tt -158.61 153.64 5.63 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.174 0 N-CA-C 109.237 -0.653 . . . . 0.0 109.237 -174.559 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B 2063 ' ' SER . . . . . . . . . . . . . 48.4 t . . . . . 0 C--O 1.252 1.196 0 CA-C-O 117.992 -1.004 . . . . 0.0 111.9 179.452 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 56.5 ttp . . . . . 0 N--CA 1.474 0.726 0 CA-C-O 119.248 -0.406 . . . . 0.0 111.565 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 41.7 tp60 60.77 35.19 19.63 Favored 'General case' 0 CA--C 1.531 0.245 0 CA-C-O 121.748 0.785 . . . . 0.0 110.818 178.204 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 12.0 tt0 -153.43 164.14 38.71 Favored 'General case' 0 N--CA 1.45 -0.44 0 N-CA-C 108.58 -0.896 . . . . 0.0 108.58 -179.237 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 14.0 m-20 55.09 26.28 8.02 Favored 'General case' 0 C--O 1.23 0.074 0 C-N-CA 123.567 0.747 . . . . 0.0 112.899 179.572 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 31.5 t0 56.35 38.15 29.48 Favored 'General case' 0 C--N 1.331 -0.227 0 C-N-CA 124.022 0.929 . . . . 0.0 111.534 -179.68 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 31.3 p-10 -57.65 -34.06 68.95 Favored 'General case' 0 N--CA 1.454 -0.256 0 N-CA-C 110.283 -0.265 . . . . 0.0 110.283 179.456 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 7' ' ' PHE . . . . . 0.514 ' CD1' ' HD3' ' A' ' 45' ' ' LYS . 1.3 t80 -57.28 -41.84 80.53 Favored 'General case' 0 N--CA 1.451 -0.376 0 C-N-CA 123.496 0.718 . . . . 0.0 111.714 -179.658 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 46.1 tp60 -53.73 -33.94 57.27 Favored 'General case' 0 N--CA 1.456 -0.127 0 C-N-CA 122.777 0.431 . . . . 0.0 111.653 -176.537 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 18.8 m-80 -70.92 -31.12 67.63 Favored 'General case' 0 N--CA 1.451 -0.398 0 N-CA-C 109.944 -0.391 . . . . 0.0 109.944 -179.964 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 10' ' ' PHE . . . . . 0.467 ' CE2' ' HB2' ' A' ' 32' ' ' LEU . 10.9 t80 -71.54 -39.02 70.97 Favored 'General case' 0 N--CA 1.452 -0.343 0 N-CA-C 109.419 -0.586 . . . . 0.0 109.419 176.189 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 57.5 t -63.15 -55.83 21.01 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.359 0 N-CA-C 109.18 -0.674 . . . . 0.0 109.18 179.059 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -60.24 -29.22 68.62 Favored 'General case' 0 N--CA 1.453 -0.291 0 C-N-CA 123.277 0.631 . . . . 0.0 112.161 -179.922 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 99.9 m -72.62 -39.74 67.02 Favored 'General case' 0 CA--C 1.53 0.211 0 CA-C-N 118.904 0.775 . . . . 0.0 109.403 177.268 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.485 ' HA ' ' CD1' ' A' ' 17' ' ' PHE . 14.2 tp -65.23 -46.71 79.51 Favored 'General case' 0 N--CA 1.454 -0.233 0 CA-C-O 121.644 0.735 . . . . 0.0 109.467 178.192 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 69.0 mm-40 -63.4 -29.58 70.85 Favored 'General case' 0 N--CA 1.45 -0.443 0 C-N-CA 124.136 0.974 . . . . 0.0 110.048 178.898 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 42.3 t -69.46 -32.24 71.04 Favored 'General case' 0 N--CA 1.452 -0.336 0 N-CA-C 109.679 -0.489 . . . . 0.0 109.679 177.375 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 17' ' ' PHE . . . . . 0.485 ' CD1' ' HA ' ' A' ' 14' ' ' LEU . 19.7 m-85 -63.61 -42.05 98.25 Favored 'General case' 0 N--CA 1.454 -0.25 0 C-N-CA 119.388 -0.925 . . . . 0.0 109.604 172.559 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 67.1 mttt -61.82 -28.54 69.55 Favored 'General case' 0 C--N 1.341 0.2 0 O-C-N 122.985 0.178 . . . . 0.0 110.833 -178.776 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 54.5 t0 -73.95 -43.62 57.63 Favored 'General case' 0 N--CA 1.455 -0.177 0 O-C-N 123.48 0.488 . . . . 0.0 111.019 178.829 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 20' ' ' LEU . . . . . 0.442 HD12 ' HB2' ' A' ' 25' ' ' SER . 63.6 mt -57.82 144.13 39.75 Favored 'General case' 0 N--CA 1.454 -0.228 0 O-C-N 122.048 -0.408 . . . . 0.0 111.073 -177.157 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 21' ' ' LYS . . . . . 0.508 ' HE2' ' OD1' ' B' 2052 ' ' ASP . 1.0 OUTLIER -83.7 -22.86 31.92 Favored 'General case' 0 N--CA 1.453 -0.323 0 N-CA-C 109.652 -0.499 . . . . 0.0 109.652 177.001 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 22' ' ' SER . . . . . 0.418 ' C ' ' H ' ' A' ' 24' ' ' ILE . 68.8 m -75.36 -24.09 57.26 Favored 'General case' 0 N--CA 1.456 -0.148 0 N-CA-C 109.832 -0.433 . . . . 0.0 109.832 170.335 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 70.64 -31.69 0.48 Allowed Glycine 0 CA--C 1.527 0.799 0 C-N-CA 124.883 1.23 . . . . 0.0 112.103 179.689 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 24' ' ' ILE . . . . . 0.418 ' H ' ' C ' ' A' ' 22' ' ' SER . 47.2 mt -87.23 154.95 3.28 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.523 0 C-N-CA 123.801 0.841 . . . . 0.0 109.143 173.881 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 25' ' ' SER . . . . . 0.442 ' HB2' HD12 ' A' ' 20' ' ' LEU . 32.7 t -158.29 81.46 0.83 Allowed 'General case' 0 CA--C 1.517 -0.319 0 N-CA-C 109.886 -0.413 . . . . 0.0 109.886 177.82 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -50.58 -33.01 25.13 Favored Glycine 0 CA--C 1.529 0.927 0 CA-C-O 119.499 -0.612 . . . . 0.0 112.43 -175.442 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 40.3 t -73.13 -52.39 14.38 Favored 'General case' 0 N--CA 1.453 -0.298 0 CA-C-N 118.205 1.003 . . . . 0.0 110.771 -179.709 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 82.6 mtt85 -69.88 -31.74 69.71 Favored 'General case' 0 C--N 1.34 0.189 0 CA-C-N 117.544 0.156 . . . . 0.0 110.681 -177.491 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 53.0 mt -59.77 -45.81 94.28 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.724 0 N-CA-C 108.164 -1.05 . . . . 0.0 108.164 174.423 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 33.5 mtmm -68.22 -23.32 64.8 Favored 'General case' 0 N--CA 1.454 -0.234 0 CA-C-O 118.606 -0.711 . . . . 0.0 111.869 177.06 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 31' ' ' LYS . . . . . 0.413 ' HA ' ' HE3' ' A' ' 31' ' ' LYS . 0.0 OUTLIER -65.04 -59.4 4.19 Favored 'General case' 0 C--N 1.341 0.197 0 CA-C-N 119.341 0.973 . . . . 0.0 110.281 177.777 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.487 HD12 ' N ' ' A' ' 33' ' ' THR . 1.2 pp -75.29 -17.94 60.17 Favored 'General case' 0 CA--C 1.531 0.245 0 C-N-CA 119.47 -0.892 . . . . 0.0 112.068 -177.271 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 33' ' ' THR . . . . . 0.487 ' N ' HD12 ' A' ' 32' ' ' LEU . 55.2 m -72.66 -38.75 67.55 Favored 'General case' 0 N--CA 1.457 -0.123 0 N-CA-C 108.898 -0.779 . . . . 0.0 108.898 175.684 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 98.8 m -70.4 -37.4 74.46 Favored 'General case' 0 N--CA 1.453 -0.321 0 N-CA-C 109.861 -0.422 . . . . 0.0 109.861 179.995 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 19.8 t80 -61.64 -38.26 87.05 Favored 'General case' 0 C--N 1.34 0.159 0 N-CA-C 109.962 -0.385 . . . . 0.0 109.962 175.359 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -68.07 -37.54 81.38 Favored 'General case' 0 N--CA 1.447 -0.621 0 CA-C-N 116.791 -0.186 . . . . 0.0 110.945 -179.331 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 3.2 mm? -71.05 -35.97 72.15 Favored 'General case' 0 CA--C 1.522 -0.114 0 C-N-CA 122.096 0.158 . . . . 0.0 110.948 -179.369 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 41.5 t0 -72.86 -14.62 61.53 Favored 'General case' 0 N--CA 1.452 -0.337 0 C-N-CA 122.472 0.309 . . . . 0.0 110.588 177.238 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 96.6 m-70 -151.52 88.99 1.45 Allowed 'General case' 0 CA--C 1.53 0.192 0 C-N-CA 122.935 0.494 . . . . 0.0 111.411 -173.897 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -75.42 -12.71 14.88 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.232 0 O-C-N 122.023 -0.423 . . . . 0.0 111.024 175.707 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -57.24 -24.38 54.33 Favored 'General case' 0 C--O 1.228 -0.045 0 C-N-CA 123.34 0.656 . . . . 0.0 111.762 -176.404 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -106.98 18.63 5.77 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.24 0 C-N-CA 123.291 0.637 . . . . 0.0 112.58 178.768 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 3.0 pp20? -54.0 -28.61 39.03 Favored 'General case' 0 CA--C 1.528 0.129 0 CA-C-N 118.723 0.692 . . . . 0.0 111.7 177.848 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 29.6 t -65.39 -46.14 81.27 Favored 'General case' 0 N--CA 1.452 -0.335 0 O-C-N 122.384 -0.198 . . . . 0.0 110.936 -176.199 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 45' ' ' LYS . . . . . 0.514 ' HD3' ' CD1' ' A' ' 7' ' ' PHE . 19.2 ptpt -74.69 -26.9 60.15 Favored 'General case' 0 C--N 1.339 0.13 0 N-CA-C 109.566 -0.531 . . . . 0.0 109.566 177.908 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 61.0 mt -68.63 -48.8 69.88 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.228 0 N-CA-C 109.823 -0.436 . . . . 0.0 109.823 -179.036 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 47' ' ' ILE . . . . . 0.435 HD13 HD11 ' A' ' 50' ' ' ILE . 35.4 mm -63.84 -38.25 81.86 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.249 0 N-CA-C 109.065 -0.717 . . . . 0.0 109.065 176.944 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 49.8 m -63.33 -42.64 98.99 Favored 'General case' 0 CA--C 1.531 0.23 0 C-N-CA 120.82 -0.352 . . . . 0.0 111.5 -178.345 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 6.9 mp -73.51 -36.35 65.72 Favored 'General case' 0 N--CA 1.453 -0.276 0 N-CA-C 112.652 0.612 . . . . 0.0 112.652 -176.332 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 50' ' ' ILE . . . . . 0.468 HD12 HG12 ' A' ' 69' ' ' ILE . 5.5 pt -71.63 -44.4 69.76 Favored 'Isoleucine or valine' 0 C--N 1.34 0.169 0 CA-C-N 119.352 0.978 . . . . 0.0 110.846 -178.55 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 51' ' ' ILE . . . . . 0.526 HG22 HD11 ' A' ' 108' ' ' LEU . 16.2 pt -66.12 -38.04 81.1 Favored 'Isoleucine or valine' 0 C--N 1.335 -0.055 0 C-N-CA 120.192 -0.603 . . . . 0.0 110.785 -179.783 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 90.7 m-20 -70.86 -41.07 71.9 Favored 'General case' 0 N--CA 1.454 -0.274 0 CA-C-N 118.107 0.412 . . . . 0.0 111.756 178.365 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 18.8 t80 -63.61 -41.3 98.32 Favored 'General case' 0 N--CA 1.455 -0.182 0 N-CA-C 109.081 -0.711 . . . . 0.0 109.081 175.93 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 23.3 t -62.25 -38.91 91.05 Favored 'General case' 0 N--CA 1.45 -0.462 0 C-N-CA 122.437 0.295 . . . . 0.0 111.435 -176.64 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 55.6 mtm180 -75.12 -40.88 59.47 Favored 'General case' 0 N--CA 1.456 -0.156 0 N-CA-C 111.913 0.338 . . . . 0.0 111.913 -177.239 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 48.7 mt -80.46 -44.52 19.1 Favored 'General case' 0 N--CA 1.455 -0.206 0 N-CA-C 113.221 0.823 . . . . 0.0 113.221 -176.023 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 14.5 p -62.68 159.45 43.58 Favored Pre-proline 0 CA--C 1.535 0.382 0 N-CA-C 114.241 1.2 . . . . 0.0 114.241 -170.701 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 35.9 Cg_exo -58.79 -179.51 0.15 Allowed 'Trans proline' 0 N--CA 1.454 -0.822 1 C-N-CA 125.758 4.306 . . . . 0.0 113.746 174.423 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 42.3 p-10 -66.4 -42.65 87.52 Favored 'General case' 0 CA--C 1.533 0.298 0 C-N-CA 124.534 1.134 . . . . 0.0 113.364 -175.013 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 39.8 m -72.75 -37.03 67.81 Favored 'General case' 0 N--CA 1.455 -0.189 0 O-C-N 121.773 -0.58 . . . . 0.0 109.762 179.74 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 55.4 m80 -69.02 -27.87 66.06 Favored 'General case' 0 N--CA 1.45 -0.425 0 CA-C-N 116.176 -0.465 . . . . 0.0 109.867 176.025 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 62' ' ' LYS . . . . . 0.487 ' HE3' ' HB2' ' A' ' 112' ' ' ALA . 56.4 tptt -65.88 -45.39 82.24 Favored 'General case' 0 C--N 1.338 0.108 0 C-N-CA 122.623 0.369 . . . . 0.0 110.025 177.877 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 63' ' ' LEU . . . . . 0.515 HD12 ' CD2' ' A' ' 120' ' ' HIS . 0.3 OUTLIER -61.29 -41.94 97.82 Favored 'General case' 0 N--CA 1.455 -0.213 0 N-CA-C 108.458 -0.941 . . . . 0.0 108.458 177.641 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -65.22 -29.26 74.87 Favored Glycine 0 CA--C 1.527 0.791 0 N-CA-C 111.964 -0.454 . . . . 0.0 111.964 178.554 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 37.0 p -68.7 -37.1 79.26 Favored 'General case' 0 N--CA 1.451 -0.375 0 CA-C-N 117.931 0.866 . . . . 0.0 110.062 178.462 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 95.1 mt -75.32 -24.81 57.47 Favored 'General case' 0 N--CA 1.452 -0.338 0 CA-C-N 116.596 -0.275 . . . . 0.0 110.726 178.98 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 9.6 m-30 -70.69 -36.01 73.08 Favored 'General case' 0 CA--C 1.515 -0.374 0 CA-C-N 118.338 0.517 . . . . 0.0 110.422 174.007 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 68' ' ' ILE . . . . . 0.472 HD11 ' CE1' ' A' ' 17' ' ' PHE . 22.0 mt -68.29 -54.3 22.76 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.621 0 N-CA-C 107.448 -1.315 . . . . 0.0 107.448 177.69 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 69' ' ' ILE . . . . . 0.468 HG12 HD12 ' A' ' 50' ' ' ILE . 65.5 mt -50.39 -37.14 14.28 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.174 0 C-N-CA 123.885 0.874 . . . . 0.0 111.802 175.021 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 8.8 t70 -71.06 -54.85 9.71 Favored 'General case' 0 CA--C 1.521 -0.147 0 CA-C-N 118.819 0.736 . . . . 0.0 111.487 -179.737 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 53.6 p -66.87 -44.26 81.4 Favored 'General case' 0 N--CA 1.452 -0.373 0 O-C-N 123.161 0.288 . . . . 0.0 110.499 -175.25 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -75.13 -36.65 38.22 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.246 0 N-CA-C 109.629 -0.508 . . . . 0.0 109.629 179.731 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -67.09 -46.15 75.32 Favored Glycine 0 C--N 1.337 0.622 0 N-CA-C 111.417 -0.673 . . . . 0.0 111.417 -175.351 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 39.0 mtm105 -69.81 -42.61 73.47 Favored 'General case' 0 CA--C 1.517 -0.309 0 CA-C-N 117.37 0.585 . . . . 0.0 109.906 177.913 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -64.83 -33.88 77.05 Favored 'General case' 0 N--CA 1.45 -0.432 0 CA-C-O 119.335 -0.364 . . . . 0.0 110.918 -178.191 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 1.0 OUTLIER -68.18 -45.45 73.4 Favored 'General case' 0 CA--C 1.519 -0.241 0 CA-C-N 118.571 0.623 . . . . 0.0 110.929 177.076 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 77' ' ' LEU . . . . . 0.436 ' HA ' ' SG ' ' A' ' 94' ' ' CYS . 6.5 tt -66.62 -48.17 70.33 Favored 'General case' 0 N--CA 1.447 -0.596 0 C-N-CA 118.249 -1.381 . . . . 0.0 108.24 -178.266 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 90.4 m-20 -54.19 -44.96 72.0 Favored 'General case' 0 C--O 1.228 -0.079 0 N-CA-C 112.864 0.69 . . . . 0.0 112.864 177.979 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 15.5 tm-20 -61.53 -50.2 73.64 Favored 'General case' 0 N--CA 1.448 -0.548 0 CA-C-N 117.878 0.308 . . . . 0.0 111.117 -177.752 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 80' ' ' THR . . . . . 0.625 HG21 ' HB3' ' A' ' 94' ' ' CYS . 31.6 p -72.82 -26.88 61.65 Favored 'General case' 0 N--CA 1.453 -0.276 0 C-N-CA 120.477 -0.489 . . . . 0.0 110.412 -178.12 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 33.2 ttp180 -70.4 -23.7 62.8 Favored 'General case' 0 N--CA 1.45 -0.448 0 C-N-CA 123.676 0.79 . . . . 0.0 111.061 175.022 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 34.0 t -84.1 -14.04 51.45 Favored 'General case' 0 N--CA 1.454 -0.262 0 N-CA-C 113.14 0.793 . . . . 0.0 113.14 -179.13 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 26.6 p30 -151.94 16.61 0.66 Allowed 'General case' 0 CA--C 1.519 -0.223 0 N-CA-C 114.064 1.135 . . . . 0.0 114.064 -175.292 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 25.2 p 63.22 19.22 11.54 Favored 'General case' 0 N--CA 1.448 -0.557 0 N-CA-C 114.501 1.297 . . . . 0.0 114.501 174.599 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 99.1 m-20 -55.13 -24.5 26.47 Favored 'General case' 0 CA--C 1.53 0.201 0 CA-C-N 119.182 0.901 . . . . 0.0 111.556 179.661 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 40.7 t -68.28 -7.48 31.2 Favored 'General case' 0 CA--C 1.531 0.24 0 C-N-CA 122.685 0.394 . . . . 0.0 111.946 -178.781 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 92.8 p -83.79 -15.08 49.76 Favored 'General case' 0 C--N 1.339 0.144 0 C-N-CA 122.683 0.393 . . . . 0.0 111.355 176.93 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 86.5 p -81.84 -157.62 0.2 Allowed 'General case' 0 CA--C 1.531 0.22 0 C-N-CA 123.411 0.685 . . . . 0.0 110.231 -179.061 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 2.0 p-10 -55.12 143.07 28.42 Favored 'General case' 0 CA--C 1.528 0.128 0 C-N-CA 122.953 0.501 . . . . 0.0 109.872 178.906 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -71.29 -64.89 1.04 Allowed Pre-proline 0 N--CA 1.456 -0.128 0 CA-C-O 118.073 -0.965 . . . . 0.0 110.702 -175.917 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 31.5 Cg_exo -59.53 139.21 88.15 Favored 'Trans proline' 0 N--CA 1.447 -1.211 0 N-CA-C 108.209 -1.496 . . . . 0.0 108.209 172.987 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 90.68 16.57 54.6 Favored Glycine 0 CA--C 1.526 0.766 0 CA-C-O 119.369 -0.684 . . . . 0.0 112.28 -176.756 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 78.0 p -151.2 172.17 16.25 Favored 'General case' 0 N--CA 1.455 -0.213 0 CA-C-N 118.05 0.925 . . . . 0.0 111.349 176.307 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 94' ' ' CYS . . . . . 0.625 ' HB3' HG21 ' A' ' 80' ' ' THR . 5.3 t -57.03 -27.21 61.44 Favored 'General case' 0 N--CA 1.451 -0.422 0 CA-C-N 115.196 -0.911 . . . . 0.0 109.91 173.376 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -56.11 -59.25 5.19 Favored 'General case' 0 N--CA 1.446 -0.653 0 N-CA-C 109.384 -0.599 . . . . 0.0 109.384 -176.189 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 73.6 t60 -74.59 -34.44 62.87 Favored 'General case' 0 N--CA 1.45 -0.472 0 CA-C-N 116.36 -0.382 . . . . 0.0 111.419 -179.152 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -64.93 -50.67 65.55 Favored 'General case' 0 N--CA 1.454 -0.261 0 O-C-N 122.969 0.168 . . . . 0.0 111.356 -177.145 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 98' ' ' ILE . . . . . 0.593 HD13 ' SG ' ' A' ' 94' ' ' CYS . 1.7 mp -73.61 -32.31 35.31 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.207 0 N-CA-C 110.033 -0.358 . . . . 0.0 110.033 -178.32 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 30.2 m-20 -67.11 -45.24 77.79 Favored 'General case' 0 N--CA 1.453 -0.306 0 CA-C-N 118.062 0.392 . . . . 0.0 111.101 176.838 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 95.9 m -70.67 -33.64 71.16 Favored 'General case' 0 N--CA 1.457 -0.12 0 CA-C-N 117.947 0.339 . . . . 0.0 110.497 -177.109 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 68.4 tp -73.58 -30.39 62.99 Favored 'General case' 0 N--CA 1.451 -0.408 0 C-N-CA 122.661 0.385 . . . . 0.0 110.946 -179.104 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -70.09 -19.84 75.91 Favored Glycine 0 CA--C 1.529 0.922 0 CA-C-O 119.555 -0.581 . . . . 0.0 112.828 -176.998 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 14.6 mm-40 -80.23 -39.46 29.01 Favored 'General case' 0 C--O 1.231 0.125 0 CA-C-N 118.008 0.904 . . . . 0.0 111.381 179.998 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 30.3 m -97.87 -8.87 9.09 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.158 0 N-CA-C 113.177 0.806 . . . . 0.0 113.177 -173.868 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 105' ' ' ILE . . . . . . . . . . . . . 10.6 tp -57.15 -26.78 26.09 Favored 'Isoleucine or valine' 0 CA--C 1.528 0.124 0 CA-C-N 119.162 0.892 . . . . 0.0 111.655 -176.716 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 106' ' ' GLN . . . . . 0.401 ' HA ' ' CD1' ' A' ' 145' ' ' ILE . 25.4 pt20 -67.48 -30.04 69.64 Favored 'General case' 0 N--CA 1.454 -0.267 0 O-C-N 122.182 -0.324 . . . . 0.0 110.523 178.852 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 66.5 mt-10 -73.98 -41.6 61.68 Favored 'General case' 0 N--CA 1.455 -0.201 0 N-CA-C 108.795 -0.817 . . . . 0.0 108.795 177.315 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 108' ' ' LEU . . . . . 0.526 HD11 HG22 ' A' ' 51' ' ' ILE . 41.1 mt -68.65 -42.73 77.53 Favored 'General case' 0 N--CA 1.449 -0.505 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.573 -174.348 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 95.9 mt -72.61 -47.1 50.58 Favored 'General case' 0 N--CA 1.451 -0.416 0 CA-C-O 119.01 -0.519 . . . . 0.0 111.319 -179.033 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 44.6 t -61.89 -41.19 97.58 Favored 'General case' 0 C--O 1.233 0.204 0 CA-C-N 118.849 0.75 . . . . 0.0 110.684 -179.295 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 22.6 t0 -59.25 -40.26 85.43 Favored 'General case' 0 N--CA 1.453 -0.289 0 N-CA-C 108.469 -0.937 . . . . 0.0 108.469 174.7 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 112' ' ' ALA . . . . . 0.487 ' HB2' ' HE3' ' A' ' 62' ' ' LYS . . . -69.33 -38.75 78.32 Favored 'General case' 0 N--CA 1.443 -0.779 0 C-N-CA 120.603 -0.439 . . . . 0.0 111.138 -175.768 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 113' ' ' ILE . . . . . 0.45 ' O ' ' HE2' ' A' ' 121' ' ' LYS . 36.6 mm -66.21 -42.37 90.92 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.473 0 C-N-CA 118.809 -1.156 . . . . 0.0 109.739 -178.276 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -71.96 -46.86 55.9 Favored 'General case' 0 N--CA 1.451 -0.422 0 N-CA-C 111.555 0.205 . . . . 0.0 111.555 -178.899 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 33.1 ttpt -76.77 -37.25 56.22 Favored 'General case' 0 N--CA 1.451 -0.384 0 N-CA-C 113.497 0.925 . . . . 0.0 113.497 -175.405 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 116' ' ' SER . . . . . 0.488 ' HB2' ' CB ' ' A' ' 120' ' ' HIS . 24.4 p -76.54 159.82 30.0 Favored 'General case' 0 CA--C 1.527 0.095 0 N-CA-C 112.605 0.595 . . . . 0.0 112.605 -170.678 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 11.6 m120 -76.68 168.4 20.15 Favored 'General case' 0 CA--C 1.519 -0.236 0 C-N-CA 123.227 0.611 . . . . 0.0 111.851 -179.719 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 118' ' ' GLN . . . . . . . . . . . . . 12.7 mm100 -53.75 -42.23 67.96 Favored 'General case' 0 C--O 1.233 0.216 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.559 -178.394 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 18.4 t0 -66.67 -32.73 74.23 Favored 'General case' 0 N--CA 1.456 -0.164 0 N-CA-C 109.303 -0.628 . . . . 0.0 109.303 -179.622 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 120' ' ' HIS . . . . . 0.515 ' CD2' HD12 ' A' ' 63' ' ' LEU . 20.8 m170 -76.05 -40.38 53.48 Favored 'General case' 0 N--CA 1.449 -0.491 0 CA-C-N 116.002 -0.544 . . . . 0.0 110.073 -178.859 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 121' ' ' LYS . . . . . 0.45 ' HE2' ' O ' ' A' ' 113' ' ' ILE . 96.0 mttt -54.98 -41.04 70.69 Favored 'General case' 0 C--N 1.339 0.118 0 N-CA-C 108.222 -1.029 . . . . 0.0 108.222 177.932 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 46.0 tp10 -70.63 -39.31 73.79 Favored 'General case' 0 CA--C 1.53 0.178 0 N-CA-C 111.467 0.173 . . . . 0.0 111.467 178.222 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 92.0 mttt -71.36 -26.43 62.8 Favored 'General case' 0 N--CA 1.452 -0.335 0 O-C-N 121.835 -0.541 . . . . 0.0 110.827 -179.266 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 124' ' ' ILE . . . . . . . . . . . . . 69.1 mt -69.99 -40.25 78.37 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.244 0 N-CA-C 108.653 -0.869 . . . . 0.0 108.653 174.233 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 125' ' ' ARG . . . . . 0.446 HH11 ' HA ' ' A' ' 125' ' ' ARG . 6.6 mmm180 -61.28 -48.41 81.53 Favored 'General case' 0 N--CA 1.45 -0.433 0 CA-C-O 118.899 -0.572 . . . . 0.0 111.518 179.269 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 126' ' ' MET . . . . . . . . . . . . . 28.7 ptm -62.96 -30.11 71.33 Favored 'General case' 0 N--CA 1.453 -0.284 0 C-N-CA 119.183 -1.007 . . . . 0.0 109.299 179.217 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 1.2 mp -62.44 -39.29 92.86 Favored 'General case' 0 C--N 1.339 0.146 0 CA-C-N 118.187 0.449 . . . . 0.0 111.037 175.957 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 80.8 mt -72.72 -36.76 67.87 Favored 'General case' 0 N--CA 1.455 -0.223 0 CA-C-N 118.488 0.586 . . . . 0.0 110.127 179.614 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 15.1 m-20 -65.71 -35.84 81.91 Favored 'General case' 0 N--CA 1.454 -0.274 0 N-CA-C 109.351 -0.611 . . . . 0.0 109.351 176.624 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 130' ' ' ILE . . . . . 0.412 ' HA ' ' HD3' ' A' ' 133' ' ' ARG . 35.7 mt -63.62 -36.43 76.41 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.229 0 C-N-CA 122.487 0.315 . . . . 0.0 110.212 176.423 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 131' ' ' TRP . . . . . . . . . . . . . 46.4 m0 -73.8 -31.01 63.05 Favored 'General case' 0 N--CA 1.449 -0.481 0 N-CA-C 112.899 0.703 . . . . 0.0 112.899 179.54 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 82.9 m-20 -70.36 -34.3 72.45 Favored 'General case' 0 N--CA 1.456 -0.172 0 CA-C-N 118.458 0.572 . . . . 0.0 110.577 176.889 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 133' ' ' ARG . . . . . 0.446 ' HB2' HD11 ' B' 2062 ' ' ILE . 23.1 mtp180 -72.36 -33.94 67.63 Favored 'General case' 0 N--CA 1.456 -0.163 0 C-N-CA 123.221 0.608 . . . . 0.0 109.823 177.747 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 37.0 m -80.47 -14.59 58.14 Favored 'General case' 0 N--CA 1.453 -0.3 0 C-N-CA 123.409 0.684 . . . . 0.0 111.973 -178.918 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 135' ' ' GLY . . . . . . . . . . . . . . . 85.09 11.5 76.04 Favored Glycine 0 CA--C 1.53 1.008 0 CA-C-O 119.121 -0.822 . . . . 0.0 113.564 177.538 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 136' ' ' LEU . . . . . . . . . . . . . 11.0 mp -69.01 154.58 41.83 Favored 'General case' 0 C--O 1.232 0.133 0 CA-C-N 118.759 1.28 . . . . 0.0 109.292 177.612 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 137' ' ' PHE . . . . . . . . . . . . . 81.9 m-85 -77.68 -22.32 50.72 Favored 'General case' 0 N--CA 1.453 -0.295 0 N-CA-C 112.189 0.44 . . . . 0.0 112.189 -175.672 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 138' ' ' GLN . . . . . . . . . . . . . 25.9 mp0 -75.15 132.88 41.49 Favored 'General case' 0 N--CA 1.455 -0.193 0 C-N-CA 122.845 0.458 . . . . 0.0 110.802 -178.809 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 139' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -174.74 175.71 2.38 Favored 'General case' 0 C--N 1.341 0.211 0 C-N-CA 123.916 0.886 . . . . 0.0 110.807 175.618 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 140' ' ' SER . . . . . . . . . . . . . 42.6 t -74.08 64.48 1.04 Allowed 'General case' 0 N--CA 1.454 -0.238 0 C-N-CA 124.336 1.054 . . . . 0.0 112.977 -176.351 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 141' ' ' TYR . . . . . . . . . . . . . 86.0 m-85 -66.36 -72.94 0.14 Allowed 'General case' 0 N--CA 1.455 -0.178 0 O-C-N 122.014 -0.429 . . . . 0.0 109.876 174.777 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 142' ' ' LEU . . . . . . . . . . . . . 73.2 mt -69.78 155.57 40.34 Favored 'General case' 0 N--CA 1.454 -0.267 0 C-N-CA 123.249 0.62 . . . . 0.0 111.844 -175.396 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 21.1 p30 -68.83 -11.56 60.58 Favored 'General case' 0 N--CA 1.453 -0.283 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.621 177.446 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . -68.12 -32.23 72.38 Favored 'General case' 0 N--CA 1.454 -0.253 0 N-CA-C 110.155 -0.313 . . . . 0.0 110.155 177.046 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 145' ' ' ILE . . . . . 0.401 ' CD1' ' HA ' ' A' ' 106' ' ' GLN . 29.5 mm -69.38 -26.75 32.12 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.262 0 N-CA-C 109.812 -0.44 . . . . 0.0 109.812 177.549 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 146' ' ' ARG . . . . . . . . . . . . . 81.7 mtt85 -81.17 -34.0 32.66 Favored 'General case' 0 N--CA 1.451 -0.378 0 N-CA-C 110.188 -0.301 . . . . 0.0 110.188 177.774 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 147' ' ' SER . . . . . . . . . . . . . 37.7 m 41.85 50.65 4.1 Favored 'General case' 0 C--N 1.344 0.359 0 C-N-CA 123.647 0.779 . . . . 0.0 110.893 178.793 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -36.91 -41.74 0.35 Allowed 'General case' 0 N--CA 1.448 -0.555 0 C-N-CA 126.279 1.832 . . . . 0.0 113.145 179.471 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 149' ' ' CYS . . . . . . . . . . . . . 13.9 p -71.29 -61.42 1.78 Allowed 'General case' 0 N--CA 1.448 -0.529 0 N-CA-C 109.976 -0.379 . . . . 0.0 109.976 -177.186 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 150' ' ' PHE . . . . . . . . . . . . . 15.6 m-85 -66.89 -16.31 64.23 Favored 'General case' 0 N--CA 1.454 -0.256 0 CA-C-N 118.561 0.618 . . . . 0.0 111.421 -175.399 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 151' ' ' ALA . . . . . . . . . . . . . . . -73.94 -46.69 42.61 Favored 'General case' 0 N--CA 1.449 -0.497 0 CA-C-O 119.438 -0.315 . . . . 0.0 110.447 176.546 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 152' ' ' MET . . . . . . . . . . . . . 93.4 mtp -85.74 -31.47 22.39 Favored 'General case' 0 CA--C 1.532 0.258 0 N-CA-C 112.71 0.633 . . . . 0.0 112.71 -179.259 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 153' ' ' ASP . . . . . . . . . . . . . 72.6 m-20 -74.55 -12.73 60.54 Favored 'General case' 0 N--CA 1.455 -0.221 0 C-N-CA 124.009 0.924 . . . . 0.0 112.735 -175.627 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 154' ' ' LEU . . . . . . . . . . . . . 79.6 mt -126.81 144.65 50.9 Favored 'General case' 0 N--CA 1.453 -0.322 0 CA-C-N 118.274 0.488 . . . . 0.0 110.799 -176.823 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 155' ' ' GLU . . . . . . . . . . . . . 1.9 pp20? -137.72 4.85 2.6 Favored 'General case' 0 N--CA 1.455 -0.221 0 C-N-CA 123.746 0.818 . . . . 0.0 111.454 -177.293 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 156' ' ' HIS . . . . . . . . . . . . . 33.1 p-80 -59.77 128.92 39.34 Favored 'General case' 0 N--CA 1.451 -0.423 0 CA-C-O 121.304 0.574 . . . . 0.0 111.389 -172.01 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 157' ' ' HIS . . . . . . . . . . . . . 1.3 t60 -161.83 19.78 0.11 Allowed 'General case' 0 CA--C 1.532 0.257 0 C-N-CA 124.855 1.262 . . . . 0.0 108.31 175.222 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 158' ' ' HIS . . . . . . . . . . . . . 16.6 p80 -156.07 169.66 23.97 Favored 'General case' 0 N--CA 1.45 -0.459 0 C-N-CA 123.968 0.907 . . . . 0.0 109.378 -170.929 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 159' ' ' HIS . . . . . . . . . . . . . 50.2 p-80 . . . . . 0 C--O 1.25 1.125 0 CA-C-O 117.295 -1.336 . . . . 0.0 109.826 -179.461 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' B' B 2052 ' ' ASP . . . . . 0.508 ' OD1' ' HE2' ' A' ' 21' ' ' LYS . 0.8 OUTLIER . . . . . 0 N--CA 1.472 0.661 0 CA-C-O 120.276 0.084 . . . . 0.0 110.793 . . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B 2053 ' ' ASP . . . . . . . . . . . . . 35.9 p-10 -100.7 9.04 42.94 Favored 'General case' 0 CA--C 1.532 0.257 0 C-N-CA 123.736 0.814 . . . . 0.0 112.464 -176.027 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B 2054 ' ' ASP . . . . . . . . . . . . . 3.0 p-10 -140.1 -158.5 0.86 Allowed 'General case' 0 N--CA 1.454 -0.249 0 CA-C-N 118.863 0.756 . . . . 0.0 111.218 -179.71 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B 2055 ' ' GLU . . . . . . . . . . . . . 41.5 mt-10 -59.89 -21.68 61.36 Favored 'General case' 0 CA--C 1.529 0.143 0 C-N-CA 124.135 0.974 . . . . 0.0 112.411 -176.539 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B 2056 ' ' ASP . . . . . . . . . . . . . 17.8 m-20 47.56 -118.26 0.91 Allowed 'General case' 0 N--CA 1.454 -0.258 0 C-N-CA 123.256 0.622 . . . . 0.0 110.922 -175.106 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B 2057 ' ' ASP . . . . . . . . . . . . . 43.1 t0 -55.5 96.7 0.02 OUTLIER 'General case' 0 CA--C 1.531 0.237 0 C-N-CA 123.761 0.824 . . . . 0.0 112.084 -173.195 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B 2058 ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -71.82 137.92 47.94 Favored 'General case' 0 N--CA 1.454 -0.262 0 C-N-CA 124.277 1.031 . . . . 0.0 110.673 -178.89 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B 2059 ' ' THR . . . . . . . . . . . . . 60.2 m -106.95 114.04 61.97 Favored Pre-proline 0 N--CA 1.453 -0.278 0 N-CA-C 109.199 -0.667 . . . . 0.0 109.199 178.158 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B 2060 ' ' PRO . . . . . . . . . . . . . 93.4 Cg_endo -74.26 132.5 16.54 Favored 'Trans proline' 0 N--CA 1.452 -0.968 0 C-N-CA 123.13 2.554 . . . . 0.0 111.348 -179.401 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B 2061 ' ' SER . . . . . . . . . . . . . 43.4 m -83.31 138.21 33.65 Favored 'General case' 0 N--CA 1.454 -0.232 0 N-CA-C 108.562 -0.903 . . . . 0.0 108.562 172.231 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B 2062 ' ' ILE . . . . . 0.446 HD11 ' HB2' ' A' ' 133' ' ' ARG . 5.9 tp -160.67 137.48 2.06 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.203 0 N-CA-C 112.693 0.627 . . . . 0.0 112.693 -176.973 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B 2063 ' ' SER . . . . . 0.414 ' C ' HH21 ' A' ' 133' ' ' ARG . 82.4 p . . . . . 0 C--O 1.251 1.173 0 CA-C-O 117.266 -1.349 . . . . 0.0 109.533 175.516 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 85.9 mtp . . . . . 0 N--CA 1.469 0.517 0 CA-C-O 119.239 -0.41 . . . . 0.0 110.727 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 24.5 mp0 -132.63 8.13 4.18 Favored 'General case' 0 C--N 1.341 0.23 0 N-CA-C 112.985 0.735 . . . . 0.0 112.985 -179.372 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 44.6 tp60 -153.0 -31.03 0.13 Allowed 'General case' 0 C--N 1.341 0.206 0 CA-C-N 118.585 0.63 . . . . 0.0 111.223 178.936 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 2.3 p-10 -78.28 160.28 27.98 Favored 'General case' 0 N--CA 1.452 -0.353 0 C-N-CA 123.443 0.697 . . . . 0.0 110.163 176.245 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 13.7 m-20 -80.83 24.79 0.47 Allowed 'General case' 0 N--CA 1.458 -0.063 0 N-CA-C 113.53 0.937 . . . . 0.0 113.53 -175.035 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 22.4 p-10 -67.05 -31.54 72.12 Favored 'General case' 0 C--N 1.334 -0.102 0 CA-C-O 121.275 0.559 . . . . 0.0 109.602 -177.806 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 7' ' ' PHE . . . . . 0.499 ' CE1' ' HD3' ' A' ' 45' ' ' LYS . 1.4 t80 -55.28 -34.72 64.34 Favored 'General case' 0 N--CA 1.447 -0.59 0 C-N-CA 125.007 1.323 . . . . 0.0 111.022 -178.314 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 50.8 tp60 -53.68 -34.82 59.99 Favored 'General case' 0 N--CA 1.454 -0.262 0 C-N-CA 123.448 0.699 . . . . 0.0 112.059 -177.189 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 27.9 m-80 -72.3 -33.36 67.34 Favored 'General case' 0 N--CA 1.453 -0.311 0 N-CA-C 110.052 -0.351 . . . . 0.0 110.052 -179.529 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 10' ' ' PHE . . . . . 0.512 ' CZ ' HG12 ' A' ' 46' ' ' ILE . 6.4 t80 -70.19 -39.39 75.23 Favored 'General case' 0 N--CA 1.45 -0.439 0 N-CA-C 108.794 -0.817 . . . . 0.0 108.794 176.18 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 88.3 t -65.89 -53.38 38.62 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.271 0 N-CA-C 109.163 -0.68 . . . . 0.0 109.163 179.054 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -58.2 -30.62 66.61 Favored 'General case' 0 N--CA 1.455 -0.221 0 C-N-CA 122.716 0.406 . . . . 0.0 111.305 -179.312 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 91.4 m -71.13 -40.36 71.44 Favored 'General case' 0 N--CA 1.453 -0.325 0 N-CA-C 109.131 -0.692 . . . . 0.0 109.131 176.213 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.46 ' HA ' ' CD1' ' A' ' 17' ' ' PHE . 8.2 tp -65.9 -41.55 91.33 Favored 'General case' 0 N--CA 1.449 -0.476 0 CA-C-O 121.416 0.627 . . . . 0.0 109.869 179.473 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 73.2 mm-40 -63.81 -27.96 69.54 Favored 'General case' 0 N--CA 1.448 -0.545 0 C-N-CA 124.133 0.973 . . . . 0.0 109.949 177.931 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 51.0 m -69.78 -30.65 68.27 Favored 'General case' 0 N--CA 1.453 -0.29 0 N-CA-C 109.74 -0.467 . . . . 0.0 109.74 176.474 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 17' ' ' PHE . . . . . 0.557 ' CD1' HD11 ' A' ' 68' ' ' ILE . 33.6 m-85 -69.98 -33.16 71.69 Favored 'General case' 0 C--N 1.339 0.137 0 C-N-CA 119.469 -0.892 . . . . 0.0 111.065 171.982 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 18' ' ' LYS . . . . . 0.475 ' HG2' ' CE1' ' A' ' 53' ' ' TYR . 70.0 mttt -67.37 -24.18 65.67 Favored 'General case' 0 N--CA 1.462 0.152 0 CA-C-O 120.918 0.389 . . . . 0.0 110.496 174.739 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 31.2 t0 -79.37 -46.35 17.8 Favored 'General case' 0 C--N 1.334 -0.075 0 CA-C-N 116.521 -0.309 . . . . 0.0 110.653 175.469 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 20' ' ' LEU . . . . . 0.44 HD21 ' H ' ' B' 2053 ' ' ASP . 13.5 mt -54.63 126.67 24.77 Favored 'General case' 0 N--CA 1.457 -0.112 0 CA-C-O 120.894 0.378 . . . . 0.0 111.556 -176.666 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 1.2 mppt? -74.06 -23.28 59.35 Favored 'General case' 0 N--CA 1.456 -0.168 0 N-CA-C 108.988 -0.745 . . . . 0.0 108.988 175.194 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 34.6 m -82.67 -20.89 35.32 Favored 'General case' 0 N--CA 1.455 -0.184 0 C-N-CA 122.923 0.489 . . . . 0.0 110.637 174.916 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 72.21 -42.52 0.8 Allowed Glycine 0 CA--C 1.527 0.829 0 C-N-CA 124.982 1.277 . . . . 0.0 111.831 -177.168 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 84.1 mt -75.52 149.43 6.95 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.392 0 C-N-CA 123.995 0.918 . . . . 0.0 111.109 177.911 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 31.2 t -167.18 93.31 0.43 Allowed 'General case' 0 CA--C 1.518 -0.281 0 N-CA-C 108.847 -0.797 . . . . 0.0 108.847 169.791 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 26' ' ' GLY . . . . . 0.42 ' O ' ' HE2' ' A' ' 30' ' ' LYS . . . -55.23 -35.51 60.43 Favored Glycine 0 C--N 1.332 0.349 0 N-CA-C 110.709 -0.956 . . . . 0.0 110.709 -176.834 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 27' ' ' SER . . . . . 0.532 ' H ' ' HB3' ' B' 2055 ' ' GLU . 30.3 t -61.83 -53.15 59.85 Favored 'General case' 0 N--CA 1.449 -0.494 0 N-CA-C 109.752 -0.462 . . . . 0.0 109.752 -179.153 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 82.5 mmt-85 -68.87 -40.6 79.2 Favored 'General case' 0 C--O 1.231 0.123 0 C-N-CA 122.941 0.496 . . . . 0.0 110.417 -179.446 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 65.6 mt -57.37 -45.13 85.32 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.657 0 N-CA-C 108.559 -0.904 . . . . 0.0 108.559 177.931 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 30' ' ' LYS . . . . . 0.42 ' HE2' ' O ' ' A' ' 26' ' ' GLY . 51.0 mtmt -68.52 -27.27 65.96 Favored 'General case' 0 N--CA 1.456 -0.132 0 CA-C-O 118.65 -0.691 . . . . 0.0 111.51 179.531 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 31' ' ' LYS . . . . . 0.425 ' HA ' ' HE3' ' A' ' 31' ' ' LYS . 0.0 OUTLIER -63.59 -59.61 4.4 Favored 'General case' 0 C--N 1.341 0.232 0 CA-C-N 119.131 0.878 . . . . 0.0 110.163 177.299 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.503 HD12 ' N ' ' A' ' 33' ' ' THR . 1.6 pp -75.67 -19.22 59.29 Favored 'General case' 0 CA--C 1.532 0.28 0 C-N-CA 119.263 -0.975 . . . . 0.0 111.64 -176.924 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 33' ' ' THR . . . . . 0.503 ' N ' HD12 ' A' ' 32' ' ' LEU . 21.4 m -69.61 -42.93 73.71 Favored 'General case' 0 CA--C 1.52 -0.174 0 N-CA-C 108.845 -0.798 . . . . 0.0 108.845 175.927 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 87.4 m -72.1 -41.54 67.18 Favored 'General case' 0 N--CA 1.448 -0.552 0 CA-C-N 116.482 -0.326 . . . . 0.0 110.374 -175.995 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 58.3 t80 -63.98 -31.34 72.49 Favored 'General case' 0 N--CA 1.456 -0.163 0 C-N-CA 119.946 -0.701 . . . . 0.0 109.842 178.436 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -72.02 -27.66 62.87 Favored 'General case' 0 N--CA 1.447 -0.589 0 CA-C-O 119.385 -0.34 . . . . 0.0 110.682 174.414 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.484 HD22 ' HA ' ' A' ' 37' ' ' LEU . 0.6 OUTLIER -76.39 -39.14 54.51 Favored 'General case' 0 CA--C 1.519 -0.229 0 N-CA-C 107.79 -1.189 . . . . 0.0 107.79 -175.89 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 77.0 m-20 -67.4 -15.28 63.59 Favored 'General case' 0 N--CA 1.441 -0.883 0 C-N-CA 124.981 1.312 . . . . 0.0 111.331 176.927 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 97.0 m-70 -153.42 91.55 1.51 Allowed 'General case' 0 N--CA 1.451 -0.415 0 C-N-CA 123.265 0.626 . . . . 0.0 111.137 -175.569 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 40' ' ' ILE . . . . . 0.528 ' H ' HD13 ' A' ' 40' ' ' ILE . 0.0 OUTLIER -70.07 -14.83 18.64 Favored 'Isoleucine or valine' 0 C--O 1.226 -0.176 0 O-C-N 121.788 -0.57 . . . . 0.0 109.789 173.11 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 20.9 m-20 -57.91 -10.49 1.78 Allowed 'General case' 0 CA--C 1.532 0.255 0 C-N-CA 125.248 1.419 . . . . 0.0 113.897 -177.672 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -118.54 9.04 6.85 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.192 0 C-N-CA 124.114 0.966 . . . . 0.0 111.335 179.714 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 3.0 pp20? -47.76 -31.07 4.44 Favored 'General case' 0 C--N 1.331 -0.212 0 O-C-N 121.996 -0.44 . . . . 0.0 112.122 176.638 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 2.5 m -71.58 -39.03 70.83 Favored 'General case' 0 CA--C 1.53 0.211 0 O-C-N 121.794 -0.566 . . . . 0.0 111.234 -175.665 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 45' ' ' LYS . . . . . 0.499 ' HD3' ' CE1' ' A' ' 7' ' ' PHE . 19.1 ptpt -74.16 -24.5 59.41 Favored 'General case' 0 CA--C 1.531 0.24 0 O-C-N 121.637 -0.665 . . . . 0.0 109.719 176.357 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 46' ' ' ILE . . . . . 0.512 HG12 ' CZ ' ' A' ' 10' ' ' PHE . 97.7 mt -72.75 -47.37 50.2 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.237 0 C-N-CA 122.514 0.326 . . . . 0.0 110.206 -179.642 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 33.6 mm -62.79 -36.59 76.11 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.181 0 N-CA-C 109.183 -0.673 . . . . 0.0 109.183 177.454 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 47.1 m -62.84 -38.4 90.64 Favored 'General case' 0 N--CA 1.455 -0.202 0 C-N-CA 120.978 -0.289 . . . . 0.0 111.228 179.213 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 18.6 mt -74.68 -35.17 62.77 Favored 'General case' 0 N--CA 1.451 -0.413 0 N-CA-C 113.176 0.806 . . . . 0.0 113.176 -178.278 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 19.4 pt -69.59 -39.99 79.0 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.181 0 CA-C-N 118.925 0.784 . . . . 0.0 110.258 -178.893 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 36.0 pt -67.21 -42.79 88.38 Favored 'Isoleucine or valine' 0 C--N 1.338 0.092 0 C-N-CA 119.701 -0.799 . . . . 0.0 110.246 178.514 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 85.3 m-20 -63.96 -46.4 84.81 Favored 'General case' 0 N--CA 1.455 -0.208 0 CA-C-N 118.117 0.417 . . . . 0.0 110.886 -179.806 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 53' ' ' TYR . . . . . 0.475 ' CE1' ' HG2' ' A' ' 18' ' ' LYS . 12.1 t80 -63.59 -43.02 98.19 Favored 'General case' 0 N--CA 1.453 -0.314 0 N-CA-C 109.925 -0.398 . . . . 0.0 109.925 -179.819 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 24.2 m -66.0 -30.17 70.68 Favored 'General case' 0 N--CA 1.454 -0.24 0 CA-C-N 118.024 0.375 . . . . 0.0 111.757 -175.923 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 83.0 mtt-85 -76.62 -54.46 6.64 Favored 'General case' 0 N--CA 1.454 -0.251 0 CA-C-N 118.053 0.388 . . . . 0.0 111.523 -177.938 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 56' ' ' LEU . . . . . 0.424 ' CD2' ' N ' ' A' ' 56' ' ' LEU . 2.8 mm? -75.42 -20.16 59.05 Favored 'General case' 0 N--CA 1.455 -0.204 0 N-CA-C 113.863 1.06 . . . . 0.0 113.863 -174.084 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 57' ' ' CYS . . . . . 0.407 ' HB2' ' CB ' ' A' ' 61' ' ' HIS . 8.5 p -83.82 157.22 63.92 Favored Pre-proline 0 CA--C 1.537 0.465 0 N-CA-C 113.611 0.967 . . . . 0.0 113.611 -172.634 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 75.9 Cg_endo -75.4 -174.2 1.9 Allowed 'Trans proline' 0 N--CA 1.459 -0.507 1 C-N-CA 125.644 4.229 . . . . 0.0 111.82 174.358 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 59' ' ' ASP . . . . . 0.407 ' HB2' ' HA ' ' A' ' 116' ' ' SER . 38.5 p-10 -57.76 -50.22 73.97 Favored 'General case' 0 CA--C 1.529 0.155 0 C-N-CA 125.022 1.329 . . . . 0.0 114.407 -171.868 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 39.9 m -71.52 -32.21 67.92 Favored 'General case' 0 C--N 1.333 -0.134 0 O-C-N 122.074 -0.392 . . . . 0.0 110.428 -174.863 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 61' ' ' HIS . . . . . 0.407 ' CB ' ' HB2' ' A' ' 57' ' ' CYS . 61.5 m170 -75.39 -27.83 59.23 Favored 'General case' 0 N--CA 1.451 -0.414 0 C-N-CA 122.608 0.363 . . . . 0.0 110.207 176.464 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 45.6 tptt -68.97 -40.22 78.97 Favored 'General case' 0 N--CA 1.451 -0.425 0 N-CA-C 109.664 -0.495 . . . . 0.0 109.664 177.812 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 63' ' ' LEU . . . . . 0.472 HD23 HG13 ' A' ' 124' ' ' ILE . 1.8 tm? -73.21 -35.43 66.32 Favored 'General case' 0 N--CA 1.454 -0.241 0 N-CA-C 109.537 -0.542 . . . . 0.0 109.537 178.6 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -69.39 -29.35 71.79 Favored Glycine 0 CA--C 1.525 0.718 0 N-CA-C 110.646 -0.982 . . . . 0.0 110.646 175.765 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 43.9 t -71.11 -42.74 68.89 Favored 'General case' 0 N--CA 1.454 -0.241 0 CA-C-N 117.566 0.683 . . . . 0.0 110.133 176.797 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 72.3 mt -68.01 -24.46 65.12 Favored 'General case' 0 N--CA 1.452 -0.358 0 N-CA-C 110.151 -0.314 . . . . 0.0 110.151 179.104 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 2.0 m-85 -70.04 -39.62 75.63 Favored 'General case' 0 N--CA 1.454 -0.274 0 C-N-CA 122.288 0.235 . . . . 0.0 110.815 172.802 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 68' ' ' ILE . . . . . 0.557 HD11 ' CD1' ' A' ' 17' ' ' PHE . 20.3 mt -67.07 -46.6 84.16 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.381 0 N-CA-C 108.728 -0.841 . . . . 0.0 108.728 177.994 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 97.3 mt -57.24 -36.48 52.23 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.121 0 C-N-CA 123.366 0.666 . . . . 0.0 111.028 175.729 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 22.2 t70 -70.18 -43.59 70.49 Favored 'General case' 0 N--CA 1.455 -0.223 0 CA-C-N 117.883 0.31 . . . . 0.0 110.912 178.437 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 30.1 t -67.25 -53.39 30.5 Favored 'General case' 0 N--CA 1.452 -0.351 0 CA-C-N 116.553 -0.294 . . . . 0.0 110.759 -177.458 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -75.13 -33.34 28.53 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.304 0 N-CA-C 109.911 -0.403 . . . . 0.0 109.911 -177.532 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -68.62 -45.33 67.08 Favored Glycine 0 C--N 1.338 0.67 0 CA-C-O 119.703 -0.498 . . . . 0.0 112.074 -176.155 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 33.4 mtm105 -71.01 -40.9 71.54 Favored 'General case' 0 N--CA 1.452 -0.329 0 CA-C-N 117.651 0.726 . . . . 0.0 109.695 177.143 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -61.22 -37.15 81.98 Favored 'General case' 0 N--CA 1.453 -0.297 0 C-N-CA 120.871 -0.332 . . . . 0.0 110.442 -178.673 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 2.4 m-30 -70.19 -47.5 61.25 Favored 'General case' 0 N--CA 1.453 -0.299 0 CA-C-N 118.033 0.379 . . . . 0.0 111.112 178.235 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -65.86 -38.27 88.38 Favored 'General case' 0 N--CA 1.444 -0.761 0 C-N-CA 118.935 -1.106 . . . . 0.0 108.675 -176.98 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 95.5 m-20 -63.49 -45.04 92.57 Favored 'General case' 0 N--CA 1.455 -0.188 0 N-CA-C 111.792 0.293 . . . . 0.0 111.792 177.255 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 14.5 tm-20 -63.54 -46.86 84.03 Favored 'General case' 0 N--CA 1.447 -0.579 0 CA-C-N 117.679 0.218 . . . . 0.0 111.215 -177.698 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 80' ' ' THR . . . . . 0.577 HG21 ' HB3' ' A' ' 94' ' ' CYS . 52.7 p -73.79 -18.53 60.95 Favored 'General case' 0 N--CA 1.453 -0.301 0 N-CA-C 112.068 0.396 . . . . 0.0 112.068 179.611 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 20.3 ttm105 -75.77 -37.13 59.52 Favored 'General case' 0 N--CA 1.455 -0.182 0 CA-C-N 118.161 0.437 . . . . 0.0 109.881 171.425 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 30.9 t -76.09 -34.27 59.53 Favored 'General case' 0 N--CA 1.456 -0.17 0 C-N-CA 122.997 0.519 . . . . 0.0 112.385 -179.331 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 47.1 m-20 -125.21 167.68 14.51 Favored 'General case' 0 N--CA 1.455 -0.213 0 CA-C-O 120.867 0.365 . . . . 0.0 111.926 -170.027 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 31.9 t -69.32 13.94 0.11 Allowed 'General case' 0 CA--C 1.535 0.4 0 N-CA-C 113.789 1.033 . . . . 0.0 113.789 -174.543 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 83.4 m-20 -76.38 -3.05 34.88 Favored 'General case' 0 CA--C 1.53 0.204 0 O-C-N 121.722 -0.611 . . . . 0.0 111.79 179.003 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 37.1 t -66.46 137.38 56.79 Favored 'General case' 0 N--CA 1.454 -0.256 0 N-CA-C 109.736 -0.468 . . . . 0.0 109.736 176.882 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 78.0 p -166.94 -170.99 1.68 Allowed 'General case' 0 N--CA 1.454 -0.253 0 N-CA-C 109.071 -0.714 . . . . 0.0 109.071 -176.88 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 32.2 t -148.46 154.82 40.39 Favored 'General case' 0 N--CA 1.454 -0.242 0 N-CA-C 110.26 -0.274 . . . . 0.0 110.26 177.881 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 7.1 m120 54.5 34.61 21.48 Favored 'General case' 0 CA--C 1.535 0.37 0 N-CA-C 113.686 0.995 . . . . 0.0 113.686 176.682 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 90' ' ' LYS . . . . . 0.41 ' HE3' ' HB3' ' A' ' 90' ' ' LYS . 21.0 ttpp -146.96 132.23 9.1 Favored Pre-proline 0 CA--C 1.534 0.333 0 CA-C-N 118.598 0.635 . . . . 0.0 111.348 -178.266 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 91' ' ' PRO . . . . . 0.407 ' HA ' ' HB3' ' A' ' 96' ' ' HIS . 85.9 Cg_endo -72.64 167.62 26.63 Favored 'Trans proline' 0 N--CA 1.453 -0.885 0 C-N-CA 123.599 2.866 . . . . 0.0 109.746 174.371 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 80.61 17.89 72.09 Favored Glycine 0 CA--C 1.525 0.663 0 N-CA-C 111.489 -0.644 . . . . 0.0 111.489 179.306 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -156.78 166.68 32.68 Favored 'General case' 0 N--CA 1.455 -0.208 0 C-N-CA 124.811 1.244 . . . . 0.0 108.918 -178.809 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 94' ' ' CYS . . . . . 0.577 ' HB3' HG21 ' A' ' 80' ' ' THR . 30.5 p -59.47 -18.59 40.99 Favored 'General case' 0 N--CA 1.451 -0.424 0 C-N-CA 122.358 0.263 . . . . 0.0 110.535 178.382 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -56.55 -63.09 1.31 Allowed 'General case' 0 N--CA 1.449 -0.48 0 C-N-CA 122.333 0.253 . . . . 0.0 110.62 -177.658 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 96' ' ' HIS . . . . . 0.407 ' HB3' ' HA ' ' A' ' 91' ' ' PRO . 76.0 t60 -72.25 -33.54 67.58 Favored 'General case' 0 N--CA 1.449 -0.515 0 CA-C-N 116.949 -0.114 . . . . 0.0 110.739 -179.556 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -63.48 -54.1 41.63 Favored 'General case' 0 N--CA 1.452 -0.347 0 O-C-N 123.021 0.201 . . . . 0.0 111.375 -177.333 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 98' ' ' ILE . . . . . 0.444 HD13 ' HB2' ' A' ' 94' ' ' CYS . 1.7 mp -70.13 -36.7 69.24 Favored 'Isoleucine or valine' 0 C--N 1.337 0.05 0 CA-C-N 117.778 0.263 . . . . 0.0 110.428 -179.505 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 35.9 m-20 -67.69 -45.22 75.77 Favored 'General case' 0 N--CA 1.454 -0.27 0 CA-C-N 117.916 0.325 . . . . 0.0 111.316 -178.512 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 98.1 m -70.27 -31.7 69.19 Favored 'General case' 0 N--CA 1.453 -0.308 0 N-CA-C 110.125 -0.324 . . . . 0.0 110.125 -177.797 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 53.7 tp -74.06 -38.34 63.98 Favored 'General case' 0 N--CA 1.449 -0.476 0 CA-C-O 119.626 -0.226 . . . . 0.0 111.058 179.439 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -65.96 -22.64 70.59 Favored Glycine 0 CA--C 1.53 1.009 0 CA-C-O 119.811 -0.438 . . . . 0.0 113.216 -174.562 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 17.3 mm-40 -78.84 -36.4 42.55 Favored 'General case' 0 N--CA 1.456 -0.127 0 CA-C-N 117.877 0.839 . . . . 0.0 111.455 179.186 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 19.6 m -105.02 -8.4 9.84 Favored 'Isoleucine or valine' 0 CA--C 1.527 0.089 0 N-CA-C 112.895 0.702 . . . . 0.0 112.895 -174.492 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 105' ' ' ILE . . . . . . . . . . . . . 10.6 tp -59.59 -26.79 35.78 Favored 'Isoleucine or valine' 0 C--N 1.337 0.062 0 CA-C-N 119.484 1.038 . . . . 0.0 110.587 -179.32 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 27.7 pt20 -66.97 -29.05 68.79 Favored 'General case' 0 N--CA 1.45 -0.432 0 N-CA-C 110.325 -0.25 . . . . 0.0 110.325 177.434 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 60.7 mt-10 -75.96 -36.44 59.3 Favored 'General case' 0 CA--C 1.529 0.153 0 N-CA-C 109.94 -0.393 . . . . 0.0 109.94 177.137 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 10.7 mp -71.69 -41.3 68.83 Favored 'General case' 0 N--CA 1.448 -0.543 0 N-CA-C 109.892 -0.41 . . . . 0.0 109.892 179.847 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 91.5 mt -70.72 -53.14 16.75 Favored 'General case' 0 N--CA 1.455 -0.183 0 CA-C-O 119.526 -0.273 . . . . 0.0 111.176 -179.581 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 9.8 p -47.14 -55.79 7.79 Favored 'General case' 0 C--N 1.34 0.162 0 C-N-CA 122.664 0.386 . . . . 0.0 111.067 177.474 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 18.5 t0 -59.76 -37.71 79.76 Favored 'General case' 0 N--CA 1.446 -0.665 0 N-CA-C 109.475 -0.565 . . . . 0.0 109.475 -179.808 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -68.65 -37.61 79.8 Favored 'General case' 0 N--CA 1.444 -0.761 0 C-N-CA 119.862 -0.735 . . . . 0.0 110.814 -176.504 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 113' ' ' ILE . . . . . . . . . . . . . 27.5 mm -67.71 -39.38 81.98 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.288 0 C-N-CA 119.331 -0.948 . . . . 0.0 110.211 -178.16 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -75.2 -43.57 51.23 Favored 'General case' 0 CA--C 1.53 0.201 0 N-CA-C 112.073 0.397 . . . . 0.0 112.073 179.265 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 39.4 ttmt -75.73 -38.31 58.59 Favored 'General case' 0 C--N 1.338 0.079 0 C-N-CA 123.486 0.714 . . . . 0.0 112.538 -175.263 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 116' ' ' SER . . . . . 0.421 ' HB2' ' HB2' ' A' ' 120' ' ' HIS . 54.9 p -74.66 154.09 38.64 Favored 'General case' 0 N--CA 1.453 -0.294 0 N-CA-C 112.692 0.627 . . . . 0.0 112.692 -170.735 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 21.5 t-20 -75.76 163.81 26.89 Favored 'General case' 0 N--CA 1.454 -0.267 0 N-CA-C 108.84 -0.8 . . . . 0.0 108.84 178.131 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 118' ' ' GLN . . . . . . . . . . . . . 26.5 mm100 -49.59 -51.91 33.99 Favored 'General case' 0 N--CA 1.457 -0.079 0 C-N-CA 123.117 0.567 . . . . 0.0 111.726 -171.61 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 16.0 t0 -57.16 -41.59 79.46 Favored 'General case' 0 C--O 1.23 0.04 0 N-CA-C 109.859 -0.422 . . . . 0.0 109.859 -179.761 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 120' ' ' HIS . . . . . 0.421 ' HB2' ' HB2' ' A' ' 116' ' ' SER . 68.3 m-70 -68.84 -34.4 75.42 Favored 'General case' 0 N--CA 1.447 -0.597 0 CA-C-O 118.981 -0.533 . . . . 0.0 110.603 -179.709 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 60.5 mttm -57.64 -42.81 84.17 Favored 'General case' 0 N--CA 1.464 0.267 0 CA-C-N 118.958 0.799 . . . . 0.0 109.845 177.319 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 29.6 mm-40 -75.62 -32.83 60.42 Favored 'General case' 0 N--CA 1.449 -0.478 0 N-CA-C 112.282 0.475 . . . . 0.0 112.282 -178.002 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 46.4 mtmt -67.5 -28.98 68.3 Favored 'General case' 0 C--N 1.332 -0.193 0 C-N-CA 120.046 -0.662 . . . . 0.0 109.427 176.791 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 124' ' ' ILE . . . . . 0.472 HG13 HD23 ' A' ' 63' ' ' LEU . 62.2 mt -69.89 -38.79 76.57 Favored 'Isoleucine or valine' 0 C--O 1.226 -0.143 0 N-CA-C 109.463 -0.569 . . . . 0.0 109.463 171.812 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -56.39 -49.05 75.6 Favored 'General case' 0 C--N 1.341 0.219 0 O-C-N 122.185 -0.322 . . . . 0.0 110.468 179.818 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 126' ' ' MET . . . . . . . . . . . . . 27.8 ptm -69.41 -31.28 69.54 Favored 'General case' 0 N--CA 1.454 -0.243 0 C-N-CA 120.508 -0.477 . . . . 0.0 110.402 -179.582 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 2.1 mp -62.85 -32.77 74.07 Favored 'General case' 0 N--CA 1.456 -0.144 0 CA-C-N 118.568 0.622 . . . . 0.0 110.547 176.107 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 128' ' ' LEU . . . . . 0.413 ' HB3' ' HE3' ' A' ' 139' ' ' LYS . 96.4 mt -72.43 -38.14 68.42 Favored 'General case' 0 N--CA 1.456 -0.162 0 CA-C-N 118.777 0.717 . . . . 0.0 109.927 177.291 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 50.9 m-20 -63.4 -36.34 83.39 Favored 'General case' 0 N--CA 1.456 -0.174 0 N-CA-C 109.796 -0.446 . . . . 0.0 109.796 175.375 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 130' ' ' ILE . . . . . 0.567 ' HA ' ' CD ' ' A' ' 133' ' ' ARG . 55.0 mt -69.02 -31.97 52.51 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.278 0 C-N-CA 122.59 0.356 . . . . 0.0 110.615 179.404 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 131' ' ' TRP . . . . . . . . . . . . . 47.9 m0 -75.92 -26.7 57.17 Favored 'General case' 0 N--CA 1.452 -0.361 0 C-N-CA 120.12 -0.632 . . . . 0.0 111.651 175.303 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 66.2 m-20 -73.93 -46.67 42.81 Favored 'General case' 0 C--N 1.341 0.198 0 CA-C-N 118.065 0.393 . . . . 0.0 110.708 175.294 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 133' ' ' ARG . . . . . 0.567 ' CD ' ' HA ' ' A' ' 130' ' ' ILE . 8.4 ptm180 -75.05 -24.42 58.25 Favored 'General case' 0 N--CA 1.454 -0.246 0 C-N-CA 123.141 0.576 . . . . 0.0 112.382 -175.801 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 28.5 t -90.62 -5.44 55.86 Favored 'General case' 0 N--CA 1.452 -0.368 0 N-CA-C 111.781 0.289 . . . . 0.0 111.781 178.181 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 135' ' ' GLY . . . . . . . . . . . . . . . 74.44 14.25 81.1 Favored Glycine 0 CA--C 1.527 0.81 0 CA-C-O 119.679 -0.511 . . . . 0.0 112.939 177.526 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 136' ' ' LEU . . . . . 0.4 ' C ' HD23 ' A' ' 136' ' ' LEU . 3.5 tt -70.1 -55.82 8.48 Favored 'General case' 0 CA--C 1.529 0.14 0 CA-C-N 117.928 0.864 . . . . 0.0 109.531 -178.543 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 137' ' ' PHE . . . . . . . . . . . . . 66.3 t80 -160.59 130.82 5.24 Favored 'General case' 0 N--CA 1.454 -0.248 0 N-CA-C 108.635 -0.876 . . . . 0.0 108.635 -178.262 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 138' ' ' GLN . . . . . . . . . . . . . 22.4 mp0 -81.79 136.79 35.39 Favored 'General case' 0 N--CA 1.451 -0.377 0 CA-C-O 120.921 0.391 . . . . 0.0 111.653 -175.999 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 139' ' ' LYS . . . . . 0.413 ' HE3' ' HB3' ' A' ' 128' ' ' LEU . 3.2 ttmp? -61.48 118.2 6.7 Favored 'General case' 0 N--CA 1.452 -0.34 0 C-N-CA 123.942 0.897 . . . . 0.0 108.752 175.052 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 140' ' ' SER . . . . . . . . . . . . . 35.0 t -89.21 -2.68 58.59 Favored 'General case' 0 CA--C 1.53 0.175 0 N-CA-C 112.806 0.669 . . . . 0.0 112.806 -176.783 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 141' ' ' TYR . . . . . . . . . . . . . 79.4 m-85 52.61 20.6 1.56 Allowed 'General case' 0 CA--C 1.533 0.321 0 C-N-CA 123.469 0.708 . . . . 0.0 112.46 -178.423 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 142' ' ' LEU . . . . . 0.417 ' HG ' ' H ' ' A' ' 144' ' ' ALA . 59.6 tp -65.2 147.94 52.56 Favored 'General case' 0 N--CA 1.454 -0.246 0 C-N-CA 123.446 0.698 . . . . 0.0 110.185 -178.166 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 27.5 p-10 -61.05 -26.78 67.87 Favored 'General case' 0 N--CA 1.455 -0.18 0 N-CA-C 111.859 0.318 . . . . 0.0 111.859 -175.023 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 144' ' ' ALA . . . . . 0.417 ' H ' ' HG ' ' A' ' 142' ' ' LEU . . . -64.61 -36.8 85.43 Favored 'General case' 0 N--CA 1.452 -0.348 0 N-CA-C 109.582 -0.525 . . . . 0.0 109.582 177.451 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 145' ' ' ILE . . . . . . . . . . . . . 24.3 mm -75.31 -27.75 19.72 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.311 0 N-CA-C 110.182 -0.303 . . . . 0.0 110.182 -179.967 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 146' ' ' ARG . . . . . . . . . . . . . 75.5 mtt180 -72.66 -20.47 61.24 Favored 'General case' 0 C--N 1.34 0.172 0 N-CA-C 109.574 -0.528 . . . . 0.0 109.574 174.82 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 147' ' ' SER . . . . . . . . . . . . . 36.2 t 57.74 55.99 5.13 Favored 'General case' 0 N--CA 1.451 -0.415 0 C-N-CA 123.341 0.657 . . . . 0.0 110.229 176.488 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 148' ' ' LYS . . . . . 0.572 ' HA ' ' HE2' ' A' ' 148' ' ' LYS . 8.0 mmpt? -55.78 -18.89 9.46 Favored 'General case' 0 N--CA 1.456 -0.137 0 N-CA-C 112.698 0.629 . . . . 0.0 112.698 -174.9 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 149' ' ' CYS . . . . . . . . . . . . . 60.6 m -63.78 -42.64 97.72 Favored 'General case' 0 N--CA 1.455 -0.208 0 CA-C-N 119.212 0.915 . . . . 0.0 109.716 177.481 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 150' ' ' PHE . . . . . . . . . . . . . 87.2 t80 -69.11 -22.89 63.94 Favored 'General case' 0 N--CA 1.453 -0.276 0 N-CA-C 109.871 -0.418 . . . . 0.0 109.871 179.16 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 151' ' ' ALA . . . . . . . . . . . . . . . -81.13 -28.32 35.16 Favored 'General case' 0 N--CA 1.45 -0.436 0 C-N-CA 122.484 0.314 . . . . 0.0 110.517 175.312 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 152' ' ' MET . . . . . . . . . . . . . 92.6 mtp -75.39 -20.5 58.91 Favored 'General case' 0 C--N 1.342 0.259 0 C-N-CA 122.795 0.438 . . . . 0.0 111.183 176.868 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 153' ' ' ASP . . . . . . . . . . . . . 60.1 m-20 -64.54 -9.66 20.53 Favored 'General case' 0 CA--C 1.535 0.383 0 N-CA-C 110.481 -0.192 . . . . 0.0 110.481 170.204 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 154' ' ' LEU . . . . . . . . . . . . . 77.9 mt -130.49 -177.92 4.55 Favored 'General case' 0 N--CA 1.455 -0.179 0 C-N-CA 124.936 1.294 . . . . 0.0 108.534 178.16 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 155' ' ' GLU . . . . . . . . . . . . . 13.3 pm0 -75.17 4.56 6.69 Favored 'General case' 0 CA--C 1.534 0.361 0 O-C-N 121.963 -0.461 . . . . 0.0 111.909 177.356 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 156' ' ' HIS . . . . . . . . . . . . . 32.5 m170 -77.96 43.53 0.43 Allowed 'General case' 0 CA--C 1.529 0.163 0 C-N-CA 124.786 1.234 . . . . 0.0 112.069 -175.265 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 157' ' ' HIS . . . . . . . . . . . . . 36.4 m170 -69.01 0.45 4.53 Favored 'General case' 0 CA--C 1.535 0.368 0 N-CA-C 112.597 0.591 . . . . 0.0 112.597 -176.553 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 158' ' ' HIS . . . . . . . . . . . . . 51.4 p-80 -73.07 163.88 27.51 Favored 'General case' 0 N--CA 1.456 -0.159 0 CA-C-N 118.576 0.626 . . . . 0.0 110.991 178.958 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 159' ' ' HIS . . . . . . . . . . . . . 30.7 m80 . . . . . 0 C--O 1.249 1.038 0 CA-C-O 117.181 -1.39 . . . . 0.0 111.429 -179.653 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' B' B 2052 ' ' ASP . . . . . . . . . . . . . 4.0 m-20 . . . . . 0 N--CA 1.476 0.83 0 N-CA-C 110.729 -0.1 . . . . 0.0 110.729 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' B' B 2053 ' ' ASP . . . . . 0.44 ' H ' HD21 ' A' ' 20' ' ' LEU . 10.8 m-20 -148.88 164.03 35.68 Favored 'General case' 0 N--CA 1.453 -0.322 0 C-N-CA 123.419 0.688 . . . . 0.0 111.933 -173.993 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B 2054 ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -72.0 164.07 26.77 Favored 'General case' 0 CA--C 1.532 0.276 0 C-N-CA 125.103 1.361 . . . . 0.0 113.454 -177.938 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B 2055 ' ' GLU . . . . . 0.532 ' HB3' ' H ' ' A' ' 27' ' ' SER . 40.6 tt0 56.31 41.09 29.56 Favored 'General case' 0 CA--C 1.535 0.373 0 C-N-CA 125.801 1.64 . . . . 0.0 114.204 172.863 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B 2056 ' ' ASP . . . . . . . . . . . . . 40.2 p-10 -74.28 0.49 14.08 Favored 'General case' 0 CA--C 1.532 0.284 0 O-C-N 120.999 -1.063 . . . . 0.0 110.822 175.706 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B 2057 ' ' ASP . . . . . . . . . . . . . 34.6 p-10 -92.81 17.13 10.96 Favored 'General case' 0 CA--C 1.531 0.233 0 C-N-CA 124.9 1.28 . . . . 0.0 111.02 178.086 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B 2058 ' ' TYR . . . . . . . . . . . . . 72.9 t80 -53.36 148.67 8.5 Favored 'General case' 0 N--CA 1.454 -0.231 0 CA-C-O 121.456 0.646 . . . . 0.0 111.981 -179.077 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B 2059 ' ' THR . . . . . . . . . . . . . 54.6 m -134.36 132.9 21.2 Favored Pre-proline 0 N--CA 1.451 -0.392 0 N-CA-C 107.734 -1.21 . . . . 0.0 107.734 178.736 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B 2060 ' ' PRO . . . . . . . . . . . . . 88.4 Cg_endo -70.29 168.65 21.64 Favored 'Trans proline' 0 N--CA 1.449 -1.092 0 C-N-CA 123.274 2.649 . . . . 0.0 111.549 -177.112 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B 2061 ' ' SER . . . . . . . . . . . . . 23.3 t -77.6 159.65 29.09 Favored 'General case' 0 CA--C 1.531 0.218 0 N-CA-C 112.898 0.703 . . . . 0.0 112.898 -174.215 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B 2062 ' ' ILE . . . . . . . . . . . . . 12.1 mt 63.44 135.83 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.534 0.33 0 C-N-CA 127.109 2.164 . . . . 0.0 112.929 -178.909 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B 2063 ' ' SER . . . . . . . . . . . . . 30.2 t . . . . . 0 C--O 1.249 1.077 0 CA-C-O 117.501 -1.238 . . . . 0.0 112.045 -172.072 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 55.2 ttm . . . . . 0 N--CA 1.474 0.731 0 CA-C-O 121.258 0.552 . . . . 0.0 110.301 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 43.9 tt0 -160.75 127.84 4.23 Favored 'General case' 0 N--CA 1.454 -0.261 0 N-CA-C 107.54 -1.281 . . . . 0.0 107.54 177.987 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 16.5 mt-30 51.83 -142.86 0.71 Allowed 'General case' 0 CA--C 1.531 0.246 0 N-CA-C 108.49 -0.93 . . . . 0.0 108.49 -176.121 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 10.6 p-10 -81.59 109.66 16.24 Favored 'General case' 0 N--CA 1.448 -0.539 0 O-C-N 121.935 -0.478 . . . . 0.0 109.784 175.155 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 90.2 m-20 -69.96 -0.36 7.32 Favored 'General case' 0 C--N 1.339 0.124 0 CA-C-O 120.967 0.413 . . . . 0.0 111.632 175.815 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 22.0 m-20 -69.1 -19.02 64.05 Favored 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 108.85 -0.796 . . . . 0.0 108.85 176.904 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 7' ' ' PHE . . . . . 0.513 ' CD1' ' HD3' ' A' ' 45' ' ' LYS . 1.4 t80 -58.26 -34.51 70.56 Favored 'General case' 0 N--CA 1.449 -0.497 0 C-N-CA 123.29 0.636 . . . . 0.0 109.779 179.55 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 51.0 tp60 -51.69 -36.75 47.81 Favored 'General case' 0 N--CA 1.456 -0.145 0 C-N-CA 124.545 1.138 . . . . 0.0 111.829 -177.668 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 26.5 m-80 -71.43 -34.85 70.66 Favored 'General case' 0 N--CA 1.454 -0.272 0 N-CA-C 109.821 -0.437 . . . . 0.0 109.821 -179.379 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 10' ' ' PHE . . . . . 0.477 ' CZ ' HG12 ' A' ' 46' ' ' ILE . 2.1 t80 -71.45 -38.2 71.33 Favored 'General case' 0 N--CA 1.45 -0.439 0 N-CA-C 109.078 -0.712 . . . . 0.0 109.078 178.24 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 86.8 t -66.48 -55.36 18.82 Favored 'Isoleucine or valine' 0 CA--C 1.52 -0.181 0 N-CA-C 109.106 -0.702 . . . . 0.0 109.106 178.448 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -58.01 -29.75 65.54 Favored 'General case' 0 N--CA 1.456 -0.13 0 C-N-CA 122.704 0.402 . . . . 0.0 111.996 -179.107 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 92.3 m -71.93 -39.77 69.22 Favored 'General case' 0 CA--C 1.53 0.209 0 N-CA-C 109.214 -0.661 . . . . 0.0 109.214 176.18 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.422 ' HA ' ' CD1' ' A' ' 17' ' ' PHE . 0.1 OUTLIER -64.28 -45.45 87.97 Favored 'General case' 0 N--CA 1.45 -0.439 0 N-CA-C 109.076 -0.713 . . . . 0.0 109.076 177.145 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 72.5 mm-40 -64.91 -29.75 70.71 Favored 'General case' 0 N--CA 1.454 -0.267 0 C-N-CA 124.004 0.922 . . . . 0.0 110.264 179.798 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 70.5 m -67.18 -34.76 78.21 Favored 'General case' 0 N--CA 1.452 -0.348 0 N-CA-C 109.464 -0.569 . . . . 0.0 109.464 175.646 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 17' ' ' PHE . . . . . 0.469 ' CE1' HD11 ' A' ' 68' ' ' ILE . 15.4 m-85 -63.77 -39.98 95.59 Favored 'General case' 0 C--N 1.34 0.186 0 C-N-CA 120.176 -0.61 . . . . 0.0 109.821 174.657 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 18' ' ' LYS . . . . . 0.474 ' HG2' ' CE1' ' A' ' 53' ' ' TYR . 59.0 mttt -65.92 -29.45 69.87 Favored 'General case' 0 C--N 1.338 0.071 0 CA-C-N 117.625 0.193 . . . . 0.0 110.993 -179.122 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 60.6 t0 -75.16 -42.05 56.88 Favored 'General case' 0 N--CA 1.454 -0.242 0 O-C-N 123.374 0.421 . . . . 0.0 111.073 -179.189 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 14.1 mt -57.99 140.79 51.58 Favored 'General case' 0 N--CA 1.451 -0.396 0 C-N-CA 120.181 -0.608 . . . . 0.0 111.069 -176.483 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 21' ' ' LYS . . . . . 0.493 ' HE2' ' OD2' ' B' 2052 ' ' ASP . 1.1 mppt? -79.84 -21.42 44.19 Favored 'General case' 0 N--CA 1.454 -0.254 0 N-CA-C 109.319 -0.623 . . . . 0.0 109.319 176.543 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 22' ' ' SER . . . . . 0.402 ' C ' ' H ' ' A' ' 24' ' ' ILE . 85.8 p -76.75 -24.95 52.96 Favored 'General case' 0 CA--C 1.53 0.205 0 N-CA-C 109.557 -0.535 . . . . 0.0 109.557 169.82 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 71.7 -29.03 0.61 Allowed Glycine 0 CA--C 1.527 0.807 0 C-N-CA 125.294 1.426 . . . . 0.0 112.683 177.3 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 24' ' ' ILE . . . . . 0.402 ' H ' ' C ' ' A' ' 22' ' ' SER . 35.9 mt -89.73 155.07 3.12 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.557 0 N-CA-C 108.433 -0.951 . . . . 0.0 108.433 173.327 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 4.0 t -158.48 76.27 0.75 Allowed 'General case' 0 C--O 1.225 -0.199 0 CA-C-N 118.665 0.666 . . . . 0.0 110.518 -177.498 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -48.03 -49.86 22.91 Favored Glycine 0 CA--C 1.53 1.01 0 CA-C-O 118.592 -1.116 . . . . 0.0 115.403 -170.036 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 60.1 p -71.7 -35.96 70.4 Favored 'General case' 0 C--N 1.34 0.19 0 CA-C-N 120.173 1.987 . . . . 0.0 110.871 -176.182 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 75.2 mtt85 -70.94 -37.91 72.87 Favored 'General case' 0 C--N 1.341 0.237 0 CA-C-N 118.236 0.471 . . . . 0.0 110.183 178.027 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 41.3 mt -56.45 -45.03 81.73 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.446 0 N-CA-C 107.811 -1.181 . . . . 0.0 107.811 174.159 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 52.8 mtmt -68.36 -23.73 64.72 Favored 'General case' 0 N--CA 1.454 -0.225 0 CA-C-O 118.458 -0.782 . . . . 0.0 112.341 177.544 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 31' ' ' LYS . . . . . 0.539 ' HA ' ' HE3' ' A' ' 31' ' ' LYS . 0.0 OUTLIER -66.1 -59.28 3.93 Favored 'General case' 0 C--N 1.344 0.331 0 CA-C-N 119.629 1.104 . . . . 0.0 110.35 177.345 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.452 HD12 ' N ' ' A' ' 33' ' ' THR . 1.4 pp -74.17 -17.97 60.84 Favored 'General case' 0 N--CA 1.455 -0.176 0 C-N-CA 119.267 -0.973 . . . . 0.0 111.695 -177.024 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 33' ' ' THR . . . . . 0.452 ' N ' HD12 ' A' ' 32' ' ' LEU . 39.7 m -73.54 -37.04 65.73 Favored 'General case' 0 N--CA 1.457 -0.12 0 N-CA-C 109.621 -0.511 . . . . 0.0 109.621 176.18 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 97.6 m -74.05 -37.27 64.33 Favored 'General case' 0 N--CA 1.453 -0.301 0 N-CA-C 110.231 -0.285 . . . . 0.0 110.231 -179.297 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 71.7 t80 -67.55 -33.32 74.81 Favored 'General case' 0 N--CA 1.454 -0.229 0 N-CA-C 109.718 -0.475 . . . . 0.0 109.718 176.727 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -71.14 -31.01 67.19 Favored 'General case' 0 N--CA 1.451 -0.386 0 CA-C-O 119.722 -0.18 . . . . 0.0 111.2 177.595 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 13.1 mt -71.92 -40.88 68.48 Favored 'General case' 0 N--CA 1.454 -0.23 0 C-N-CA 122.349 0.26 . . . . 0.0 111.123 178.101 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 41.8 t0 -67.6 -21.51 65.41 Favored 'General case' 0 CA--C 1.532 0.28 0 N-CA-C 110.504 -0.184 . . . . 0.0 110.504 178.613 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 74.6 m80 -146.39 92.0 2.12 Favored 'General case' 0 N--CA 1.453 -0.314 0 CA-C-O 120.88 0.372 . . . . 0.0 111.197 -177.662 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 40' ' ' ILE . . . . . 0.615 ' H ' HD13 ' A' ' 40' ' ' ILE . 0.0 OUTLIER -72.63 -16.99 18.3 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.54 0 CA-C-O 118.965 -0.54 . . . . 0.0 110.816 176.8 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 3.8 m-20 -57.68 -22.7 47.55 Favored 'General case' 0 N--CA 1.456 -0.16 0 N-CA-C 112.864 0.69 . . . . 0.0 112.864 -176.264 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -102.57 14.79 5.94 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.159 0 C-N-CA 122.636 0.374 . . . . 0.0 111.876 177.098 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 2.8 pp20? -51.51 -34.02 34.2 Favored 'General case' 0 C--O 1.226 -0.153 0 O-C-N 121.475 -0.765 . . . . 0.0 111.23 178.042 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 30.9 t -58.39 -49.88 75.67 Favored 'General case' 0 CA--C 1.531 0.225 0 N-CA-C 112.279 0.474 . . . . 0.0 112.279 -176.853 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 45' ' ' LYS . . . . . 0.513 ' HD3' ' CD1' ' A' ' 7' ' ' PHE . 19.4 ptpt -71.13 -23.22 62.04 Favored 'General case' 0 CA--C 1.529 0.153 0 O-C-N 121.959 -0.463 . . . . 0.0 110.326 -179.913 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 46' ' ' ILE . . . . . 0.477 HG12 ' CZ ' ' A' ' 10' ' ' PHE . 94.4 mt -75.2 -41.72 44.28 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.256 0 C-N-CA 122.888 0.475 . . . . 0.0 109.899 179.979 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 32.1 mm -62.61 -35.47 70.47 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.212 0 N-CA-C 109.185 -0.672 . . . . 0.0 109.185 175.672 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 17.9 t -63.59 -47.78 80.07 Favored 'General case' 0 N--CA 1.456 -0.152 0 C-N-CA 119.872 -0.731 . . . . 0.0 110.454 177.443 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 20.6 mt -64.5 -33.54 76.12 Favored 'General case' 0 N--CA 1.449 -0.496 0 CA-C-O 118.708 -0.663 . . . . 0.0 112.451 -175.788 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 24.6 pt -70.18 -42.71 79.12 Favored 'Isoleucine or valine' 0 C--O 1.226 -0.17 0 C-N-CA 119.366 -0.933 . . . . 0.0 110.669 178.554 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 43.3 pt -70.92 -39.96 75.85 Favored 'Isoleucine or valine' 0 C--N 1.342 0.264 0 CA-C-N 118.916 0.78 . . . . 0.0 110.68 179.756 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 76.3 m-20 -63.31 -48.86 76.29 Favored 'General case' 0 N--CA 1.454 -0.265 0 CA-C-N 117.783 0.265 . . . . 0.0 110.8 -179.987 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 53' ' ' TYR . . . . . 0.474 ' CE1' ' HG2' ' A' ' 18' ' ' LYS . 16.9 t80 -66.13 -47.14 75.08 Favored 'General case' 0 N--CA 1.454 -0.255 0 CA-C-O 119.443 -0.313 . . . . 0.0 110.41 -179.538 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 19.4 t -65.0 -27.91 69.15 Favored 'General case' 0 N--CA 1.454 -0.272 0 O-C-N 123.205 0.316 . . . . 0.0 111.796 -173.968 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 55' ' ' ARG . . . . . 0.43 HH22 ' CD ' ' A' ' 107' ' ' GLU . 90.2 mtt-85 -75.49 -51.29 13.34 Favored 'General case' 0 N--CA 1.455 -0.205 0 O-C-N 122.211 -0.306 . . . . 0.0 110.996 178.057 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 44.0 mt -75.17 -43.53 51.71 Favored 'General case' 0 N--CA 1.457 -0.112 0 N-CA-C 113.034 0.753 . . . . 0.0 113.034 -172.884 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 57' ' ' CYS . . . . . 0.461 ' O ' ' HE2' ' A' ' 62' ' ' LYS . 12.6 p -65.39 154.07 88.55 Favored Pre-proline 0 CA--C 1.538 0.483 0 N-CA-C 112.985 0.735 . . . . 0.0 112.985 -173.633 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 45.6 Cg_endo -80.23 -175.53 2.75 Favored 'Trans proline' 0 N--CA 1.458 -0.612 1 C-N-CA 125.381 4.054 . . . . 0.0 112.371 -179.557 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 59' ' ' ASP . . . . . 0.403 ' CG ' ' HA ' ' A' ' 116' ' ' SER . 35.4 t0 -36.86 -73.29 0.05 OUTLIER 'General case' 0 C--N 1.341 0.206 0 C-N-CA 126.422 1.889 . . . . 0.0 114.357 -174.134 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 19.7 m -61.88 -29.43 70.19 Favored 'General case' 0 C--O 1.232 0.138 0 O-C-N 122.079 -0.388 . . . . 0.0 111.544 -171.643 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 60.2 m80 -75.66 -29.2 59.0 Favored 'General case' 0 N--CA 1.45 -0.444 0 C-N-CA 122.467 0.307 . . . . 0.0 110.62 178.516 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 62' ' ' LYS . . . . . 0.461 ' HE2' ' O ' ' A' ' 57' ' ' CYS . 66.4 mttm -68.33 -37.85 80.96 Favored 'General case' 0 C--N 1.34 0.182 0 N-CA-C 109.092 -0.707 . . . . 0.0 109.092 174.241 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -61.61 -44.66 96.59 Favored 'General case' 0 C--N 1.341 0.213 0 N-CA-C 108.437 -0.949 . . . . 0.0 108.437 177.321 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -68.76 -28.31 73.2 Favored Glycine 0 CA--C 1.526 0.733 0 N-CA-C 111.609 -0.596 . . . . 0.0 111.609 -179.539 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 37.0 p -67.73 -36.94 81.49 Favored 'General case' 0 N--CA 1.452 -0.326 0 CA-C-N 117.965 0.883 . . . . 0.0 109.497 177.71 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 79.0 mt -75.47 -26.81 58.54 Favored 'General case' 0 N--CA 1.449 -0.5 0 CA-C-N 116.506 -0.315 . . . . 0.0 110.935 179.573 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 10.0 m-30 -69.29 -37.72 77.97 Favored 'General case' 0 CA--C 1.513 -0.476 0 CA-C-N 118.367 0.531 . . . . 0.0 110.97 174.231 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 68' ' ' ILE . . . . . 0.469 HD11 ' CE1' ' A' ' 17' ' ' PHE . 18.2 mt -63.87 -47.83 88.99 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.764 0 N-CA-C 107.501 -1.296 . . . . 0.0 107.501 178.907 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 97.0 mt -59.4 -32.56 48.93 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.155 0 C-N-CA 123.832 0.853 . . . . 0.0 111.34 177.056 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 15.2 t70 -68.89 -54.9 12.99 Favored 'General case' 0 CA--C 1.52 -0.196 0 CA-C-N 118.26 0.482 . . . . 0.0 111.134 179.183 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 32.3 t -70.02 -42.33 73.11 Favored 'General case' 0 N--CA 1.452 -0.342 0 C-N-CA 120.829 -0.348 . . . . 0.0 110.795 -174.353 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -74.99 -34.89 33.67 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.233 0 N-CA-C 109.583 -0.525 . . . . 0.0 109.583 179.851 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -70.15 -52.0 20.25 Favored Glycine 0 C--N 1.338 0.667 0 N-CA-C 111.619 -0.592 . . . . 0.0 111.619 -176.531 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 38.6 mtm180 -65.95 -41.79 90.83 Favored 'General case' 0 N--CA 1.45 -0.466 0 C-N-CA 120.306 -0.558 . . . . 0.0 109.608 178.839 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -67.44 -31.29 71.36 Favored 'General case' 0 N--CA 1.45 -0.442 0 C-N-CA 119.703 -0.799 . . . . 0.0 110.865 -177.645 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 1.4 m-30 -66.52 -44.84 81.38 Favored 'General case' 0 CA--C 1.52 -0.199 0 CA-C-N 118.801 0.728 . . . . 0.0 110.348 177.368 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 42.9 tp -70.62 -45.74 64.65 Favored 'General case' 0 N--CA 1.447 -0.6 0 C-N-CA 117.914 -1.514 . . . . 0.0 109.281 179.387 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 83.1 m-20 -56.91 -45.91 82.31 Favored 'General case' 0 CA--C 1.531 0.247 0 N-CA-C 113.164 0.802 . . . . 0.0 113.164 179.017 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 4.7 tm-20 -64.79 -48.62 73.78 Favored 'General case' 0 N--CA 1.453 -0.323 0 CA-C-N 119.115 0.87 . . . . 0.0 110.994 -179.66 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 68.9 p -67.41 -25.91 66.17 Favored 'General case' 0 CA--C 1.528 0.125 0 O-C-N 122.219 -0.301 . . . . 0.0 110.694 179.133 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 35.3 ttp180 -75.93 -20.36 58.04 Favored 'General case' 0 N--CA 1.452 -0.361 0 C-N-CA 124.155 0.982 . . . . 0.0 111.757 171.98 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 53.4 m -83.21 -26.71 30.55 Favored 'General case' 0 CA--C 1.529 0.135 0 CA-C-O 119.364 -0.35 . . . . 0.0 111.77 -179.4 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 58.0 t30 -159.2 158.41 32.62 Favored 'General case' 0 N--CA 1.454 -0.257 0 CA-C-N 118.132 0.424 . . . . 0.0 110.255 177.709 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 36.9 t -70.23 35.75 0.04 OUTLIER 'General case' 0 CA--C 1.535 0.387 0 C-N-CA 124.02 0.928 . . . . 0.0 112.948 -177.396 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 74.3 m-20 -65.65 141.29 58.44 Favored 'General case' 0 N--CA 1.453 -0.278 0 O-C-N 121.922 -0.487 . . . . 0.0 110.169 179.457 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 37.3 t -160.99 149.9 16.53 Favored 'General case' 0 N--CA 1.454 -0.25 0 CA-C-O 120.374 0.131 . . . . 0.0 110.76 179.508 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 27.9 t -81.67 -179.35 7.35 Favored 'General case' 0 N--CA 1.452 -0.335 0 N-CA-C 108.855 -0.794 . . . . 0.0 108.855 171.62 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 93.5 p -74.77 2.94 8.9 Favored 'General case' 0 CA--C 1.533 0.323 0 N-CA-C 112.882 0.697 . . . . 0.0 112.882 -177.37 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 25.6 t-20 -156.83 178.2 10.62 Favored 'General case' 0 CA--C 1.531 0.215 0 CA-C-N 118.541 0.61 . . . . 0.0 110.505 -176.226 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 90' ' ' LYS . . . . . 0.421 ' N ' ' HD2' ' A' ' 91' ' ' PRO . 28.6 tptp -59.91 -51.56 79.82 Favored Pre-proline 0 CA--C 1.536 0.41 0 CA-C-O 118.403 -0.808 . . . . 0.0 110.694 177.614 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 91' ' ' PRO . . . . . 0.421 ' HD2' ' N ' ' A' ' 90' ' ' LYS . 58.3 Cg_endo -65.92 151.18 84.77 Favored 'Trans proline' 0 N--CA 1.453 -0.906 0 C-N-CA 122.149 1.899 . . . . 0.0 108.647 169.365 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 96.1 19.56 28.19 Favored Glycine 0 CA--C 1.525 0.683 0 CA-C-O 119.466 -0.63 . . . . 0.0 112.569 -176.841 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 37.3 p -151.62 171.33 17.79 Favored 'General case' 0 CA--C 1.521 -0.17 0 CA-C-N 118.327 1.064 . . . . 0.0 110.922 178.595 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 94' ' ' CYS . . . . . 0.451 ' HB2' HD13 ' A' ' 98' ' ' ILE . 29.6 p -59.23 -24.79 63.47 Favored 'General case' 0 N--CA 1.451 -0.394 0 CA-C-N 115.404 -0.816 . . . . 0.0 109.287 175.133 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -60.69 -57.99 10.37 Favored 'General case' 0 N--CA 1.446 -0.675 0 N-CA-C 109.381 -0.6 . . . . 0.0 109.381 -176.814 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 63.0 t60 -75.4 -30.18 60.01 Favored 'General case' 0 N--CA 1.451 -0.406 0 N-CA-C 111.603 0.223 . . . . 0.0 111.603 -179.03 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -68.53 -51.36 43.84 Favored 'General case' 0 N--CA 1.448 -0.539 0 O-C-N 123.029 0.206 . . . . 0.0 111.127 -178.473 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 98' ' ' ILE . . . . . 0.451 HD13 ' HB2' ' A' ' 94' ' ' CYS . 2.0 mp -72.01 -29.62 33.66 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.198 0 C-N-CA 120.785 -0.366 . . . . 0.0 110.323 179.874 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 4.5 m120 -64.65 -48.78 73.56 Favored 'General case' 0 N--CA 1.455 -0.19 0 CA-C-N 118.373 0.533 . . . . 0.0 110.322 175.663 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 43.9 m -71.79 -33.94 69.0 Favored 'General case' 0 N--CA 1.456 -0.126 0 O-C-N 122.322 -0.236 . . . . 0.0 110.61 -175.717 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -71.04 -40.85 71.45 Favored 'General case' 0 N--CA 1.447 -0.578 0 N-CA-C 110.225 -0.287 . . . . 0.0 110.225 -179.794 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -64.27 -22.54 67.38 Favored Glycine 0 CA--C 1.528 0.906 0 CA-C-O 119.185 -0.786 . . . . 0.0 114.045 -172.333 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 16.0 mt-10 -95.16 -13.8 24.7 Favored 'General case' 0 C--O 1.231 0.116 0 CA-C-N 118.649 1.225 . . . . 0.0 112.015 -178.492 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 48.2 t -113.18 -23.45 4.34 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.198 0 CA-C-N 116.691 -0.231 . . . . 0.0 111.289 -173.543 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 105' ' ' ILE . . . . . . . . . . . . . 10.0 tp -59.98 -23.3 26.52 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.146 0 C-N-CA 122.922 0.489 . . . . 0.0 111.369 -178.34 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 26.5 pt20 -65.58 -29.53 70.14 Favored 'General case' 0 N--CA 1.452 -0.373 0 N-CA-C 110.288 -0.264 . . . . 0.0 110.288 179.351 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 107' ' ' GLU . . . . . 0.43 ' CD ' HH22 ' A' ' 55' ' ' ARG . 37.8 mt-10 -75.88 -39.91 55.54 Favored 'General case' 0 N--CA 1.455 -0.19 0 CA-C-N 118.079 0.4 . . . . 0.0 110.164 177.445 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 9.8 mp -67.95 -42.37 81.07 Favored 'General case' 0 N--CA 1.453 -0.314 0 N-CA-C 110.066 -0.346 . . . . 0.0 110.066 -178.462 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 90.2 mt -69.52 -59.17 3.15 Favored 'General case' 0 N--CA 1.454 -0.27 0 CA-C-O 119.113 -0.47 . . . . 0.0 110.583 -179.285 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 12.1 p -45.5 -52.74 9.88 Favored 'General case' 0 C--O 1.232 0.17 0 CA-C-N 118.163 0.438 . . . . 0.0 111.806 -179.696 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 34.2 t0 -64.34 -38.93 92.76 Favored 'General case' 0 N--CA 1.445 -0.706 0 N-CA-C 110.099 -0.334 . . . . 0.0 110.099 -178.271 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -70.41 -32.98 70.82 Favored 'General case' 0 N--CA 1.448 -0.568 0 CA-C-O 119.244 -0.407 . . . . 0.0 110.671 -177.914 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 113' ' ' ILE . . . . . . . . . . . . . 46.1 mm -65.23 -41.3 91.21 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.133 0 N-CA-C 108.525 -0.917 . . . . 0.0 108.525 178.175 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -74.6 -38.46 62.6 Favored 'General case' 0 N--CA 1.454 -0.27 0 N-CA-C 112.13 0.418 . . . . 0.0 112.13 179.89 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -75.5 -34.17 60.82 Favored 'General case' 0 C--N 1.339 0.138 0 N-CA-C 112.784 0.661 . . . . 0.0 112.784 -176.53 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 116' ' ' SER . . . . . 0.479 ' HB2' ' HB2' ' A' ' 120' ' ' HIS . 86.5 p -82.13 154.08 25.71 Favored 'General case' 0 N--CA 1.452 -0.352 0 N-CA-C 113.739 1.014 . . . . 0.0 113.739 -168.718 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 48.8 t30 -72.01 165.46 24.2 Favored 'General case' 0 CA--C 1.533 0.296 0 C-N-CA 124.036 0.935 . . . . 0.0 110.329 176.27 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 118' ' ' GLN . . . . . . . . . . . . . 25.6 mm100 -52.71 -40.78 63.31 Favored 'General case' 0 N--CA 1.456 -0.141 0 N-CA-C 113.239 0.829 . . . . 0.0 113.239 -171.633 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 20.4 p-10 -72.44 -41.06 66.56 Favored 'General case' 0 N--CA 1.456 -0.151 0 C-N-CA 120.606 -0.437 . . . . 0.0 109.828 -179.613 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 120' ' ' HIS . . . . . 0.479 ' HB2' ' HB2' ' A' ' 116' ' ' SER . 14.6 m-70 -65.22 -34.83 79.3 Favored 'General case' 0 N--CA 1.452 -0.334 0 C-N-CA 123.11 0.564 . . . . 0.0 110.366 178.226 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 55.8 mttm -61.15 -46.26 91.26 Favored 'General case' 0 C--N 1.341 0.208 0 N-CA-C 108.638 -0.875 . . . . 0.0 108.638 175.062 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 40.7 tp10 -67.39 -36.79 82.02 Favored 'General case' 0 N--CA 1.452 -0.336 0 CA-C-N 116.513 -0.312 . . . . 0.0 111.108 -176.313 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 34.1 mtmt -64.36 -31.68 72.98 Favored 'General case' 0 N--CA 1.452 -0.332 0 N-CA-C 109.61 -0.515 . . . . 0.0 109.61 176.912 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 124' ' ' ILE . . . . . . . . . . . . . 53.7 mt -74.0 -35.86 43.13 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.319 0 O-C-N 121.642 -0.661 . . . . 0.0 109.785 175.696 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 11.7 mmm180 -63.79 -39.74 94.97 Favored 'General case' 0 C--N 1.34 0.174 0 CA-C-N 118.522 0.601 . . . . 0.0 110.353 -179.778 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 126' ' ' MET . . . . . . . . . . . . . 18.6 ptp -68.9 -32.26 71.77 Favored 'General case' 0 N--CA 1.455 -0.189 0 C-N-CA 119.623 -0.831 . . . . 0.0 109.354 176.736 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 2.0 mp -60.52 -33.06 72.09 Favored 'General case' 0 CA--C 1.531 0.221 0 CA-C-N 118.647 0.658 . . . . 0.0 110.277 175.787 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 128' ' ' LEU . . . . . 0.435 ' HA ' HD13 ' A' ' 128' ' ' LEU . 3.1 mm? -70.27 -42.11 72.56 Favored 'General case' 0 CA--C 1.523 -0.064 0 CA-C-N 118.701 0.682 . . . . 0.0 109.992 177.196 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 15.6 t0 -61.0 -45.03 96.49 Favored 'General case' 0 N--CA 1.455 -0.211 0 CA-C-O 121.085 0.469 . . . . 0.0 109.797 177.124 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 130' ' ' ILE . . . . . 0.413 ' HA ' ' HD3' ' A' ' 133' ' ' ARG . 53.6 mt -61.05 -36.89 75.6 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.348 0 C-N-CA 123.575 0.75 . . . . 0.0 110.511 -178.29 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 131' ' ' TRP . . . . . . . . . . . . . 51.3 m0 -77.98 -31.32 50.7 Favored 'General case' 0 N--CA 1.451 -0.383 0 N-CA-C 112.897 0.703 . . . . 0.0 112.897 -179.834 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 88.6 m-20 -75.1 -22.77 58.04 Favored 'General case' 0 N--CA 1.454 -0.246 0 CA-C-N 118.258 0.481 . . . . 0.0 110.803 176.965 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 133' ' ' ARG . . . . . 0.466 HH21 ' C ' ' B' 2063 ' ' SER . 16.0 mtp180 -75.56 -35.99 60.52 Favored 'General case' 0 C--N 1.339 0.136 0 C-N-CA 123.099 0.56 . . . . 0.0 110.411 172.783 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 44.6 t -72.69 -16.22 61.68 Favored 'General case' 0 N--CA 1.455 -0.203 0 C-N-CA 122.594 0.358 . . . . 0.0 111.714 -179.692 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 135' ' ' GLY . . . . . . . . . . . . . . . 78.94 15.3 80.87 Favored Glycine 0 CA--C 1.527 0.83 0 CA-C-O 119.519 -0.601 . . . . 0.0 111.962 -179.451 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 136' ' ' LEU . . . . . . . . . . . . . 25.5 mt -60.84 156.94 16.13 Favored 'General case' 0 N--CA 1.456 -0.133 0 CA-C-N 117.793 0.796 . . . . 0.0 109.645 176.204 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 137' ' ' PHE . . . . . . . . . . . . . 79.7 t80 -66.99 -34.41 77.69 Favored 'General case' 0 C--O 1.232 0.177 0 N-CA-C 112.919 0.711 . . . . 0.0 112.919 -171.46 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 138' ' ' GLN . . . . . . . . . . . . . 18.5 pm0 -71.27 152.24 43.47 Favored 'General case' 0 N--CA 1.455 -0.21 0 CA-C-N 118.497 0.589 . . . . 0.0 109.683 178.253 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 139' ' ' LYS . . . . . . . . . . . . . 13.4 mmtm -138.83 143.81 39.0 Favored 'General case' 0 N--CA 1.456 -0.135 0 CA-C-O 121.184 0.516 . . . . 0.0 111.222 -175.304 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 140' ' ' SER . . . . . . . . . . . . . 88.1 p -74.63 -4.51 37.59 Favored 'General case' 0 N--CA 1.456 -0.171 0 C-N-CA 123.976 0.91 . . . . 0.0 112.368 -179.162 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 141' ' ' TYR . . . . . . . . . . . . . 6.4 m-30 -76.23 -17.49 59.48 Favored 'General case' 0 N--CA 1.455 -0.213 0 N-CA-C 113.033 0.753 . . . . 0.0 113.033 -173.272 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 142' ' ' LEU . . . . . . . . . . . . . 79.3 mt -74.03 139.75 44.94 Favored 'General case' 0 N--CA 1.456 -0.164 0 CA-C-N 118.771 0.714 . . . . 0.0 110.285 -175.859 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 17.6 p30 -67.53 -14.9 63.34 Favored 'General case' 0 CA--C 1.531 0.226 0 CA-C-N 116.822 -0.172 . . . . 0.0 111.386 -176.977 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . -67.96 -34.47 76.62 Favored 'General case' 0 N--CA 1.447 -0.585 0 N-CA-C 109.409 -0.589 . . . . 0.0 109.409 175.182 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 145' ' ' ILE . . . . . . . . . . . . . 19.5 mm -78.33 -25.21 13.83 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.236 0 CA-C-O 120.588 0.233 . . . . 0.0 110.389 -179.871 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 146' ' ' ARG . . . . . . . . . . . . . 37.2 mtt180 -73.4 -23.93 60.23 Favored 'General case' 0 N--CA 1.456 -0.152 0 N-CA-C 109.718 -0.475 . . . . 0.0 109.718 175.425 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 147' ' ' SER . . . . . . . . . . . . . 84.1 p 46.69 57.1 5.83 Favored 'General case' 0 C--N 1.339 0.148 0 C-N-CA 124.604 1.162 . . . . 0.0 111.399 172.003 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 148' ' ' LYS . . . . . 0.615 ' HD3' ' H ' ' A' ' 148' ' ' LYS . 0.0 OUTLIER -54.72 -14.99 1.56 Allowed 'General case' 0 CA--C 1.532 0.283 0 C-N-CA 124.229 1.012 . . . . 0.0 112.408 -178.566 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 149' ' ' CYS . . . . . . . . . . . . . 26.1 p -63.13 -29.81 71.09 Favored 'General case' 0 N--CA 1.452 -0.374 0 CA-C-N 118.345 0.52 . . . . 0.0 109.757 177.432 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 150' ' ' PHE . . . . . . . . . . . . . 43.4 t80 -70.71 -24.62 62.68 Favored 'General case' 0 N--CA 1.453 -0.285 0 CA-C-N 118.142 0.428 . . . . 0.0 110.265 179.224 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 151' ' ' ALA . . . . . . . . . . . . . . . -76.62 -30.54 56.95 Favored 'General case' 0 N--CA 1.45 -0.46 0 N-CA-C 109.67 -0.493 . . . . 0.0 109.67 174.555 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 152' ' ' MET . . . . . . . . . . . . . 96.7 mmm -73.3 -23.49 60.28 Favored 'General case' 0 CA--C 1.531 0.212 0 CA-C-O 119.746 -0.168 . . . . 0.0 111.121 176.711 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 153' ' ' ASP . . . . . . . . . . . . . 71.1 m-20 -68.18 -14.14 62.76 Favored 'General case' 0 CA--C 1.531 0.22 0 C-N-CA 122.455 0.302 . . . . 0.0 111.552 175.209 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 154' ' ' LEU . . . . . . . . . . . . . 52.7 mt -78.44 38.95 0.32 Allowed 'General case' 0 CA--C 1.53 0.175 0 C-N-CA 123.117 0.567 . . . . 0.0 111.666 -179.934 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 155' ' ' GLU . . . . . . . . . . . . . 17.2 pt-20 -73.69 -174.73 1.84 Allowed 'General case' 0 CA--C 1.535 0.393 0 C-N-CA 123.056 0.542 . . . . 0.0 111.087 -178.965 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 156' ' ' HIS . . . . . . . . . . . . . 80.3 t60 -64.88 -1.17 1.82 Allowed 'General case' 0 CA--C 1.534 0.35 0 N-CA-C 113.682 0.993 . . . . 0.0 113.682 -174.105 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 157' ' ' HIS . . . . . . . . . . . . . 35.3 p-80 -152.26 156.14 39.1 Favored 'General case' 0 N--CA 1.453 -0.314 0 CA-C-N 118.158 0.436 . . . . 0.0 109.878 -179.676 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 158' ' ' HIS . . . . . . . . . . . . . 53.2 p-80 -83.24 164.68 19.96 Favored 'General case' 0 N--CA 1.453 -0.304 0 C-N-CA 122.649 0.38 . . . . 0.0 110.463 178.111 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 159' ' ' HIS . . . . . . . . . . . . . 59.5 m170 . . . . . 0 C--O 1.251 1.151 0 CA-C-O 117.251 -1.357 . . . . 0.0 110.013 176.654 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' B' B 2052 ' ' ASP . . . . . 0.493 ' OD2' ' HE2' ' A' ' 21' ' ' LYS . 0.7 OUTLIER . . . . . 0 N--CA 1.473 0.714 0 CA-C-O 120.274 0.083 . . . . 0.0 111.094 . . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B 2053 ' ' ASP . . . . . . . . . . . . . 50.2 p-10 -124.22 20.31 8.95 Favored 'General case' 0 CA--C 1.53 0.174 0 C-N-CA 123.523 0.729 . . . . 0.0 110.664 -177.041 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B 2054 ' ' ASP . . . . . . . . . . . . . 38.5 t0 -142.74 179.48 6.97 Favored 'General case' 0 N--CA 1.451 -0.397 0 N-CA-C 109.394 -0.595 . . . . 0.0 109.394 -175.606 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B 2055 ' ' GLU . . . . . . . . . . . . . 86.4 mt-10 -57.87 -13.16 3.9 Favored 'General case' 0 N--CA 1.454 -0.232 0 C-N-CA 124.24 1.016 . . . . 0.0 111.934 179.379 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B 2056 ' ' ASP . . . . . . . . . . . . . 91.3 m-20 47.72 -126.27 1.76 Allowed 'General case' 0 N--CA 1.452 -0.335 0 C-N-CA 123.164 0.586 . . . . 0.0 110.708 -177.298 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B 2057 ' ' ASP . . . . . . . . . . . . . 28.5 t0 -57.06 89.64 0.01 OUTLIER 'General case' 0 CA--C 1.533 0.316 0 C-N-CA 123.858 0.863 . . . . 0.0 112.429 -173.293 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B 2058 ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -62.78 142.57 58.12 Favored 'General case' 0 N--CA 1.454 -0.252 0 C-N-CA 124.967 1.307 . . . . 0.0 110.994 178.628 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B 2059 ' ' THR . . . . . . . . . . . . . 52.5 m -112.13 117.89 47.01 Favored Pre-proline 0 N--CA 1.452 -0.326 0 N-CA-C 108.633 -0.877 . . . . 0.0 108.633 178.216 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B 2060 ' ' PRO . . . . . . . . . . . . . 88.9 Cg_endo -75.5 167.66 26.1 Favored 'Trans proline' 0 N--CA 1.45 -1.062 0 C-N-CA 123.678 2.919 . . . . 0.0 111.378 -178.39 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B 2061 ' ' SER . . . . . . . . . . . . . 39.9 t -150.41 142.76 24.3 Favored 'General case' 0 N--CA 1.453 -0.282 0 N-CA-C 109.364 -0.606 . . . . 0.0 109.364 175.861 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B 2062 ' ' ILE . . . . . 0.409 HD13 ' HB2' ' A' ' 133' ' ' ARG . 16.7 tt -167.06 155.34 1.29 Allowed 'Isoleucine or valine' 0 N--CA 1.455 -0.217 0 C-N-CA 123.508 0.723 . . . . 0.0 110.052 -178.181 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B 2063 ' ' SER . . . . . 0.466 ' C ' HH21 ' A' ' 133' ' ' ARG . 80.3 p . . . . . 0 C--O 1.247 0.96 0 CA-C-O 117.211 -1.376 . . . . 0.0 109.722 174.453 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.473 0.697 0 N-CA-C 110.286 -0.264 . . . . 0.0 110.286 . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 2' ' ' GLN . . . . . 0.595 ' HG2' ' H ' ' A' ' 4' ' ' ASP . 14.5 pm0 -157.52 -165.37 1.77 Allowed 'General case' 0 N--CA 1.453 -0.293 0 N-CA-C 108.709 -0.849 . . . . 0.0 108.709 -178.62 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 4.6 pm0 -61.38 -10.75 7.97 Favored 'General case' 0 CA--C 1.532 0.268 0 O-C-N 121.519 -0.738 . . . . 0.0 112.547 -178.236 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 4' ' ' ASP . . . . . 0.595 ' H ' ' HG2' ' A' ' 2' ' ' GLN . 4.8 m-20 -86.24 8.46 21.15 Favored 'General case' 0 C--N 1.341 0.219 0 N-CA-C 112.467 0.543 . . . . 0.0 112.467 179.606 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 25.3 m-20 -81.67 11.31 4.88 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.927 -0.579 . . . . 0.0 111.998 -176.634 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 18.8 p-10 -76.83 -32.18 57.39 Favored 'General case' 0 N--CA 1.453 -0.32 0 N-CA-C 107.443 -1.317 . . . . 0.0 107.443 173.599 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER -62.34 -34.42 76.6 Favored 'General case' 0 N--CA 1.443 -0.816 0 C-N-CA 125.515 1.526 . . . . 0.0 111.174 -176.427 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 17.4 tp60 -50.56 -36.2 33.38 Favored 'General case' 0 N--CA 1.456 -0.135 0 C-N-CA 123.141 0.576 . . . . 0.0 111.325 -178.455 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 26.5 m-80 -70.99 -39.69 72.31 Favored 'General case' 0 N--CA 1.454 -0.248 0 N-CA-C 110.194 -0.298 . . . . 0.0 110.194 -179.389 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 10' ' ' PHE . . . . . 0.526 ' CE2' ' HB2' ' A' ' 32' ' ' LEU . 3.7 t80 -68.56 -37.51 79.96 Favored 'General case' 0 N--CA 1.451 -0.408 0 C-N-CA 123.476 0.71 . . . . 0.0 109.873 178.089 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 94.7 t -66.28 -51.19 61.67 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.219 0 N-CA-C 108.221 -1.029 . . . . 0.0 108.221 178.601 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -61.64 -25.76 67.57 Favored 'General case' 0 N--CA 1.452 -0.344 0 C-N-CA 122.844 0.458 . . . . 0.0 111.717 179.789 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 59.3 m -74.61 -37.02 62.96 Favored 'General case' 0 N--CA 1.456 -0.155 0 N-CA-C 108.972 -0.751 . . . . 0.0 108.972 175.613 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -66.49 -44.25 83.16 Favored 'General case' 0 N--CA 1.448 -0.54 0 N-CA-C 108.617 -0.883 . . . . 0.0 108.617 177.088 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 68.2 mm-40 -66.53 -27.03 67.44 Favored 'General case' 0 N--CA 1.451 -0.41 0 C-N-CA 123.952 0.901 . . . . 0.0 110.001 177.864 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 22.0 t -67.93 -35.16 77.97 Favored 'General case' 0 N--CA 1.451 -0.379 0 N-CA-C 109.316 -0.624 . . . . 0.0 109.316 177.521 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 17' ' ' PHE . . . . . 0.519 ' HA ' HD12 ' A' ' 20' ' ' LEU . 46.6 m-85 -67.9 -39.32 83.64 Favored 'General case' 0 CA--C 1.518 -0.267 0 C-N-CA 120.304 -0.558 . . . . 0.0 110.439 173.977 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 72.1 mttt -58.7 -32.81 69.5 Favored 'General case' 0 C--N 1.339 0.11 0 C-N-CA 120.46 -0.496 . . . . 0.0 109.714 178.849 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 24.9 t0 -76.33 -45.73 30.84 Favored 'General case' 0 N--CA 1.456 -0.151 0 C-N-CA 123.27 0.628 . . . . 0.0 111.05 176.292 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 20' ' ' LEU . . . . . 0.519 HD12 ' HA ' ' A' ' 17' ' ' PHE . 3.8 mt -46.99 136.49 8.38 Favored 'General case' 0 N--CA 1.454 -0.231 0 C-N-CA 123.224 0.61 . . . . 0.0 112.073 -173.473 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.49 -13.0 60.26 Favored 'General case' 0 CA--C 1.53 0.205 0 CA-C-N 115.252 -0.886 . . . . 0.0 111.88 -174.621 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 22' ' ' SER . . . . . 0.418 ' C ' ' H ' ' A' ' 24' ' ' ILE . 67.3 m -120.96 -10.85 9.02 Favored 'General case' 0 CA--C 1.528 0.122 0 C-N-CA 123.692 0.797 . . . . 0.0 112.005 -178.397 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 74.39 -21.66 1.43 Allowed Glycine 0 CA--C 1.531 1.059 0 N-CA-C 111.344 -0.702 . . . . 0.0 111.344 -174.824 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 24' ' ' ILE . . . . . 0.418 ' H ' ' C ' ' A' ' 22' ' ' SER . 81.0 mt -94.19 154.22 3.34 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.136 0 C-N-CA 124.498 1.119 . . . . 0.0 109.604 174.301 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 25' ' ' SER . . . . . 0.507 ' HB2' HD13 ' A' ' 20' ' ' LEU . 30.3 t -168.44 107.38 0.49 Allowed 'General case' 0 CA--C 1.517 -0.306 0 CA-C-O 119.451 -0.309 . . . . 0.0 110.289 168.933 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 26' ' ' GLY . . . . . 0.421 ' O ' ' HE2' ' A' ' 30' ' ' LYS . . . -54.61 -39.57 67.13 Favored Glycine 0 CA--C 1.524 0.634 0 C-N-CA 120.091 -1.052 . . . . 0.0 110.618 179.924 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 29.0 t -63.08 -52.31 63.21 Favored 'General case' 0 N--CA 1.455 -0.193 0 CA-C-N 117.866 0.833 . . . . 0.0 110.745 -178.075 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 74.2 mmt-85 -68.17 -39.46 82.56 Favored 'General case' 0 C--O 1.231 0.129 0 O-C-N 122.103 -0.373 . . . . 0.0 110.265 -178.971 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 72.9 mt -61.01 -47.59 92.89 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.511 0 N-CA-C 109.595 -0.52 . . . . 0.0 109.595 178.789 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 30' ' ' LYS . . . . . 0.421 ' HE2' ' O ' ' A' ' 26' ' ' GLY . 51.2 mtmt -64.75 -28.97 69.94 Favored 'General case' 0 C--N 1.341 0.2 0 CA-C-O 119.289 -0.386 . . . . 0.0 111.151 -179.782 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 31' ' ' LYS . . . . . 0.434 ' HE2' ' HA ' ' A' ' 31' ' ' LYS . 4.6 mmpt? -65.63 -58.74 5.01 Favored 'General case' 0 C--O 1.231 0.085 0 CA-C-N 118.362 0.528 . . . . 0.0 110.839 179.547 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.556 HD12 ' N ' ' A' ' 33' ' ' THR . 1.6 pp -72.21 -20.97 61.48 Favored 'General case' 0 CA--C 1.528 0.115 0 C-N-CA 118.967 -1.093 . . . . 0.0 111.249 -177.642 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 33' ' ' THR . . . . . 0.556 ' N ' HD12 ' A' ' 32' ' ' LEU . 55.2 m -72.51 -40.7 66.65 Favored 'General case' 0 N--CA 1.455 -0.215 0 N-CA-C 109.364 -0.606 . . . . 0.0 109.364 178.169 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 99.9 m -69.31 -38.29 78.17 Favored 'General case' 0 N--CA 1.451 -0.389 0 C-N-CA 121.008 -0.277 . . . . 0.0 110.392 -177.671 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 42.9 t80 -66.44 -34.33 77.7 Favored 'General case' 0 N--CA 1.455 -0.223 0 C-N-CA 119.821 -0.752 . . . . 0.0 110.047 176.547 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -71.49 -32.18 67.95 Favored 'General case' 0 N--CA 1.452 -0.347 0 CA-C-O 119.376 -0.345 . . . . 0.0 111.477 179.094 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -75.07 -34.1 61.77 Favored 'General case' 0 N--CA 1.457 -0.103 0 CA-C-N 118.129 0.422 . . . . 0.0 110.544 179.003 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 44.1 t0 -67.71 -22.74 65.24 Favored 'General case' 0 N--CA 1.455 -0.212 0 N-CA-C 110.403 -0.221 . . . . 0.0 110.403 175.86 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 98.1 m-70 -151.44 99.01 2.59 Favored 'General case' 0 C--N 1.342 0.263 0 C-N-CA 122.871 0.468 . . . . 0.0 111.461 -175.157 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 40' ' ' ILE . . . . . 0.505 ' H ' HD13 ' A' ' 40' ' ' ILE . 0.0 OUTLIER -75.91 -14.59 15.2 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.322 0 CA-C-O 119.268 -0.396 . . . . 0.0 110.478 175.14 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 89.4 m-20 -58.58 -16.88 17.76 Favored 'General case' 0 CA--C 1.531 0.232 0 N-CA-C 112.723 0.638 . . . . 0.0 112.723 -178.204 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -106.71 13.19 8.33 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.159 0 C-N-CA 122.803 0.441 . . . . 0.0 111.859 177.473 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 3.0 pp20? -52.49 -30.07 28.24 Favored 'General case' 0 CA--C 1.527 0.085 0 O-C-N 121.755 -0.591 . . . . 0.0 111.557 177.532 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 40.3 t -62.4 -48.19 80.79 Favored 'General case' 0 CA--C 1.53 0.209 0 N-CA-C 112.299 0.481 . . . . 0.0 112.299 -179.326 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 18.2 ptpt -71.93 -25.58 61.95 Favored 'General case' 0 C--N 1.339 0.139 0 N-CA-C 109.494 -0.558 . . . . 0.0 109.494 179.32 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 46' ' ' ILE . . . . . 0.467 HG12 ' CZ ' ' A' ' 10' ' ' PHE . 88.7 mt -71.01 -50.38 42.93 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.297 0 C-N-CA 122.798 0.439 . . . . 0.0 110.064 -178.96 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 35.5 mm -63.75 -35.03 71.58 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.169 0 N-CA-C 109.402 -0.592 . . . . 0.0 109.402 179.237 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 50.1 m -63.68 -39.4 94.22 Favored 'General case' 0 N--CA 1.452 -0.332 0 O-C-N 122.429 -0.17 . . . . 0.0 111.073 -179.192 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -78.46 -30.58 47.5 Favored 'General case' 0 N--CA 1.456 -0.163 0 N-CA-C 113.465 0.913 . . . . 0.0 113.465 -178.728 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 13.5 pt -70.15 -40.32 78.08 Favored 'Isoleucine or valine' 0 C--N 1.34 0.161 0 CA-C-N 119.963 1.256 . . . . 0.0 110.259 177.994 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 22.1 pt -69.11 -39.91 80.01 Favored 'Isoleucine or valine' 0 C--N 1.338 0.103 0 C-N-CA 120.138 -0.625 . . . . 0.0 110.315 179.584 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 44.4 t0 -65.42 -49.34 69.58 Favored 'General case' 0 N--CA 1.456 -0.174 0 CA-C-N 117.906 0.321 . . . . 0.0 110.841 178.492 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 44.5 t80 -62.74 -43.22 99.36 Favored 'General case' 0 N--CA 1.453 -0.31 0 N-CA-C 109.538 -0.542 . . . . 0.0 109.538 179.671 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 34.7 t -62.49 -30.83 71.55 Favored 'General case' 0 N--CA 1.454 -0.237 0 CA-C-N 118.175 0.443 . . . . 0.0 111.492 -177.786 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 7.1 tpt180 -81.34 -44.53 17.49 Favored 'General case' 0 N--CA 1.454 -0.25 0 CA-C-N 118.126 0.421 . . . . 0.0 111.271 -178.942 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 95.0 mt -77.37 -47.51 19.69 Favored 'General case' 0 N--CA 1.456 -0.146 0 N-CA-C 114.032 1.123 . . . . 0.0 114.032 -175.56 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 57' ' ' CYS . . . . . 0.425 ' HA ' ' HD3' ' A' ' 58' ' ' PRO . 13.5 p -61.39 158.46 38.09 Favored Pre-proline 0 CA--C 1.536 0.408 0 N-CA-C 113.957 1.095 . . . . 0.0 113.957 -169.718 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 58' ' ' PRO . . . . . 0.425 ' HD3' ' HA ' ' A' ' 57' ' ' CYS . 31.7 Cg_exo -59.12 174.05 1.09 Allowed 'Trans proline' 0 N--CA 1.455 -0.774 1 C-N-CA 125.801 4.334 . . . . 0.0 113.439 176.442 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 27.3 p30 -58.48 -47.75 83.06 Favored 'General case' 0 CA--C 1.531 0.225 0 CA-C-N 115.179 -0.919 . . . . 0.0 112.624 -173.695 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 34.3 m -70.66 -29.77 66.2 Favored 'General case' 0 N--CA 1.453 -0.299 0 CA-C-O 120.927 0.394 . . . . 0.0 110.18 -179.0 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 62.9 m80 -75.34 -27.16 59.1 Favored 'General case' 0 N--CA 1.45 -0.468 0 C-N-CA 122.812 0.445 . . . . 0.0 110.313 177.701 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 62' ' ' LYS . . . . . 0.416 ' HE2' ' O ' ' A' ' 57' ' ' CYS . 64.1 mttm -67.79 -37.46 82.05 Favored 'General case' 0 N--CA 1.457 -0.084 0 N-CA-C 109.668 -0.493 . . . . 0.0 109.668 171.613 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -62.79 -42.84 99.88 Favored 'General case' 0 CA--C 1.53 0.199 0 N-CA-C 108.045 -1.095 . . . . 0.0 108.045 173.341 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -66.83 -30.99 76.99 Favored Glycine 0 C--N 1.34 0.75 0 N-CA-C 111.811 -0.515 . . . . 0.0 111.811 -179.423 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 30.0 t -68.62 -40.45 80.37 Favored 'General case' 0 N--CA 1.45 -0.443 0 CA-C-N 117.665 0.732 . . . . 0.0 109.884 178.317 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 77.0 mt -70.99 -24.12 62.32 Favored 'General case' 0 N--CA 1.45 -0.438 0 N-CA-C 109.767 -0.457 . . . . 0.0 109.767 178.922 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -73.49 -38.85 65.25 Favored 'General case' 0 N--CA 1.456 -0.169 0 C-N-CA 122.822 0.449 . . . . 0.0 110.698 174.765 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 68' ' ' ILE . . . . . 0.443 HD11 ' CD1' ' A' ' 17' ' ' PHE . 19.6 mt -65.59 -51.06 67.61 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.295 0 N-CA-C 108.594 -0.891 . . . . 0.0 108.594 175.211 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 86.0 mt -55.89 -32.01 31.63 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.303 0 C-N-CA 123.662 0.785 . . . . 0.0 111.4 176.588 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 15.0 t70 -69.31 -51.41 37.43 Favored 'General case' 0 N--CA 1.454 -0.264 0 O-C-N 121.757 -0.589 . . . . 0.0 111.157 178.757 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 90.2 p -67.64 -48.06 67.79 Favored 'General case' 0 N--CA 1.452 -0.368 0 O-C-N 122.987 0.18 . . . . 0.0 111.059 -175.128 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -75.72 -34.79 29.32 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.168 0 N-CA-C 109.818 -0.438 . . . . 0.0 109.818 -179.672 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -67.82 -48.21 56.48 Favored Glycine 0 C--N 1.336 0.569 0 N-CA-C 110.811 -0.916 . . . . 0.0 110.811 -176.376 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 39.5 mtm180 -68.41 -42.9 78.33 Favored 'General case' 0 N--CA 1.448 -0.526 0 CA-C-N 117.408 0.604 . . . . 0.0 109.899 178.394 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -62.38 -31.31 71.96 Favored 'General case' 0 N--CA 1.449 -0.498 0 C-N-CA 120.302 -0.559 . . . . 0.0 110.498 -178.462 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 1.9 m-30 -70.86 -51.97 23.14 Favored 'General case' 0 N--CA 1.456 -0.169 0 CA-C-N 118.46 0.573 . . . . 0.0 110.934 176.413 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 43.6 tp -68.34 -36.92 79.96 Favored 'General case' 0 N--CA 1.449 -0.493 0 C-N-CA 118.212 -1.395 . . . . 0.0 110.092 -176.952 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 83.8 m-20 -64.89 -45.41 86.07 Favored 'General case' 0 N--CA 1.454 -0.274 0 CA-C-O 119.645 -0.217 . . . . 0.0 111.507 179.052 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 16.0 tm-20 -64.92 -49.04 71.95 Favored 'General case' 0 N--CA 1.446 -0.661 0 CA-C-N 118.17 0.441 . . . . 0.0 111.575 179.378 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 80' ' ' THR . . . . . 0.541 HG21 ' CB ' ' A' ' 94' ' ' CYS . 79.9 p -68.32 -25.45 65.12 Favored 'General case' 0 CA--C 1.531 0.243 0 CA-C-N 117.933 0.333 . . . . 0.0 110.577 -178.538 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 37.3 ttp-105 -74.73 -30.7 61.6 Favored 'General case' 0 CA--C 1.53 0.2 0 C-N-CA 122.813 0.445 . . . . 0.0 111.42 173.023 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 58.0 m -75.74 -28.01 58.34 Favored 'General case' 0 N--CA 1.458 -0.063 0 N-CA-C 112.65 0.611 . . . . 0.0 112.65 -175.839 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -159.95 158.47 30.77 Favored 'General case' 0 N--CA 1.456 -0.15 0 CA-C-N 118.093 0.406 . . . . 0.0 110.951 -179.964 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 32.2 t -71.6 22.12 0.05 OUTLIER 'General case' 0 CA--C 1.535 0.399 0 N-CA-C 113.99 1.108 . . . . 0.0 113.99 -173.308 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 93.3 m-20 -61.62 134.31 56.65 Favored 'General case' 0 N--CA 1.454 -0.231 0 N-CA-C 109.078 -0.712 . . . . 0.0 109.078 177.986 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 77.9 p -160.41 161.45 33.02 Favored 'General case' 0 N--CA 1.452 -0.342 0 CA-C-N 116.508 -0.315 . . . . 0.0 110.341 -176.878 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 87' ' ' SER . . . . . 0.444 ' H ' ' CG2' ' A' ' 93' ' ' THR . 11.1 t -92.62 178.71 5.72 Favored 'General case' 0 N--CA 1.453 -0.304 0 C-N-CA 123.247 0.619 . . . . 0.0 110.533 -179.988 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 79.4 p -73.98 -5.23 40.08 Favored 'General case' 0 N--CA 1.455 -0.224 0 C-N-CA 123.186 0.594 . . . . 0.0 112.455 -178.001 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 11.2 m120 -148.26 178.12 8.84 Favored 'General case' 0 CA--C 1.528 0.126 0 CA-C-N 118.314 0.506 . . . . 0.0 110.294 -175.748 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 90' ' ' LYS . . . . . 0.432 ' HE3' ' HB1' ' A' ' 95' ' ' ALA . 22.0 tptm -59.93 -53.35 66.22 Favored Pre-proline 0 CA--C 1.53 0.183 0 CA-C-O 118.552 -0.737 . . . . 0.0 110.197 176.159 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 91' ' ' PRO . . . . . 0.424 ' HD2' ' N ' ' A' ' 90' ' ' LYS . 55.4 Cg_endo -64.16 152.64 80.3 Favored 'Trans proline' 0 N--CA 1.454 -0.833 0 C-N-CA 122.359 2.039 . . . . 0.0 108.352 171.007 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 95.76 15.53 42.51 Favored Glycine 0 CA--C 1.524 0.645 0 CA-C-O 119.464 -0.631 . . . . 0.0 112.314 -177.165 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 93' ' ' THR . . . . . 0.444 ' CG2' ' H ' ' A' ' 87' ' ' SER . 42.0 p -150.33 168.65 23.47 Favored 'General case' 0 C--N 1.34 0.157 0 CA-C-N 118.446 1.123 . . . . 0.0 111.436 177.825 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 94' ' ' CYS . . . . . 0.657 ' SG ' HD13 ' A' ' 98' ' ' ILE . 7.5 t -54.96 -28.12 48.99 Favored 'General case' 0 N--CA 1.449 -0.48 0 CA-C-N 115.021 -0.991 . . . . 0.0 109.653 173.262 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 95' ' ' ALA . . . . . 0.432 ' HB1' ' HE3' ' A' ' 90' ' ' LYS . . . -57.84 -57.32 13.29 Favored 'General case' 0 N--CA 1.445 -0.71 0 N-CA-C 109.244 -0.65 . . . . 0.0 109.244 -178.324 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 61.0 t60 -75.64 -31.69 59.93 Favored 'General case' 0 N--CA 1.452 -0.35 0 C-N-CA 121.103 -0.239 . . . . 0.0 111.598 -179.193 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -67.4 -48.69 66.62 Favored 'General case' 0 N--CA 1.451 -0.422 0 O-C-N 122.92 0.138 . . . . 0.0 111.039 -177.255 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 98' ' ' ILE . . . . . 0.657 HD13 ' SG ' ' A' ' 94' ' ' CYS . 1.7 mp -73.69 -30.74 29.85 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.208 0 N-CA-C 109.903 -0.406 . . . . 0.0 109.903 179.998 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 3.5 m120 -64.68 -47.93 76.58 Favored 'General case' 0 N--CA 1.457 -0.09 0 CA-C-N 118.423 0.556 . . . . 0.0 110.942 175.104 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 47.5 m -72.39 -25.96 61.7 Favored 'General case' 0 N--CA 1.456 -0.157 0 C-N-CA 122.334 0.254 . . . . 0.0 110.563 -175.259 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 57.5 tp -80.33 -37.5 32.42 Favored 'General case' 0 N--CA 1.447 -0.595 0 C-N-CA 122.794 0.438 . . . . 0.0 110.867 178.876 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -75.02 -24.84 70.61 Favored Glycine 0 CA--C 1.527 0.809 0 CA-C-O 119.485 -0.619 . . . . 0.0 112.74 -175.954 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 24.1 pt-20 -78.14 -2.48 37.71 Favored 'General case' 0 CA--C 1.532 0.27 0 CA-C-N 117.98 0.89 . . . . 0.0 111.604 -179.928 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 36.0 m -138.47 9.56 0.69 Allowed 'Isoleucine or valine' 0 CA--C 1.529 0.167 0 N-CA-C 111.996 0.369 . . . . 0.0 111.996 176.288 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 105' ' ' ILE . . . . . . . . . . . . . 11.2 tp -62.28 -26.18 39.63 Favored 'Isoleucine or valine' 0 N--CA 1.458 -0.065 0 CA-C-N 118.697 0.681 . . . . 0.0 111.408 -175.367 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 10.2 pt20 -67.9 -28.47 67.53 Favored 'General case' 0 N--CA 1.453 -0.287 0 N-CA-C 110.154 -0.313 . . . . 0.0 110.154 178.617 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 74.6 mm-40 -75.55 -42.8 51.45 Favored 'General case' 0 N--CA 1.453 -0.283 0 N-CA-C 110.007 -0.368 . . . . 0.0 110.007 -178.017 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 7.3 mp -69.83 -43.77 71.3 Favored 'General case' 0 N--CA 1.448 -0.525 0 N-CA-C 109.703 -0.48 . . . . 0.0 109.703 -179.119 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 96.2 mt -66.72 -64.14 0.92 Allowed 'General case' 0 N--CA 1.452 -0.348 0 C-N-CA 120.592 -0.443 . . . . 0.0 110.261 178.788 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 21.1 t -50.86 -39.82 54.69 Favored 'General case' 0 C--O 1.233 0.199 0 N-CA-C 112.535 0.569 . . . . 0.0 112.535 -173.593 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 49.7 t0 -68.4 -43.8 76.44 Favored 'General case' 0 N--CA 1.456 -0.146 0 N-CA-C 110.206 -0.294 . . . . 0.0 110.206 178.914 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -69.21 -34.68 75.26 Favored 'General case' 0 N--CA 1.448 -0.569 0 CA-C-N 116.836 -0.166 . . . . 0.0 110.744 -178.137 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 113' ' ' ILE . . . . . . . . . . . . . 46.7 mm -66.96 -36.06 76.23 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.333 0 N-CA-C 109.334 -0.617 . . . . 0.0 109.334 179.204 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -74.81 -42.28 58.34 Favored 'General case' 0 N--CA 1.453 -0.31 0 N-CA-C 111.828 0.307 . . . . 0.0 111.828 178.03 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -78.14 -35.73 48.61 Favored 'General case' 0 N--CA 1.456 -0.163 0 N-CA-C 112.514 0.561 . . . . 0.0 112.514 -174.964 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 116' ' ' SER . . . . . 0.483 ' HB2' ' CB ' ' A' ' 120' ' ' HIS . 54.3 p -81.84 157.13 24.53 Favored 'General case' 0 N--CA 1.456 -0.172 0 N-CA-C 112.892 0.701 . . . . 0.0 112.892 -171.15 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 53.1 t30 -77.03 166.35 23.43 Favored 'General case' 0 C--O 1.226 -0.146 0 C-N-CA 123.203 0.601 . . . . 0.0 110.564 -178.563 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 118' ' ' GLN . . . . . . . . . . . . . 34.0 mt-30 -54.71 -36.54 64.83 Favored 'General case' 0 CA--C 1.531 0.221 0 N-CA-C 112.649 0.611 . . . . 0.0 112.649 -172.663 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 11.2 p-10 -70.99 -39.12 72.65 Favored 'General case' 0 C--O 1.226 -0.144 0 CA-C-O 121.099 0.476 . . . . 0.0 109.877 178.767 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 120' ' ' HIS . . . . . 0.483 ' CB ' ' HB2' ' A' ' 116' ' ' SER . 36.9 m170 -64.74 -38.89 92.53 Favored 'General case' 0 N--CA 1.45 -0.43 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.223 176.473 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 121' ' ' LYS . . . . . 0.614 ' HE3' ' CE2' ' A' ' 150' ' ' PHE . 46.2 mttm -58.95 -43.4 91.23 Favored 'General case' 0 C--N 1.342 0.274 0 N-CA-C 108.719 -0.845 . . . . 0.0 108.719 177.196 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 41.6 tp10 -66.34 -38.73 88.3 Favored 'General case' 0 N--CA 1.454 -0.25 0 CA-C-O 119.459 -0.305 . . . . 0.0 111.358 -176.982 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 53.2 mtpt -65.74 -28.88 69.36 Favored 'General case' 0 N--CA 1.452 -0.341 0 CA-C-N 118.511 0.596 . . . . 0.0 110.225 177.729 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 124' ' ' ILE . . . . . . . . . . . . . 61.6 mt -74.44 -37.18 44.03 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.24 0 N-CA-C 109.544 -0.539 . . . . 0.0 109.544 176.822 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 55.8 mmm-85 -65.53 -42.81 91.57 Favored 'General case' 0 C--O 1.23 0.076 0 O-C-N 122.215 -0.303 . . . . 0.0 110.969 179.851 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 126' ' ' MET . . . . . . . . . . . . . 28.6 ptm -67.57 -29.54 68.93 Favored 'General case' 0 N--CA 1.454 -0.273 0 C-N-CA 119.747 -0.781 . . . . 0.0 109.237 176.563 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 1.7 mp -63.15 -29.61 70.93 Favored 'General case' 0 N--CA 1.455 -0.208 0 CA-C-O 118.993 -0.527 . . . . 0.0 110.29 172.849 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 76.0 mt -69.16 -43.2 74.76 Favored 'General case' 0 C--N 1.34 0.163 0 CA-C-N 119.23 0.923 . . . . 0.0 109.935 175.691 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 67.0 m-20 -60.17 -39.37 86.2 Favored 'General case' 0 N--CA 1.463 0.18 0 CA-C-N 118.331 0.514 . . . . 0.0 110.041 176.514 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 130' ' ' ILE . . . . . 0.439 ' HA ' ' HD3' ' A' ' 133' ' ' ARG . 62.7 mt -66.15 -36.66 77.96 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.401 0 C-N-CA 122.911 0.484 . . . . 0.0 110.063 179.118 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 131' ' ' TRP . . . . . . . . . . . . . 49.4 m0 -75.7 -29.7 59.08 Favored 'General case' 0 N--CA 1.455 -0.197 0 N-CA-C 112.56 0.578 . . . . 0.0 112.56 177.9 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 65.3 m-20 -67.74 -31.5 71.46 Favored 'General case' 0 N--CA 1.454 -0.228 0 CA-C-N 118.243 0.474 . . . . 0.0 109.903 175.975 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 133' ' ' ARG . . . . . 0.439 ' HD3' ' HA ' ' A' ' 130' ' ' ILE . 20.8 mtp180 -73.99 -37.95 64.28 Favored 'General case' 0 C--N 1.338 0.104 0 C-N-CA 122.907 0.483 . . . . 0.0 111.164 178.905 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 43.3 t -75.88 -15.24 60.24 Favored 'General case' 0 CA--C 1.531 0.227 0 O-C-N 122.083 -0.386 . . . . 0.0 110.826 176.045 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 135' ' ' GLY . . . . . . . . . . . . . . . 85.96 12.11 71.98 Favored Glycine 0 CA--C 1.528 0.857 0 CA-C-O 119.557 -0.58 . . . . 0.0 112.648 179.003 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 136' ' ' LEU . . . . . . . . . . . . . 65.3 mt -69.52 -34.58 74.47 Favored 'General case' 0 N--CA 1.454 -0.242 0 CA-C-N 118.034 0.917 . . . . 0.0 111.201 -179.624 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 137' ' ' PHE . . . . . . . . . . . . . 73.5 m-85 -153.78 -169.3 3.24 Favored 'General case' 0 N--CA 1.456 -0.139 0 CA-C-O 120.905 0.383 . . . . 0.0 110.54 -173.017 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 138' ' ' GLN . . . . . . . . . . . . . 12.7 pt20 -147.97 171.59 15.55 Favored 'General case' 0 N--CA 1.45 -0.474 0 C-N-CA 124.437 1.095 . . . . 0.0 108.431 177.562 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 139' ' ' LYS . . . . . . . . . . . . . 57.7 mttp -72.73 61.37 0.53 Allowed 'General case' 0 CA--C 1.53 0.199 0 C-N-CA 123.238 0.615 . . . . 0.0 112.347 -177.786 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 140' ' ' SER . . . . . . . . . . . . . 39.5 t -73.55 49.91 0.31 Allowed 'General case' 0 CA--C 1.533 0.296 0 C-N-CA 124.449 1.1 . . . . 0.0 109.645 172.704 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 141' ' ' TYR . . . . . . . . . . . . . 35.7 t80 -70.54 46.74 0.09 Allowed 'General case' 0 N--CA 1.449 -0.51 0 C-N-CA 126.171 1.789 . . . . 0.0 113.708 -174.185 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 142' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -67.02 169.87 7.68 Favored 'General case' 0 N--CA 1.453 -0.281 0 N-CA-C 109.126 -0.694 . . . . 0.0 109.126 175.427 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 16.6 p30 -60.03 -15.09 19.85 Favored 'General case' 0 CA--C 1.531 0.241 0 O-C-N 122.056 -0.403 . . . . 0.0 111.5 -177.28 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . -70.83 -51.92 23.65 Favored 'General case' 0 N--CA 1.452 -0.334 0 N-CA-C 109.607 -0.516 . . . . 0.0 109.607 175.885 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 145' ' ' ILE . . . . . . . . . . . . . 40.6 mm -72.55 -30.7 35.03 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.135 0 N-CA-C 109.995 -0.372 . . . . 0.0 109.995 178.574 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 146' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -66.21 -24.85 66.69 Favored 'General case' 0 N--CA 1.454 -0.243 0 N-CA-C 108.226 -1.028 . . . . 0.0 108.226 172.498 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 147' ' ' SER . . . . . . . . . . . . . 12.3 t 55.28 77.05 0.23 Allowed 'General case' 0 N--CA 1.449 -0.483 0 C-N-CA 125.015 1.326 . . . . 0.0 111.612 177.305 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.28 -11.72 7.15 Favored 'General case' 0 CA--C 1.532 0.28 0 CA-C-N 115.28 -0.873 . . . . 0.0 111.082 172.959 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 149' ' ' CYS . . . . . . . . . . . . . 49.1 t -61.38 -33.12 73.13 Favored 'General case' 0 N--CA 1.448 -0.526 0 N-CA-C 109.415 -0.587 . . . . 0.0 109.415 178.081 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 150' ' ' PHE . . . . . 0.614 ' CE2' ' HE3' ' A' ' 121' ' ' LYS . 28.1 t80 -64.47 -30.42 71.46 Favored 'General case' 0 N--CA 1.452 -0.351 0 N-CA-C 110.214 -0.291 . . . . 0.0 110.214 -178.67 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 151' ' ' ALA . . . . . . . . . . . . . . . -76.52 -28.79 56.5 Favored 'General case' 0 N--CA 1.454 -0.23 0 N-CA-C 110.293 -0.262 . . . . 0.0 110.293 177.576 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 152' ' ' MET . . . . . . . . . . . . . 87.9 mtp -77.09 -29.43 54.92 Favored 'General case' 0 CA--C 1.53 0.188 0 N-CA-C 110.721 -0.103 . . . . 0.0 110.721 173.845 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 153' ' ' ASP . . . . . . . . . . . . . 79.2 m-20 -75.68 -44.39 42.54 Favored 'General case' 0 N--CA 1.453 -0.277 0 C-N-CA 123.76 0.824 . . . . 0.0 112.462 -179.239 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 154' ' ' LEU . . . . . . . . . . . . . 50.8 mt -141.74 169.5 17.47 Favored 'General case' 0 C--N 1.339 0.133 0 C-N-CA 123.079 0.552 . . . . 0.0 111.5 -175.888 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 155' ' ' GLU . . . . . . . . . . . . . 39.5 mp0 -66.26 -12.03 53.85 Favored 'General case' 0 N--CA 1.455 -0.198 0 C-N-CA 123.609 0.764 . . . . 0.0 110.567 176.759 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 156' ' ' HIS . . . . . . . . . . . . . 49.2 m80 -72.86 73.41 1.12 Allowed 'General case' 0 N--CA 1.452 -0.331 0 C-N-CA 123.682 0.793 . . . . 0.0 109.045 174.7 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 157' ' ' HIS . . . . . . . . . . . . . 57.7 m170 -65.55 -1.67 2.8 Favored 'General case' 0 N--CA 1.453 -0.296 0 N-CA-C 113.05 0.759 . . . . 0.0 113.05 -178.448 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 158' ' ' HIS . . . . . . . . . . . . . 97.0 m-70 -140.66 167.52 21.97 Favored 'General case' 0 N--CA 1.455 -0.183 0 C-N-CA 123.282 0.633 . . . . 0.0 110.013 -179.525 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 159' ' ' HIS . . . . . . . . . . . . . 44.9 m170 . . . . . 0 C--O 1.249 1.053 0 CA-C-O 117.751 -1.119 . . . . 0.0 110.591 -178.94 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' B' B 2052 ' ' ASP . . . . . . . . . . . . . 14.4 p-10 . . . . . 0 N--CA 1.471 0.585 0 N-CA-C 109.995 -0.372 . . . . 0.0 109.995 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' B' B 2053 ' ' ASP . . . . . . . . . . . . . 47.2 m-20 -77.61 140.99 39.73 Favored 'General case' 0 N--CA 1.452 -0.329 0 CA-C-O 121.093 0.473 . . . . 0.0 112.132 -174.742 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B 2054 ' ' ASP . . . . . . . . . . . . . 41.6 t0 -165.97 -160.2 0.43 Allowed 'General case' 0 CA--C 1.535 0.38 0 C-N-CA 125.397 1.479 . . . . 0.0 107.178 -178.283 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B 2055 ' ' GLU . . . . . . . . . . . . . 61.7 tt0 -43.77 136.15 3.63 Favored 'General case' 0 C--N 1.34 0.163 0 C-N-CA 123.546 0.739 . . . . 0.0 109.68 173.959 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B 2056 ' ' ASP . . . . . . . . . . . . . 55.6 t0 -105.08 -115.41 0.24 Allowed 'General case' 0 CA--C 1.532 0.268 0 C-N-CA 123.153 0.581 . . . . 0.0 111.73 -174.26 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B 2057 ' ' ASP . . . . . . . . . . . . . 33.0 t0 -60.03 98.68 0.06 Allowed 'General case' 0 N--CA 1.454 -0.236 0 C-N-CA 124.03 0.932 . . . . 0.0 112.149 -171.084 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B 2058 ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -75.82 145.77 40.41 Favored 'General case' 0 N--CA 1.453 -0.305 0 C-N-CA 122.92 0.488 . . . . 0.0 109.847 177.688 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B 2059 ' ' THR . . . . . . . . . . . . . 54.0 m -85.72 116.14 64.45 Favored Pre-proline 0 N--CA 1.455 -0.204 0 N-CA-C 109.61 -0.515 . . . . 0.0 109.61 179.006 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B 2060 ' ' PRO . . . . . . . . . . . . . 47.8 Cg_endo -77.73 62.03 7.7 Favored 'Trans proline' 0 N--CA 1.45 -1.038 0 C-N-CA 123.859 3.039 . . . . 0.0 110.201 179.573 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B 2061 ' ' SER . . . . . . . . . . . . . 88.2 p -62.31 143.46 56.9 Favored 'General case' 0 N--CA 1.455 -0.219 0 CA-C-O 121.021 0.438 . . . . 0.0 111.059 -177.865 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B 2062 ' ' ILE . . . . . . . . . . . . . 16.7 tt -164.63 155.93 1.82 Allowed 'Isoleucine or valine' 0 N--CA 1.453 -0.319 0 C-N-CA 123.747 0.819 . . . . 0.0 109.748 -179.378 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B 2063 ' ' SER . . . . . . . . . . . . . 82.5 p . . . . . 0 C--O 1.248 0.988 0 CA-C-O 117.097 -1.43 . . . . 0.0 109.632 174.865 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 63.2 ttp . . . . . 0 N--CA 1.474 0.743 0 N-CA-C 109.969 -0.382 . . . . 0.0 109.969 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 27.2 tp60 -153.7 135.98 14.91 Favored 'General case' 0 N--CA 1.451 -0.379 0 CA-C-O 120.973 0.415 . . . . 0.0 110.539 -179.929 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 35.6 tp60 -164.38 128.26 2.57 Favored 'General case' 0 N--CA 1.455 -0.184 0 N-CA-C 108.056 -1.09 . . . . 0.0 108.056 173.99 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 4' ' ' ASP . . . . . 0.425 ' C ' ' H ' ' A' ' 6' ' ' ASP . 47.7 t0 -162.37 -174.23 3.94 Favored 'General case' 0 N--CA 1.453 -0.309 0 N-CA-C 108.238 -1.023 . . . . 0.0 108.238 -177.798 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 42.3 m-20 -74.38 15.83 0.31 Allowed 'General case' 0 N--CA 1.454 -0.264 0 O-C-N 121.974 -0.454 . . . . 0.0 110.922 171.711 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 6' ' ' ASP . . . . . 0.425 ' H ' ' C ' ' A' ' 4' ' ' ASP . 36.2 p-10 -73.8 -28.06 61.44 Favored 'General case' 0 N--CA 1.453 -0.283 0 N-CA-C 108.788 -0.819 . . . . 0.0 108.788 179.328 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 7' ' ' PHE . . . . . 0.522 ' CE1' ' HD3' ' A' ' 45' ' ' LYS . 1.6 t80 -51.12 -37.31 45.3 Favored 'General case' 0 N--CA 1.448 -0.54 0 C-N-CA 124.375 1.07 . . . . 0.0 110.71 177.36 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 51.1 tp60 -53.64 -34.64 59.26 Favored 'General case' 0 N--CA 1.454 -0.268 0 C-N-CA 123.281 0.632 . . . . 0.0 111.579 -178.515 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 32.0 m-80 -72.49 -31.46 65.39 Favored 'General case' 0 N--CA 1.448 -0.528 0 N-CA-C 109.992 -0.373 . . . . 0.0 109.992 -179.587 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 10' ' ' PHE . . . . . 0.452 ' CE2' ' HB2' ' A' ' 32' ' ' LEU . 13.0 t80 -69.44 -40.94 76.89 Favored 'General case' 0 N--CA 1.449 -0.519 0 N-CA-C 108.986 -0.746 . . . . 0.0 108.986 175.412 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 62.6 t -64.35 -53.62 40.86 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.23 0 N-CA-C 108.657 -0.868 . . . . 0.0 108.657 179.467 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -59.84 -26.88 66.17 Favored 'General case' 0 N--CA 1.453 -0.279 0 C-N-CA 122.597 0.359 . . . . 0.0 111.808 179.534 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 91.2 m -74.25 -39.46 63.02 Favored 'General case' 0 CA--C 1.529 0.166 0 N-CA-C 109.077 -0.712 . . . . 0.0 109.077 176.703 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.495 ' HA ' ' CD1' ' A' ' 17' ' ' PHE . 10.9 tp -64.42 -45.31 88.09 Favored 'General case' 0 N--CA 1.452 -0.367 0 CA-C-O 121.374 0.607 . . . . 0.0 109.371 177.402 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 68.6 mm-40 -63.85 -28.28 69.74 Favored 'General case' 0 N--CA 1.453 -0.312 0 C-N-CA 124.069 0.948 . . . . 0.0 110.005 178.393 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 74.5 m -70.62 -28.19 64.66 Favored 'General case' 0 N--CA 1.453 -0.325 0 N-CA-C 109.616 -0.513 . . . . 0.0 109.616 177.281 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 17' ' ' PHE . . . . . 0.515 ' CE1' HD11 ' A' ' 68' ' ' ILE . 16.6 m-85 -69.74 -40.94 75.87 Favored 'General case' 0 N--CA 1.454 -0.243 0 C-N-CA 119.648 -0.821 . . . . 0.0 110.267 171.554 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 81.0 mttt -61.96 -28.51 69.6 Favored 'General case' 0 C--N 1.34 0.18 0 CA-C-O 120.617 0.246 . . . . 0.0 110.691 -178.575 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 46.3 t0 -71.42 -27.12 63.07 Favored 'General case' 0 CA--C 1.532 0.281 0 CA-C-N 115.826 -0.625 . . . . 0.0 112.192 -179.407 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 97.4 mt -74.02 152.92 39.89 Favored 'General case' 0 N--CA 1.455 -0.176 0 O-C-N 122.055 -0.403 . . . . 0.0 110.78 -177.563 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 21' ' ' LYS . . . . . 0.47 ' HE3' ' CA ' ' A' ' 21' ' ' LYS . 0.0 OUTLIER -77.13 -30.89 55.35 Favored 'General case' 0 C--N 1.339 0.135 0 N-CA-C 110.261 -0.274 . . . . 0.0 110.261 176.3 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 99.0 p -88.33 -22.47 23.82 Favored 'General case' 0 N--CA 1.457 -0.114 0 C-N-CA 122.983 0.513 . . . . 0.0 110.931 179.568 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 73.08 -22.04 0.98 Allowed Glycine 0 CA--C 1.527 0.801 0 C-N-CA 123.532 0.586 . . . . 0.0 112.752 178.919 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 24' ' ' ILE . . . . . 0.409 HD11 HD12 ' A' ' 63' ' ' LEU . 53.5 mt -78.93 149.38 5.57 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.212 0 N-CA-C 108.775 -0.824 . . . . 0.0 108.775 172.137 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 47.7 t -157.61 83.0 0.89 Allowed 'General case' 0 CA--C 1.517 -0.311 0 N-CA-C 110.146 -0.316 . . . . 0.0 110.146 177.355 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 26' ' ' GLY . . . . . 0.505 ' O ' ' HE2' ' A' ' 30' ' ' LYS . . . -48.58 -33.85 13.03 Favored Glycine 0 CA--C 1.526 0.741 0 N-CA-C 110.826 -0.91 . . . . 0.0 110.826 -178.89 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 4.7 t -67.76 -61.59 1.81 Allowed 'General case' 0 N--CA 1.452 -0.347 0 CA-C-N 117.407 0.604 . . . . 0.0 111.331 -178.084 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -72.68 -25.85 61.4 Favored 'General case' 0 N--CA 1.454 -0.256 0 CA-C-O 119.424 -0.322 . . . . 0.0 110.749 -175.615 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 56.7 mt -61.12 -46.51 96.49 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.332 0 N-CA-C 108.292 -1.003 . . . . 0.0 108.292 173.713 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 30' ' ' LYS . . . . . 0.505 ' HE2' ' O ' ' A' ' 26' ' ' GLY . 51.2 mtmt -64.74 -31.16 72.26 Favored 'General case' 0 C--N 1.34 0.154 0 CA-C-N 118.155 0.434 . . . . 0.0 111.258 178.268 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 31' ' ' LYS . . . . . 0.486 ' HE2' ' HA ' ' A' ' 31' ' ' LYS . 6.2 mmpt? -63.85 -59.93 3.92 Favored 'General case' 0 C--N 1.338 0.098 0 CA-C-O 119.215 -0.421 . . . . 0.0 111.61 -178.811 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.458 HD12 ' N ' ' A' ' 33' ' ' THR . 1.2 pp -75.51 -16.71 60.26 Favored 'General case' 0 CA--C 1.534 0.343 0 C-N-CA 119.539 -0.865 . . . . 0.0 111.942 -178.182 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 33' ' ' THR . . . . . 0.458 ' N ' HD12 ' A' ' 32' ' ' LEU . 43.5 m -72.47 -38.36 68.23 Favored 'General case' 0 C--N 1.341 0.216 0 N-CA-C 108.656 -0.868 . . . . 0.0 108.656 174.58 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 80.4 m -70.03 -36.5 75.1 Favored 'General case' 0 N--CA 1.452 -0.371 0 N-CA-C 110.168 -0.308 . . . . 0.0 110.168 179.575 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 31.5 t80 -64.8 -36.11 83.26 Favored 'General case' 0 N--CA 1.456 -0.154 0 N-CA-C 109.791 -0.448 . . . . 0.0 109.791 176.045 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -71.36 -35.46 71.12 Favored 'General case' 0 N--CA 1.45 -0.451 0 CA-C-O 119.648 -0.215 . . . . 0.0 111.422 179.253 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 2.3 mm? -69.56 -32.37 71.12 Favored 'General case' 0 N--CA 1.455 -0.182 0 CA-C-O 119.74 -0.172 . . . . 0.0 110.578 179.858 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 40.2 t0 -69.44 -22.87 63.62 Favored 'General case' 0 N--CA 1.454 -0.246 0 O-C-N 122.9 0.125 . . . . 0.0 110.745 176.283 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 77.8 m80 -150.65 101.8 2.96 Favored 'General case' 0 N--CA 1.453 -0.305 0 N-CA-C 112.583 0.586 . . . . 0.0 112.583 -174.931 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 40' ' ' ILE . . . . . 0.606 ' H ' HD13 ' A' ' 40' ' ' ILE . 0.0 OUTLIER -74.56 -9.54 12.96 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.247 0 N-CA-C 109.701 -0.481 . . . . 0.0 109.701 170.865 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 34.0 m-20 -56.72 -17.64 9.69 Favored 'General case' 0 N--CA 1.457 -0.08 0 C-N-CA 124.3 1.04 . . . . 0.0 112.541 -178.92 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -120.08 17.96 6.37 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.267 0 C-N-CA 123.825 0.85 . . . . 0.0 111.461 -178.435 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 2.9 pp20? -52.64 -32.88 44.18 Favored 'General case' 0 CA--C 1.532 0.254 0 O-C-N 121.823 -0.548 . . . . 0.0 111.103 178.159 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 40.3 t -61.16 -46.66 89.6 Favored 'General case' 0 CA--C 1.531 0.242 0 N-CA-C 112.318 0.488 . . . . 0.0 112.318 -178.958 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 45' ' ' LYS . . . . . 0.522 ' HD3' ' CE1' ' A' ' 7' ' ' PHE . 19.1 ptpt -73.84 -24.13 59.73 Favored 'General case' 0 C--N 1.343 0.299 0 O-C-N 121.577 -0.702 . . . . 0.0 110.153 179.897 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 64.1 mt -71.65 -48.98 49.22 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.278 0 N-CA-C 109.733 -0.469 . . . . 0.0 109.733 -179.676 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 47' ' ' ILE . . . . . 0.455 HD13 HD11 ' A' ' 50' ' ' ILE . 39.4 mm -63.76 -35.93 74.8 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.237 0 N-CA-C 109.626 -0.509 . . . . 0.0 109.626 178.28 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 40.3 t -63.78 -43.48 96.24 Favored 'General case' 0 N--CA 1.455 -0.18 0 O-C-N 122.263 -0.273 . . . . 0.0 111.626 -178.985 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 33.3 mt -75.43 -33.22 60.89 Favored 'General case' 0 N--CA 1.449 -0.498 0 N-CA-C 113.23 0.826 . . . . 0.0 113.23 -176.286 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 50' ' ' ILE . . . . . 0.455 HD11 HD13 ' A' ' 47' ' ' ILE . 5.1 pt -72.65 -43.97 61.03 Favored 'Isoleucine or valine' 0 C--O 1.23 0.075 0 CA-C-N 119.284 0.947 . . . . 0.0 110.787 179.702 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 21.3 pt -62.21 -40.29 87.13 Favored 'Isoleucine or valine' 0 C--N 1.339 0.145 0 C-N-CA 119.628 -0.829 . . . . 0.0 109.962 178.366 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 94.0 m-20 -70.8 -33.62 70.91 Favored 'General case' 0 N--CA 1.455 -0.18 0 CA-C-N 118.061 0.392 . . . . 0.0 111.78 177.787 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 53' ' ' TYR . . . . . 0.455 ' CD2' ' HB2' ' A' ' 65' ' ' SER . 20.8 t80 -67.67 -34.26 76.57 Favored 'General case' 0 N--CA 1.454 -0.248 0 CA-C-N 118.535 0.607 . . . . 0.0 109.667 177.017 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 35.6 t -81.76 -18.26 44.84 Favored 'General case' 0 C--N 1.338 0.075 0 N-CA-C 111.882 0.327 . . . . 0.0 111.882 178.011 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 32.0 ttp180 -93.89 -42.86 8.86 Favored 'General case' 0 N--CA 1.453 -0.314 0 N-CA-C 112.797 0.666 . . . . 0.0 112.797 -178.19 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 41.8 mt -86.3 -49.37 7.72 Favored 'General case' 0 C--N 1.338 0.093 0 N-CA-C 113.407 0.892 . . . . 0.0 113.407 -175.222 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 57' ' ' CYS . . . . . 0.41 ' HB3' ' CD ' ' A' ' 58' ' ' PRO . 84.2 m -72.34 166.72 39.01 Favored Pre-proline 0 CA--C 1.533 0.326 0 N-CA-C 113.248 0.832 . . . . 0.0 113.248 -170.996 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 58' ' ' PRO . . . . . 0.41 ' CD ' ' HB3' ' A' ' 57' ' ' CYS . 35.6 Cg_exo -61.38 166.46 11.22 Favored 'Trans proline' 0 N--CA 1.453 -0.909 1 C-N-CA 125.816 4.344 . . . . 0.0 113.404 -175.178 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 31.8 p-10 -53.86 -44.66 70.56 Favored 'General case' 0 C--N 1.329 -0.314 0 C-N-CA 125.146 1.378 . . . . 0.0 113.618 -171.328 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 9.3 t -71.73 -29.13 64.19 Favored 'General case' 0 N--CA 1.452 -0.354 0 O-C-N 122.049 -0.407 . . . . 0.0 110.151 -179.623 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 52.8 m80 -75.82 -29.47 58.68 Favored 'General case' 0 N--CA 1.452 -0.361 0 C-N-CA 122.692 0.397 . . . . 0.0 109.965 176.104 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 59.1 mttm -61.93 -41.81 98.38 Favored 'General case' 0 C--N 1.341 0.197 0 N-CA-C 109.559 -0.534 . . . . 0.0 109.559 173.164 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 63' ' ' LEU . . . . . 0.466 HD23 HG13 ' A' ' 124' ' ' ILE . 3.0 tm? -63.03 -45.5 92.0 Favored 'General case' 0 N--CA 1.455 -0.222 0 N-CA-C 109.024 -0.732 . . . . 0.0 109.024 177.227 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -61.53 -27.17 67.55 Favored Glycine 0 C--N 1.339 0.729 0 N-CA-C 112.108 -0.397 . . . . 0.0 112.108 -178.95 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 65' ' ' SER . . . . . 0.455 ' HB2' ' CD2' ' A' ' 53' ' ' TYR . 30.1 t -74.66 -39.02 62.29 Favored 'General case' 0 N--CA 1.451 -0.397 0 CA-C-N 117.694 0.747 . . . . 0.0 110.561 176.795 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 82.9 mt -66.21 -23.49 66.44 Favored 'General case' 0 N--CA 1.452 -0.365 0 N-CA-C 109.721 -0.474 . . . . 0.0 109.721 177.546 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 2.3 m-30 -73.69 -39.33 64.44 Favored 'General case' 0 C--O 1.233 0.226 0 C-N-CA 122.397 0.279 . . . . 0.0 110.428 173.926 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 68' ' ' ILE . . . . . 0.515 HD11 ' CE1' ' A' ' 17' ' ' PHE . 31.5 mt -64.88 -51.19 70.0 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.543 0 N-CA-C 107.51 -1.293 . . . . 0.0 107.51 177.055 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 69' ' ' ILE . . . . . 0.451 HG12 HD12 ' A' ' 50' ' ' ILE . 43.5 mt -50.26 -36.84 13.45 Favored 'Isoleucine or valine' 0 CA--C 1.528 0.133 0 C-N-CA 124.21 1.004 . . . . 0.0 111.778 174.828 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 16.6 t70 -69.87 -53.86 16.1 Favored 'General case' 0 N--CA 1.455 -0.193 0 CA-C-N 118.774 0.715 . . . . 0.0 111.116 180.0 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 79.2 p -67.89 -46.72 70.83 Favored 'General case' 0 N--CA 1.451 -0.42 0 CA-C-N 116.717 -0.22 . . . . 0.0 110.772 -174.96 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -74.84 -35.03 35.1 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.133 0 N-CA-C 109.359 -0.608 . . . . 0.0 109.359 -179.172 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -65.82 -50.76 51.41 Favored Glycine 0 C--N 1.339 0.724 0 N-CA-C 111.58 -0.608 . . . . 0.0 111.58 -175.836 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 41.7 mtm105 -69.73 -38.56 76.91 Favored 'General case' 0 N--CA 1.451 -0.4 0 CA-C-N 117.267 0.533 . . . . 0.0 110.227 179.061 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -66.57 -32.68 74.17 Favored 'General case' 0 N--CA 1.451 -0.391 0 C-N-CA 120.714 -0.395 . . . . 0.0 110.743 -179.101 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 1.0 OUTLIER -68.72 -43.52 75.79 Favored 'General case' 0 CA--C 1.518 -0.28 0 CA-C-N 118.527 0.603 . . . . 0.0 110.297 176.091 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 77' ' ' LEU . . . . . 0.427 ' C ' HD13 ' A' ' 77' ' ' LEU . 3.0 tm? -64.89 -47.72 76.81 Favored 'General case' 0 N--CA 1.448 -0.534 0 C-N-CA 118.359 -1.336 . . . . 0.0 108.049 178.978 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 46.9 m-20 -58.25 -43.65 87.95 Favored 'General case' 0 C--O 1.23 0.065 0 N-CA-C 112.38 0.511 . . . . 0.0 112.38 -178.063 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 10.4 tm-20 -63.96 -45.06 90.78 Favored 'General case' 0 N--CA 1.447 -0.583 0 CA-C-N 118.186 0.448 . . . . 0.0 110.623 -177.81 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 61.2 p -69.8 -37.62 76.37 Favored 'General case' 0 N--CA 1.453 -0.321 0 CA-C-O 118.927 -0.559 . . . . 0.0 111.1 -177.136 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 7.4 ppt_? -75.85 -16.55 60.05 Favored 'General case' 0 C--N 1.341 0.211 0 CA-C-N 118.823 0.738 . . . . 0.0 111.627 178.05 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 36.9 m -90.72 -36.63 14.21 Favored 'General case' 0 N--CA 1.456 -0.145 0 N-CA-C 112.353 0.501 . . . . 0.0 112.353 179.132 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 66.9 m-20 -119.86 26.14 9.51 Favored 'General case' 0 CA--C 1.52 -0.19 0 N-CA-C 112.954 0.724 . . . . 0.0 112.954 -174.985 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 26.0 t 58.33 15.51 3.48 Favored 'General case' 0 N--CA 1.447 -0.576 0 N-CA-C 114.314 1.227 . . . . 0.0 114.314 173.722 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 80.5 m-20 -76.45 14.11 0.83 Allowed 'General case' 0 CA--C 1.532 0.278 0 CA-C-N 118.413 0.551 . . . . 0.0 111.135 177.887 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 79.2 p -71.7 162.1 29.97 Favored 'General case' 0 N--CA 1.453 -0.32 0 C-N-CA 123.431 0.692 . . . . 0.0 110.822 178.38 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 47.1 t -156.61 -178.96 7.73 Favored 'General case' 0 N--CA 1.452 -0.367 0 C-N-CA 123.145 0.578 . . . . 0.0 109.465 -179.349 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 96.9 p -138.78 8.68 2.58 Favored 'General case' 0 N--CA 1.455 -0.222 0 C-N-CA 123.264 0.625 . . . . 0.0 109.945 175.691 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 9.2 t-20 -161.2 159.2 28.53 Favored 'General case' 0 CA--C 1.531 0.238 0 C-N-CA 122.767 0.427 . . . . 0.0 110.269 -178.525 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 60.0 mttp 63.12 150.51 0.11 Allowed Pre-proline 0 CA--C 1.534 0.353 0 C-N-CA 126.028 1.731 . . . . 0.0 114.182 178.834 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_endo -69.09 170.03 16.71 Favored 'Trans proline' 0 N--CA 1.453 -0.875 0 C-N-CA 124.425 3.417 . . . . 0.0 110.384 175.71 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 96.04 17.29 35.41 Favored Glycine 0 CA--C 1.523 0.586 0 CA-C-O 119.363 -0.687 . . . . 0.0 112.908 177.071 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 35.2 p -151.77 169.24 22.7 Favored 'General case' 0 CA--C 1.518 -0.266 0 C-N-CA 123.907 0.883 . . . . 0.0 109.227 175.974 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 94' ' ' CYS . . . . . 0.432 ' HA ' ' HB3' ' A' ' 97' ' ' ALA . 1.8 p -67.16 -16.95 64.63 Favored 'General case' 0 N--CA 1.447 -0.612 0 N-CA-C 109.692 -0.485 . . . . 0.0 109.692 178.599 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -62.91 -57.24 11.46 Favored 'General case' 0 N--CA 1.449 -0.5 0 N-CA-C 109.833 -0.432 . . . . 0.0 109.833 -177.104 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 72.9 t60 -72.39 -31.25 65.4 Favored 'General case' 0 N--CA 1.451 -0.408 0 N-CA-C 110.208 -0.293 . . . . 0.0 110.208 179.243 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 97' ' ' ALA . . . . . 0.432 ' HB3' ' HA ' ' A' ' 94' ' ' CYS . . . -65.67 -56.56 11.5 Favored 'General case' 0 N--CA 1.451 -0.417 0 O-C-N 123.274 0.359 . . . . 0.0 111.517 -178.32 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 2.1 mp -67.72 -34.62 68.95 Favored 'Isoleucine or valine' 0 C--N 1.34 0.195 0 C-N-CA 120.494 -0.483 . . . . 0.0 110.456 -179.13 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 69.2 m-20 -66.71 -45.1 79.82 Favored 'General case' 0 N--CA 1.45 -0.448 0 CA-C-N 118.157 0.435 . . . . 0.0 111.509 179.534 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 98.3 m -69.12 -29.62 67.72 Favored 'General case' 0 C--N 1.338 0.088 0 CA-C-N 117.976 0.353 . . . . 0.0 110.455 -177.227 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 62.2 tp -74.11 -33.98 63.77 Favored 'General case' 0 N--CA 1.447 -0.607 0 C-N-CA 122.758 0.423 . . . . 0.0 110.431 179.558 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -67.59 -17.4 68.86 Favored Glycine 0 CA--C 1.526 0.774 0 CA-C-O 119.636 -0.536 . . . . 0.0 112.845 -177.232 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 25.5 mt-10 -79.5 -25.93 41.7 Favored 'General case' 0 C--N 1.338 0.096 0 CA-C-N 118.004 0.902 . . . . 0.0 111.316 -179.696 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 25.3 m -116.92 -6.67 11.91 Favored 'Isoleucine or valine' 0 C--O 1.23 0.061 0 N-CA-C 112.924 0.713 . . . . 0.0 112.924 -174.687 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 105' ' ' ILE . . . . . . . . . . . . . 17.5 tt -60.09 -23.07 26.17 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.25 0 CA-C-N 118.979 0.809 . . . . 0.0 111.635 -179.694 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 106' ' ' GLN . . . . . 0.4 ' HA ' HD11 ' A' ' 145' ' ' ILE . 25.7 pt20 -61.6 -35.0 76.62 Favored 'General case' 0 N--CA 1.45 -0.447 0 C-N-CA 122.867 0.467 . . . . 0.0 110.19 175.906 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 49.2 mt-10 -71.95 -40.88 68.39 Favored 'General case' 0 N--CA 1.454 -0.232 0 N-CA-C 109.454 -0.573 . . . . 0.0 109.454 -179.828 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 20.2 mt -73.0 -40.87 64.84 Favored 'General case' 0 N--CA 1.449 -0.512 0 CA-C-N 115.899 -0.592 . . . . 0.0 110.706 -173.283 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 84.7 mt -68.56 -63.17 1.11 Allowed 'General case' 0 N--CA 1.448 -0.539 0 N-CA-C 109.626 -0.509 . . . . 0.0 109.626 178.517 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 24.4 p -46.0 -48.37 16.63 Favored 'General case' 0 CA--C 1.52 -0.183 0 C-N-CA 122.613 0.365 . . . . 0.0 111.976 -177.329 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 39.3 t0 -70.66 -35.99 73.14 Favored 'General case' 0 N--CA 1.447 -0.579 0 CA-C-N 116.882 -0.144 . . . . 0.0 110.977 -176.148 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -72.88 -31.54 64.77 Favored 'General case' 0 N--CA 1.448 -0.528 0 C-N-CA 120.882 -0.327 . . . . 0.0 110.735 -178.487 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 113' ' ' ILE . . . . . . . . . . . . . 45.4 mm -68.33 -40.86 83.12 Favored 'Isoleucine or valine' 0 C--N 1.339 0.111 0 N-CA-C 108.892 -0.781 . . . . 0.0 108.892 176.316 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -72.78 -38.3 67.33 Favored 'General case' 0 N--CA 1.45 -0.441 0 CA-C-N 115.697 -0.683 . . . . 0.0 111.926 -177.562 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -90.46 -33.53 15.95 Favored 'General case' 0 N--CA 1.453 -0.283 0 N-CA-C 113.844 1.053 . . . . 0.0 113.844 -174.968 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 116' ' ' SER . . . . . 0.525 ' O ' ' HE3' ' A' ' 121' ' ' LYS . 1.0 OUTLIER -89.4 160.47 16.8 Favored 'General case' 0 C--N 1.339 0.111 0 N-CA-C 113.45 0.907 . . . . 0.0 113.45 -167.886 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 46.4 t30 -75.51 169.69 17.6 Favored 'General case' 0 C--O 1.226 -0.164 0 C-N-CA 123.983 0.913 . . . . 0.0 111.872 -173.941 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 118' ' ' GLN . . . . . . . . . . . . . 14.8 mm100 -54.37 -37.23 64.74 Favored 'General case' 0 C--N 1.338 0.094 0 C-N-CA 124.03 0.932 . . . . 0.0 112.954 -173.456 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 16.7 p-10 -69.28 -43.3 74.16 Favored 'General case' 0 N--CA 1.453 -0.301 0 N-CA-C 109.393 -0.595 . . . . 0.0 109.393 179.401 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 78.8 m-70 -69.22 -36.12 76.9 Favored 'General case' 0 N--CA 1.45 -0.444 0 CA-C-O 119.311 -0.376 . . . . 0.0 110.939 177.949 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 121' ' ' LYS . . . . . 0.525 ' HE3' ' O ' ' A' ' 116' ' ' SER . 89.8 mttt -58.49 -40.91 84.08 Favored 'General case' 0 C--O 1.231 0.129 0 N-CA-C 108.793 -0.817 . . . . 0.0 108.793 176.063 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 38.3 tp10 -73.99 -35.13 64.41 Favored 'General case' 0 N--CA 1.451 -0.378 0 C-N-CA 122.32 0.248 . . . . 0.0 110.93 179.849 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 84.9 mttt -63.95 -37.65 88.2 Favored 'General case' 0 N--CA 1.453 -0.296 0 N-CA-C 109.546 -0.538 . . . . 0.0 109.546 177.572 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 124' ' ' ILE . . . . . 0.466 HG13 HD23 ' A' ' 63' ' ' LEU . 56.4 mt -66.05 -38.92 83.11 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.182 0 N-CA-C 110.032 -0.359 . . . . 0.0 110.032 174.737 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 17.5 mtp180 -66.43 -42.31 87.91 Favored 'General case' 0 C--N 1.34 0.158 0 C-N-CA 122.404 0.282 . . . . 0.0 111.398 -177.356 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 126' ' ' MET . . . . . . . . . . . . . 17.8 ptp -68.42 -31.55 70.96 Favored 'General case' 0 N--CA 1.452 -0.325 0 C-N-CA 119.613 -0.835 . . . . 0.0 109.424 176.482 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 2.2 mp -63.25 -35.39 80.18 Favored 'General case' 0 N--CA 1.454 -0.267 0 N-CA-C 109.695 -0.483 . . . . 0.0 109.695 177.245 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 99.2 mt -68.34 -38.15 81.22 Favored 'General case' 0 N--CA 1.454 -0.256 0 CA-C-N 118.471 0.578 . . . . 0.0 110.049 177.687 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 14.9 t0 -65.49 -45.63 82.84 Favored 'General case' 0 CA--C 1.531 0.212 0 CA-C-N 118.055 0.389 . . . . 0.0 110.052 175.567 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 130' ' ' ILE . . . . . 0.406 ' HA ' ' HD3' ' A' ' 133' ' ' ARG . 51.5 mt -61.11 -34.11 58.86 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.296 0 C-N-CA 123.031 0.532 . . . . 0.0 110.202 -178.721 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 131' ' ' TRP . . . . . . . . . . . . . 50.5 m0 -79.45 -25.8 41.89 Favored 'General case' 0 N--CA 1.452 -0.371 0 N-CA-C 112.928 0.714 . . . . 0.0 112.928 179.271 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 76.8 m-20 -76.81 -27.82 55.33 Favored 'General case' 0 CA--C 1.526 0.048 0 CA-C-N 118.882 0.764 . . . . 0.0 111.329 175.113 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 133' ' ' ARG . . . . . 0.451 HH21 ' C ' ' B' 2063 ' ' SER . 14.7 mtp180 -73.69 -42.99 60.53 Favored 'General case' 0 N--CA 1.455 -0.191 0 C-N-CA 122.798 0.439 . . . . 0.0 110.069 176.952 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 31.6 p -79.86 -14.88 58.33 Favored 'General case' 0 CA--C 1.531 0.25 0 C-N-CA 123.239 0.615 . . . . 0.0 111.033 176.844 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 135' ' ' GLY . . . . . . . . . . . . . . . 76.64 -68.64 2.45 Favored Glycine 0 CA--C 1.526 0.761 0 C-N-CA 124.036 0.827 . . . . 0.0 113.047 174.709 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 136' ' ' LEU . . . . . . . . . . . . . 10.7 mp 56.56 8.66 0.47 Allowed 'General case' 0 CA--C 1.536 0.407 0 C-N-CA 124.914 1.286 . . . . 0.0 113.164 -175.092 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 137' ' ' PHE . . . . . . . . . . . . . 66.4 m-85 53.91 16.99 1.2 Allowed 'General case' 0 CA--C 1.533 0.294 0 N-CA-C 114.622 1.342 . . . . 0.0 114.622 175.887 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 138' ' ' GLN . . . . . . . . . . . . . 39.1 mm-40 -140.89 145.54 36.27 Favored 'General case' 0 N--CA 1.457 -0.091 0 C-N-CA 122.972 0.509 . . . . 0.0 109.7 177.624 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 139' ' ' LYS . . . . . 0.428 ' HA ' ' HD3' ' A' ' 139' ' ' LYS . 53.2 mmtt -145.96 162.16 38.45 Favored 'General case' 0 C--N 1.339 0.131 0 C-N-CA 123.558 0.743 . . . . 0.0 110.118 -178.133 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 140' ' ' SER . . . . . . . . . . . . . 47.1 t -150.66 34.56 0.62 Allowed 'General case' 0 N--CA 1.452 -0.339 0 CA-C-N 116.373 -0.376 . . . . 0.0 111.797 -174.971 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 141' ' ' TYR . . . . . . . . . . . . . 43.5 m-85 -71.61 44.73 0.1 Allowed 'General case' 0 CA--C 1.534 0.354 0 C-N-CA 123.345 0.658 . . . . 0.0 111.818 177.528 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 142' ' ' LEU . . . . . . . . . . . . . 75.7 mt -70.56 161.85 29.92 Favored 'General case' 0 N--CA 1.455 -0.22 0 C-N-CA 123.367 0.667 . . . . 0.0 109.764 176.796 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 72.3 m-20 -60.15 -20.89 60.57 Favored 'General case' 0 N--CA 1.455 -0.209 0 N-CA-C 112.137 0.421 . . . . 0.0 112.137 -176.976 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . -64.71 -34.62 78.74 Favored 'General case' 0 N--CA 1.451 -0.391 0 CA-C-N 117.724 0.238 . . . . 0.0 110.411 178.461 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 145' ' ' ILE . . . . . 0.4 HD11 ' HA ' ' A' ' 106' ' ' GLN . 23.4 mm -78.31 -32.78 17.03 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.159 0 CA-C-O 120.558 0.218 . . . . 0.0 110.622 177.114 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 146' ' ' ARG . . . . . 0.452 ' O ' ' HE2' ' A' ' 148' ' ' LYS . 85.6 mtt180 -75.63 -17.68 59.93 Favored 'General case' 0 CA--C 1.518 -0.282 0 CA-C-O 118.772 -0.632 . . . . 0.0 112.298 -176.671 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 147' ' ' SER . . . . . . . . . . . . . 39.0 t -70.64 61.76 0.25 Allowed 'General case' 0 N--CA 1.454 -0.228 0 CA-C-O 122.149 0.976 . . . . 0.0 111.249 177.264 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 148' ' ' LYS . . . . . 0.452 ' HE2' ' O ' ' A' ' 146' ' ' ARG . 0.0 OUTLIER -46.6 -15.8 0.03 OUTLIER 'General case' 0 CA--C 1.53 0.194 0 C-N-CA 126.067 1.747 . . . . 0.0 113.695 172.905 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 149' ' ' CYS . . . . . . . . . . . . . 61.0 m -58.93 -29.65 67.25 Favored 'General case' 0 N--CA 1.452 -0.326 0 CA-C-N 118.039 0.381 . . . . 0.0 111.403 -175.654 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 150' ' ' PHE . . . . . . . . . . . . . 9.7 m-85 -63.16 -30.96 72.0 Favored 'General case' 0 N--CA 1.455 -0.187 0 CA-C-N 118.215 0.461 . . . . 0.0 110.301 -179.506 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 151' ' ' ALA . . . . . . . . . . . . . . . -79.36 -42.51 25.45 Favored 'General case' 0 N--CA 1.448 -0.566 0 C-N-CA 122.429 0.292 . . . . 0.0 110.322 178.244 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 152' ' ' MET . . . . . . . . . . . . . 93.7 mtp -64.35 -29.94 71.0 Favored 'General case' 0 N--CA 1.456 -0.143 0 C-N-CA 122.993 0.517 . . . . 0.0 111.249 -176.71 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 153' ' ' ASP . . . . . . . . . . . . . 69.1 m-20 -75.71 -14.33 60.33 Favored 'General case' 0 N--CA 1.452 -0.353 0 C-N-CA 123.283 0.633 . . . . 0.0 111.765 176.653 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 154' ' ' LEU . . . . . . . . . . . . . 89.5 mt -130.94 40.34 3.49 Favored 'General case' 0 N--CA 1.455 -0.184 0 C-N-CA 123.648 0.779 . . . . 0.0 112.107 -172.57 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 155' ' ' GLU . . . . . . . . . . . . . 19.7 pt-20 -154.28 150.2 27.75 Favored 'General case' 0 N--CA 1.454 -0.227 0 CA-C-O 121.105 0.478 . . . . 0.0 111.611 177.405 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 156' ' ' HIS . . . . . . . . . . . . . 31.3 m80 -79.22 -14.45 59.06 Favored 'General case' 0 C--N 1.34 0.181 0 CA-C-N 115.882 -0.599 . . . . 0.0 111.835 -179.239 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 157' ' ' HIS . . . . . . . . . . . . . 86.0 t60 -156.54 142.16 17.71 Favored 'General case' 0 N--CA 1.455 -0.175 0 N-CA-C 109.66 -0.496 . . . . 0.0 109.66 179.587 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 158' ' ' HIS . . . . . . . . . . . . . 48.5 m170 -81.63 151.93 27.39 Favored 'General case' 0 CA--C 1.529 0.161 0 C-N-CA 122.667 0.387 . . . . 0.0 111.279 -176.59 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 159' ' ' HIS . . . . . . . . . . . . . 79.3 t60 . . . . . 0 C--O 1.251 1.167 0 CA-C-O 117.592 -1.194 . . . . 0.0 109.809 -177.463 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' B' B 2052 ' ' ASP . . . . . . . . . . . . . 2.4 m-20 . . . . . 0 N--CA 1.474 0.767 0 N-CA-C 110.144 -0.317 . . . . 0.0 110.144 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' B' B 2053 ' ' ASP . . . . . . . . . . . . . 5.2 m-20 -68.02 122.15 17.61 Favored 'General case' 0 N--CA 1.455 -0.223 0 CA-C-N 116.479 -0.328 . . . . 0.0 110.35 -176.95 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B 2054 ' ' ASP . . . . . . . . . . . . . 44.9 t0 -167.75 174.44 7.62 Favored 'General case' 0 CA--C 1.531 0.217 0 N-CA-C 108.719 -0.845 . . . . 0.0 108.719 -177.724 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B 2055 ' ' GLU . . . . . . . . . . . . . 54.1 mt-10 -70.5 -11.2 60.77 Favored 'General case' 0 CA--C 1.533 0.314 0 N-CA-C 109.459 -0.571 . . . . 0.0 109.459 173.408 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B 2056 ' ' ASP . . . . . . . . . . . . . 45.5 t0 50.6 -111.17 0.51 Allowed 'General case' 0 N--CA 1.455 -0.195 0 C-N-CA 125.488 1.515 . . . . 0.0 112.48 177.68 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B 2057 ' ' ASP . . . . . . . . . . . . . 22.2 t0 -63.18 170.43 2.89 Favored 'General case' 0 CA--C 1.534 0.348 0 C-N-CA 123.631 0.772 . . . . 0.0 112.756 -173.642 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B 2058 ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -143.47 153.6 42.8 Favored 'General case' 0 N--CA 1.456 -0.133 0 C-N-CA 124.342 1.057 . . . . 0.0 108.77 -178.969 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B 2059 ' ' THR . . . . . . . . . . . . . 38.7 m -137.9 119.6 10.72 Favored Pre-proline 0 N--CA 1.451 -0.415 0 N-CA-C 108.624 -0.88 . . . . 0.0 108.624 -179.115 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B 2060 ' ' PRO . . . . . . . . . . . . . 86.0 Cg_endo -75.06 169.19 23.13 Favored 'Trans proline' 0 N--CA 1.447 -1.253 0 C-N-CA 123.766 2.977 . . . . 0.0 111.131 -179.946 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B 2061 ' ' SER . . . . . . . . . . . . . 59.5 m -151.62 138.67 19.13 Favored 'General case' 0 N--CA 1.454 -0.258 0 N-CA-C 108.461 -0.94 . . . . 0.0 108.461 175.828 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B 2062 ' ' ILE . . . . . . . . . . . . . 16.7 tt -164.23 155.14 2.12 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.222 0 CA-C-N 116.642 -0.254 . . . . 0.0 110.424 -176.309 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B 2063 ' ' SER . . . . . 0.451 ' C ' HH21 ' A' ' 133' ' ' ARG . 81.3 p . . . . . 0 C--O 1.253 1.246 0 CA-C-O 117.488 -1.244 . . . . 0.0 109.65 174.17 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 70.4 mtm . . . . . 0 N--CA 1.472 0.643 0 N-CA-C 110.223 -0.288 . . . . 0.0 110.223 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -138.64 -167.46 2.2 Favored 'General case' 0 N--CA 1.456 -0.136 0 N-CA-C 109.166 -0.679 . . . . 0.0 109.166 179.872 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 3' ' ' GLN . . . . . 0.449 ' H ' ' CD ' ' A' ' 3' ' ' GLN . 4.1 pm0 -59.32 -20.2 52.61 Favored 'General case' 0 CA--C 1.536 0.421 0 N-CA-C 110.106 -0.331 . . . . 0.0 110.106 174.384 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 21.3 p30 -155.52 143.84 20.18 Favored 'General case' 0 N--CA 1.452 -0.364 0 C-N-CA 123.772 0.829 . . . . 0.0 108.923 172.855 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 51.1 m-20 -110.09 18.28 20.16 Favored 'General case' 0 N--CA 1.457 -0.114 0 N-CA-C 112.389 0.514 . . . . 0.0 112.389 -178.287 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 21.2 p-10 -70.39 -29.18 65.76 Favored 'General case' 0 C--N 1.331 -0.222 0 N-CA-C 108.032 -1.099 . . . . 0.0 108.032 175.863 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 7' ' ' PHE . . . . . 0.498 ' CD1' ' HD3' ' A' ' 45' ' ' LYS . 1.2 t80 -55.03 -30.47 59.62 Favored 'General case' 0 N--CA 1.445 -0.695 0 C-N-CA 126.09 1.756 . . . . 0.0 111.213 -178.02 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 52.1 tp60 -50.48 -36.51 33.97 Favored 'General case' 0 N--CA 1.455 -0.218 0 C-N-CA 124.125 0.97 . . . . 0.0 111.878 -177.679 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 33.8 m-80 -72.36 -36.36 68.75 Favored 'General case' 0 N--CA 1.454 -0.251 0 CA-C-N 117.939 0.336 . . . . 0.0 110.294 -179.195 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 1.9 t80 -70.84 -39.27 73.08 Favored 'General case' 0 N--CA 1.452 -0.336 0 C-N-CA 123.519 0.728 . . . . 0.0 109.044 178.008 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 76.6 t -66.59 -53.02 39.58 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.385 0 N-CA-C 108.776 -0.824 . . . . 0.0 108.776 179.446 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -60.07 -31.25 69.83 Favored 'General case' 0 N--CA 1.454 -0.267 0 C-N-CA 122.759 0.424 . . . . 0.0 111.839 -178.517 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 86.6 m -67.53 -43.78 79.95 Favored 'General case' 0 CA--C 1.531 0.241 0 N-CA-C 108.691 -0.855 . . . . 0.0 108.691 176.488 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.443 HD22 ' HG ' ' A' ' 49' ' ' LEU . 5.5 tp -69.36 -39.56 78.02 Favored 'General case' 0 N--CA 1.452 -0.356 0 CA-C-N 116.418 -0.355 . . . . 0.0 111.278 -179.559 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 69.4 mm-40 -62.73 -33.76 75.8 Favored 'General case' 0 N--CA 1.451 -0.421 0 C-N-CA 123.596 0.758 . . . . 0.0 109.206 178.226 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 49.5 m -66.21 -32.89 74.59 Favored 'General case' 0 N--CA 1.451 -0.412 0 N-CA-C 108.881 -0.785 . . . . 0.0 108.881 176.774 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 17' ' ' PHE . . . . . 0.467 ' CE2' ' HB3' ' A' ' 25' ' ' SER . 14.8 m-30 -69.83 -33.82 72.83 Favored 'General case' 0 C--N 1.339 0.126 0 N-CA-C 112.2 0.444 . . . . 0.0 112.2 174.904 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 70.5 mttt -64.54 -27.08 68.72 Favored 'General case' 0 C--N 1.339 0.134 0 N-CA-C 109.243 -0.651 . . . . 0.0 109.243 174.944 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 43.8 t0 -79.41 -22.24 44.54 Favored 'General case' 0 CA--C 1.535 0.368 0 CA-C-N 115.701 -0.681 . . . . 0.0 111.898 177.009 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 81.1 mt -72.65 148.54 44.69 Favored 'General case' 0 N--CA 1.457 -0.11 0 O-C-N 121.152 -0.968 . . . . 0.0 110.674 179.649 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 1.6 mppt? -86.73 20.31 2.6 Favored 'General case' 0 CA--C 1.534 0.351 0 CA-C-N 115.653 -0.703 . . . . 0.0 109.33 175.713 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 79.9 p -147.46 -32.51 0.29 Allowed 'General case' 0 CA--C 1.53 0.198 0 C-N-CA 123.953 0.901 . . . . 0.0 111.237 -176.803 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 80.07 -19.91 6.17 Favored Glycine 0 CA--C 1.527 0.841 0 CA-C-O 119.601 -0.555 . . . . 0.0 113.63 176.194 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 96.3 mt -89.86 145.88 6.86 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.128 0 CA-C-N 118.059 0.93 . . . . 0.0 109.549 176.188 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 25' ' ' SER . . . . . 0.467 ' HB3' ' CE2' ' A' ' 17' ' ' PHE . 33.4 t -166.71 88.53 0.34 Allowed 'General case' 0 N--CA 1.455 -0.225 0 CA-C-N 117.679 0.218 . . . . 0.0 110.813 176.517 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -47.58 -56.55 8.27 Favored Glycine 0 CA--C 1.528 0.861 0 CA-C-O 119.111 -0.827 . . . . 0.0 114.623 -170.753 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 27' ' ' SER . . . . . 0.588 ' HA ' ' HE3' ' A' ' 30' ' ' LYS . 38.9 m -63.55 -36.25 83.17 Favored 'General case' 0 CA--C 1.524 -0.027 0 CA-C-N 119.2 1.5 . . . . 0.0 112.026 -176.328 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -75.76 -37.54 59.17 Favored 'General case' 0 CA--C 1.529 0.172 0 N-CA-C 109.846 -0.427 . . . . 0.0 109.846 179.079 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 60.6 mt -58.03 -42.82 83.72 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.501 0 N-CA-C 108.237 -1.023 . . . . 0.0 108.237 172.163 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 30' ' ' LYS . . . . . 0.588 ' HE3' ' HA ' ' A' ' 27' ' ' SER . 45.2 mtmt -69.1 -23.36 63.99 Favored 'General case' 0 N--CA 1.454 -0.226 0 CA-C-O 118.846 -0.597 . . . . 0.0 111.497 178.777 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 31' ' ' LYS . . . . . 0.469 ' CE ' ' HA ' ' A' ' 31' ' ' LYS . 3.9 mmpt? -67.64 -51.59 48.18 Favored 'General case' 0 C--N 1.34 0.183 0 CA-C-N 118.904 0.775 . . . . 0.0 110.314 175.405 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 4.2 pp -75.0 -23.25 58.21 Favored 'General case' 0 CA--C 1.531 0.227 0 C-N-CA 119.943 -0.703 . . . . 0.0 110.671 179.431 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 33' ' ' THR . . . . . 0.402 ' HB ' ' HA ' ' A' ' 30' ' ' LYS . 51.9 m -71.54 -39.34 70.76 Favored 'General case' 0 CA--C 1.523 -0.095 0 N-CA-C 109.678 -0.489 . . . . 0.0 109.678 177.125 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 99.7 m -70.61 -41.46 72.22 Favored 'General case' 0 N--CA 1.45 -0.47 0 N-CA-C 109.685 -0.487 . . . . 0.0 109.685 -177.881 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 29.1 t80 -66.07 -30.29 70.78 Favored 'General case' 0 N--CA 1.453 -0.282 0 C-N-CA 119.772 -0.771 . . . . 0.0 109.815 178.206 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -71.03 -27.86 63.97 Favored 'General case' 0 N--CA 1.449 -0.489 0 CA-C-O 119.492 -0.289 . . . . 0.0 111.375 176.102 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.405 HD23 ' HA ' ' A' ' 37' ' ' LEU . 11.4 mt -81.18 -39.63 25.17 Favored 'General case' 0 CA--C 1.519 -0.242 0 N-CA-C 108.926 -0.768 . . . . 0.0 108.926 -179.943 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 86.1 m-20 -58.65 -30.79 67.58 Favored 'General case' 0 N--CA 1.44 -0.949 0 C-N-CA 123.843 0.857 . . . . 0.0 110.633 175.076 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 78.4 m80 -149.93 103.3 3.2 Favored 'General case' 0 N--CA 1.453 -0.306 0 C-N-CA 122.885 0.474 . . . . 0.0 111.299 179.147 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 40' ' ' ILE . . . . . 0.638 ' H ' HD13 ' A' ' 40' ' ' ILE . 0.0 OUTLIER -75.72 -9.92 13.1 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.449 0 N-CA-C 109.136 -0.69 . . . . 0.0 109.136 172.672 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 4.6 m-20 -55.21 -25.11 30.95 Favored 'General case' 0 N--CA 1.455 -0.224 0 C-N-CA 124.026 0.931 . . . . 0.0 111.58 -177.744 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -105.62 16.33 6.45 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.328 0 C-N-CA 123.454 0.701 . . . . 0.0 112.105 -179.656 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 2.7 pp20? -52.31 -31.31 32.48 Favored 'General case' 0 CA--C 1.529 0.135 0 CA-C-N 118.641 0.655 . . . . 0.0 111.051 178.583 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 40.8 t -62.27 -46.85 86.95 Favored 'General case' 0 CA--C 1.531 0.238 0 N-CA-C 112.265 0.469 . . . . 0.0 112.265 -177.879 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 45' ' ' LYS . . . . . 0.498 ' HD3' ' CD1' ' A' ' 7' ' ' PHE . 14.6 ptpt -74.34 -23.49 59.05 Favored 'General case' 0 C--N 1.341 0.219 0 O-C-N 121.892 -0.505 . . . . 0.0 110.149 179.21 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 85.5 mt -73.74 -47.81 42.45 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.307 0 N-CA-C 110.059 -0.348 . . . . 0.0 110.059 -178.697 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 40.7 mm -66.93 -38.28 81.08 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.13 0 N-CA-C 109.781 -0.452 . . . . 0.0 109.781 179.415 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 27.8 t -64.78 -34.25 77.91 Favored 'General case' 0 N--CA 1.454 -0.258 0 C-N-CA 121.103 -0.239 . . . . 0.0 110.459 178.14 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 49' ' ' LEU . . . . . 0.454 HD22 ' CE1' ' A' ' 7' ' ' PHE . 40.9 tp -75.15 -34.51 61.63 Favored 'General case' 0 N--CA 1.452 -0.353 0 N-CA-C 112.673 0.62 . . . . 0.0 112.673 -176.605 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 11.4 pt -71.23 -43.21 74.73 Favored 'Isoleucine or valine' 0 C--N 1.339 0.151 0 CA-C-N 118.459 0.572 . . . . 0.0 110.162 178.574 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 35.4 pt -65.29 -39.77 86.41 Favored 'Isoleucine or valine' 0 C--O 1.231 0.103 0 C-N-CA 119.87 -0.732 . . . . 0.0 110.842 -178.516 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 78.3 m-20 -65.11 -51.46 61.14 Favored 'General case' 0 N--CA 1.454 -0.254 0 CA-C-N 117.462 0.119 . . . . 0.0 111.214 179.04 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 53' ' ' TYR . . . . . 0.421 ' CB ' HD21 ' A' ' 14' ' ' LEU . 15.9 t80 -63.95 -45.54 88.72 Favored 'General case' 0 N--CA 1.453 -0.306 0 N-CA-C 110.1 -0.334 . . . . 0.0 110.1 -179.293 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 31.7 t -65.2 -29.9 70.75 Favored 'General case' 0 N--CA 1.455 -0.216 0 N-CA-C 112.646 0.61 . . . . 0.0 112.646 -175.204 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 17.0 tpt85 -82.14 -36.67 27.2 Favored 'General case' 0 N--CA 1.454 -0.235 0 C-N-CA 119.697 -0.801 . . . . 0.0 111.193 -178.492 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 57.7 mt -80.98 -43.26 19.93 Favored 'General case' 0 C--O 1.227 -0.111 0 N-CA-C 112.764 0.654 . . . . 0.0 112.764 -178.482 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 57' ' ' CYS . . . . . 0.466 ' HB2' ' HD2' ' A' ' 58' ' ' PRO . 13.3 p -62.06 159.78 35.09 Favored Pre-proline 0 CA--C 1.536 0.419 0 N-CA-C 112.875 0.695 . . . . 0.0 112.875 -173.93 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 58' ' ' PRO . . . . . 0.466 ' HD2' ' HB2' ' A' ' 57' ' ' CYS . 84.3 Cg_endo -74.7 169.94 21.45 Favored 'Trans proline' 0 N--CA 1.451 -1.014 0 C-N-CA 124.209 3.272 . . . . 0.0 110.183 179.4 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -50.5 -47.04 57.45 Favored 'General case' 0 N--CA 1.457 -0.124 0 N-CA-C 114.287 1.218 . . . . 0.0 114.287 -170.795 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 16.6 t -66.79 -32.1 73.16 Favored 'General case' 0 N--CA 1.455 -0.198 0 C-N-CA 119.539 -0.864 . . . . 0.0 110.038 -177.323 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 54.8 m170 -76.03 -27.55 57.36 Favored 'General case' 0 N--CA 1.453 -0.276 0 N-CA-C 109.973 -0.38 . . . . 0.0 109.973 177.221 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 68.0 mttm -65.73 -39.87 91.58 Favored 'General case' 0 C--N 1.343 0.305 0 N-CA-C 109.106 -0.702 . . . . 0.0 109.106 174.074 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -63.08 -41.64 99.46 Favored 'General case' 0 N--CA 1.452 -0.374 0 N-CA-C 108.283 -1.006 . . . . 0.0 108.283 176.702 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -67.63 -31.56 76.51 Favored Glycine 0 CA--C 1.525 0.704 0 CA-C-O 119.713 -0.493 . . . . 0.0 112.271 -179.197 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 22.6 t -74.28 -32.75 63.02 Favored 'General case' 0 N--CA 1.453 -0.277 0 CA-C-N 118.118 0.959 . . . . 0.0 110.566 178.157 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 69.1 mt -71.99 -24.86 61.64 Favored 'General case' 0 N--CA 1.452 -0.328 0 N-CA-C 109.336 -0.616 . . . . 0.0 109.336 176.037 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -72.47 -36.88 68.59 Favored 'General case' 0 N--CA 1.455 -0.19 0 N-CA-C 110.333 -0.247 . . . . 0.0 110.333 174.533 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 68' ' ' ILE . . . . . . . . . . . . . 27.1 mt -66.65 -49.58 73.53 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.356 0 N-CA-C 108.811 -0.811 . . . . 0.0 108.811 174.886 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 67.1 mt -54.14 -34.68 27.43 Favored 'Isoleucine or valine' 0 C--O 1.226 -0.177 0 C-N-CA 123.085 0.554 . . . . 0.0 111.702 175.78 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 28.9 t70 -68.3 -44.58 75.11 Favored 'General case' 0 N--CA 1.452 -0.331 0 CA-C-N 119.112 0.869 . . . . 0.0 110.651 176.538 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 31.9 t -67.45 -57.22 6.93 Favored 'General case' 0 N--CA 1.451 -0.382 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.926 -176.804 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 72' ' ' ILE . . . . . 0.408 HD11 ' CZ ' ' A' ' 76' ' ' TYR . 0.0 OUTLIER -75.12 -30.58 23.38 Favored 'Isoleucine or valine' 0 CA--C 1.523 -0.075 0 N-CA-C 110.465 -0.198 . . . . 0.0 110.465 -177.469 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -68.49 -54.3 16.64 Favored Glycine 0 C--N 1.336 0.545 0 N-CA-C 111.582 -0.607 . . . . 0.0 111.582 -175.774 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 44.3 mtm105 -69.75 -37.34 76.4 Favored 'General case' 0 N--CA 1.452 -0.327 0 C-N-CA 120.273 -0.571 . . . . 0.0 109.737 179.294 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -60.29 -37.02 79.22 Favored 'General case' 0 N--CA 1.45 -0.456 0 C-N-CA 120.299 -0.56 . . . . 0.0 110.323 179.486 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 76' ' ' TYR . . . . . 0.408 ' CZ ' HD11 ' A' ' 72' ' ' ILE . 2.1 m-30 -68.05 -54.08 20.94 Favored 'General case' 0 N--CA 1.451 -0.378 0 CA-C-N 118.075 0.398 . . . . 0.0 111.045 178.765 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 1.5 tt -67.84 -42.27 81.66 Favored 'General case' 0 N--CA 1.448 -0.531 0 C-N-CA 118.813 -1.155 . . . . 0.0 109.003 -174.837 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 79.6 m-20 -61.72 -49.45 76.4 Favored 'General case' 0 CA--C 1.531 0.235 0 N-CA-C 112.946 0.721 . . . . 0.0 112.946 179.07 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 65.5 mm-40 -66.32 -42.96 87.5 Favored 'General case' 0 C--N 1.34 0.158 0 CA-C-N 119.452 1.024 . . . . 0.0 111.688 -178.279 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 42.6 p -65.03 -35.34 80.87 Favored 'General case' 0 N--CA 1.45 -0.432 0 N-CA-C 109.737 -0.468 . . . . 0.0 109.737 178.15 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 33.1 ttp180 -69.16 -43.22 74.71 Favored 'General case' 0 N--CA 1.45 -0.432 0 C-N-CA 123.613 0.765 . . . . 0.0 111.792 179.259 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 42.0 t -83.59 -35.66 24.52 Favored 'General case' 0 N--CA 1.454 -0.254 0 N-CA-C 113.568 0.951 . . . . 0.0 113.568 -176.56 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 50.7 m-20 -131.18 -8.65 3.81 Favored 'General case' 0 C--N 1.34 0.165 0 N-CA-C 115.471 1.656 . . . . 0.0 115.471 -166.967 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 92.0 p -161.26 77.95 0.57 Allowed 'General case' 0 N--CA 1.461 0.11 0 CA-C-N 119.844 1.202 . . . . 0.0 111.621 179.11 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 4.5 m120 -65.14 137.57 57.73 Favored 'General case' 0 CA--C 1.529 0.156 0 N-CA-C 109.258 -0.645 . . . . 0.0 109.258 177.642 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 86' ' ' SER . . . . . 0.403 ' C ' ' H ' ' A' ' 88' ' ' SER . 76.6 p -83.24 -17.07 43.97 Favored 'General case' 0 CA--C 1.528 0.124 0 O-C-N 122.294 -0.254 . . . . 0.0 111.447 -179.423 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 37.5 p 58.65 -5.42 0.06 Allowed 'General case' 0 N--CA 1.463 0.216 0 C-N-CA 125.787 1.635 . . . . 0.0 113.73 -177.001 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 88' ' ' SER . . . . . 0.403 ' H ' ' C ' ' A' ' 86' ' ' SER . 46.6 t -162.89 162.4 26.3 Favored 'General case' 0 N--CA 1.454 -0.258 0 C-N-CA 122.963 0.505 . . . . 0.0 110.119 179.841 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 1.1 t30 -82.97 114.22 21.09 Favored 'General case' 0 N--CA 1.454 -0.229 0 N-CA-C 109.468 -0.567 . . . . 0.0 109.468 175.424 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 46.8 mmtm -149.62 142.11 15.57 Favored Pre-proline 0 N--CA 1.456 -0.128 0 N-CA-C 108.628 -0.879 . . . . 0.0 108.628 177.866 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 70.5 Cg_exo -52.8 144.77 42.47 Favored 'Trans proline' 0 N--CA 1.45 -1.075 0 C-N-CA 122.639 2.226 . . . . 0.0 109.727 173.815 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 92.69 20.27 34.86 Favored Glycine 0 CA--C 1.528 0.851 0 CA-C-O 119.21 -0.772 . . . . 0.0 112.487 -178.246 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 60.6 p -151.67 167.61 27.61 Favored 'General case' 0 CA--C 1.522 -0.119 0 CA-C-N 118.11 0.955 . . . . 0.0 110.26 176.118 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 94' ' ' CYS . . . . . 0.461 ' HB2' HD13 ' A' ' 98' ' ' ILE . 17.2 p -59.51 -24.69 63.85 Favored 'General case' 0 N--CA 1.449 -0.512 0 CA-C-N 115.623 -0.717 . . . . 0.0 109.779 175.794 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -63.4 -57.65 9.61 Favored 'General case' 0 N--CA 1.446 -0.656 0 N-CA-C 109.376 -0.601 . . . . 0.0 109.376 -173.59 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 66.5 t60 -74.78 -29.28 61.06 Favored 'General case' 0 N--CA 1.449 -0.524 0 CA-C-N 116.553 -0.294 . . . . 0.0 110.631 -179.464 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -67.41 -54.52 19.7 Favored 'General case' 0 N--CA 1.452 -0.336 0 N-CA-C 111.643 0.238 . . . . 0.0 111.643 -179.125 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 98' ' ' ILE . . . . . 0.461 HD13 ' HB2' ' A' ' 94' ' ' CYS . 2.5 mp -70.0 -31.51 48.05 Favored 'Isoleucine or valine' 0 C--N 1.341 0.202 0 C-N-CA 120.817 -0.353 . . . . 0.0 110.504 -179.577 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 77.0 m-20 -68.65 -38.25 80.32 Favored 'General case' 0 N--CA 1.452 -0.37 0 CA-C-N 118.458 0.572 . . . . 0.0 111.379 176.544 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 58.2 m -73.14 -36.93 66.77 Favored 'General case' 0 N--CA 1.454 -0.228 0 CA-C-N 117.996 0.362 . . . . 0.0 110.378 179.874 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 60.0 tp -74.86 -31.92 61.75 Favored 'General case' 0 N--CA 1.452 -0.372 0 C-N-CA 121.394 -0.122 . . . . 0.0 111.089 179.137 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -62.91 -20.86 62.76 Favored Glycine 0 CA--C 1.525 0.71 0 CA-C-O 119.614 -0.548 . . . . 0.0 112.465 -176.047 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 6.1 mm-40 -85.92 -32.77 21.43 Favored 'General case' 0 N--CA 1.456 -0.164 0 CA-C-N 118.213 1.006 . . . . 0.0 111.428 177.711 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 43.9 t -96.06 -19.35 6.25 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.221 0 N-CA-C 112.701 0.63 . . . . 0.0 112.701 -175.415 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 105' ' ' ILE . . . . . . . . . . . . . 10.5 tp -57.59 -24.95 23.42 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.229 0 CA-C-N 118.604 0.638 . . . . 0.0 111.8 -177.025 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 27.5 pt20 -68.17 -25.3 65.18 Favored 'General case' 0 N--CA 1.452 -0.368 0 O-C-N 122.1 -0.375 . . . . 0.0 110.325 178.506 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 65.0 mm-40 -75.58 -39.95 57.31 Favored 'General case' 0 N--CA 1.456 -0.13 0 CA-C-N 118.271 0.487 . . . . 0.0 109.913 176.471 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 8.3 mp -70.56 -41.16 72.81 Favored 'General case' 0 N--CA 1.451 -0.376 0 N-CA-C 109.769 -0.456 . . . . 0.0 109.769 -178.583 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 89.1 mt -67.69 -61.45 1.88 Allowed 'General case' 0 N--CA 1.452 -0.337 0 CA-C-O 119.351 -0.357 . . . . 0.0 110.246 178.451 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 19.5 p -44.36 -51.24 8.69 Favored 'General case' 0 CA--C 1.52 -0.205 0 C-N-CA 122.993 0.517 . . . . 0.0 112.238 -178.076 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 62.3 t0 -63.69 -42.01 98.05 Favored 'General case' 0 N--CA 1.448 -0.539 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.438 -178.047 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -72.42 -35.75 68.44 Favored 'General case' 0 N--CA 1.447 -0.593 0 C-N-CA 120.762 -0.375 . . . . 0.0 111.268 -178.028 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 113' ' ' ILE . . . . . . . . . . . . . 34.9 mm -68.42 -38.27 79.06 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.185 0 CA-C-N 119.185 0.902 . . . . 0.0 109.569 -177.533 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -75.0 -45.46 41.79 Favored 'General case' 0 N--CA 1.451 -0.396 0 CA-C-N 117.471 0.123 . . . . 0.0 111.242 179.765 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 115' ' ' LYS . . . . . 0.611 ' HE2' ' HA ' ' A' ' 115' ' ' LYS . 0.2 OUTLIER -82.07 -31.16 30.94 Favored 'General case' 0 N--CA 1.455 -0.209 0 N-CA-C 113.869 1.063 . . . . 0.0 113.869 -173.111 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 116' ' ' SER . . . . . 0.464 ' HB2' ' CB ' ' A' ' 120' ' ' HIS . 45.5 p -76.39 156.12 33.48 Favored 'General case' 0 CA--C 1.528 0.13 0 N-CA-C 112.261 0.467 . . . . 0.0 112.261 -172.984 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 53.6 t30 -73.02 165.67 24.57 Favored 'General case' 0 N--CA 1.453 -0.277 0 C-N-CA 123.383 0.673 . . . . 0.0 110.708 -178.863 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 118' ' ' GLN . . . . . . . . . . . . . 20.5 mm100 -53.68 -38.1 63.86 Favored 'General case' 0 CA--C 1.531 0.226 0 N-CA-C 112.908 0.707 . . . . 0.0 112.908 -172.765 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 7.5 p-10 -71.65 -38.42 70.71 Favored 'General case' 0 N--CA 1.454 -0.272 0 N-CA-C 109.899 -0.408 . . . . 0.0 109.899 179.227 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 120' ' ' HIS . . . . . 0.464 ' CB ' ' HB2' ' A' ' 116' ' ' SER . 34.3 m170 -65.3 -40.78 94.26 Favored 'General case' 0 N--CA 1.451 -0.406 0 C-N-CA 122.681 0.392 . . . . 0.0 110.044 176.457 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 56.7 mttm -58.55 -42.94 89.02 Favored 'General case' 0 C--N 1.341 0.231 0 N-CA-C 108.895 -0.779 . . . . 0.0 108.895 178.225 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 43.8 tp10 -73.73 -36.5 65.18 Favored 'General case' 0 N--CA 1.451 -0.417 0 CA-C-N 116.661 -0.245 . . . . 0.0 111.468 -176.863 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 13.0 tppt? -62.41 -36.04 81.1 Favored 'General case' 0 N--CA 1.45 -0.431 0 N-CA-C 109.333 -0.617 . . . . 0.0 109.333 177.828 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 124' ' ' ILE . . . . . . . . . . . . . 61.2 mt -69.37 -36.26 71.14 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.261 0 O-C-N 121.957 -0.464 . . . . 0.0 109.892 177.51 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 13.7 mtp-105 -68.05 -35.34 78.07 Favored 'General case' 0 N--CA 1.457 -0.099 0 CA-C-O 119.468 -0.301 . . . . 0.0 111.511 -178.472 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 126' ' ' MET . . . . . . . . . . . . . 27.2 ptm -72.92 -28.01 62.2 Favored 'General case' 0 N--CA 1.455 -0.177 0 C-N-CA 119.488 -0.885 . . . . 0.0 109.452 174.666 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 4.2 mp -65.77 -31.62 72.69 Favored 'General case' 0 CA--C 1.529 0.163 0 CA-C-N 118.084 0.402 . . . . 0.0 110.134 172.999 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 95.6 mt -70.12 -38.72 75.66 Favored 'General case' 0 C--N 1.34 0.19 0 CA-C-N 118.755 0.707 . . . . 0.0 109.868 176.237 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 10.7 t70 -60.37 -44.02 96.01 Favored 'General case' 0 N--CA 1.454 -0.231 0 N-CA-C 109.182 -0.673 . . . . 0.0 109.182 175.561 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 130' ' ' ILE . . . . . 0.419 ' HA ' ' HD3' ' A' ' 133' ' ' ARG . 73.9 mt -61.87 -39.07 82.18 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.417 0 CA-C-N 116.418 -0.355 . . . . 0.0 110.632 -179.532 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 131' ' ' TRP . . . . . . . . . . . . . 48.1 m0 -75.39 -32.64 60.86 Favored 'General case' 0 N--CA 1.45 -0.43 0 N-CA-C 112.355 0.502 . . . . 0.0 112.355 -179.045 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 62.9 m-20 -70.53 -27.56 64.26 Favored 'General case' 0 C--O 1.228 -0.067 0 CA-C-N 118.504 0.593 . . . . 0.0 110.881 177.535 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 133' ' ' ARG . . . . . 0.481 HH21 ' C ' ' B' 2063 ' ' SER . 23.6 mtp180 -73.28 -42.95 61.85 Favored 'General case' 0 CA--C 1.521 -0.163 0 N-CA-C 109.741 -0.466 . . . . 0.0 109.741 177.019 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 46.4 t -77.08 -19.1 57.5 Favored 'General case' 0 CA--C 1.536 0.421 0 C-N-CA 122.185 0.194 . . . . 0.0 111.289 178.898 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 135' ' ' GLY . . . . . . . . . . . . . . . 91.09 14.13 58.01 Favored Glycine 0 CA--C 1.528 0.904 0 CA-C-O 119.346 -0.697 . . . . 0.0 114.356 174.444 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 136' ' ' LEU . . . . . . . . . . . . . 7.8 mp -73.08 154.65 40.32 Favored 'General case' 0 CA--C 1.529 0.154 0 CA-C-N 118.591 1.196 . . . . 0.0 109.881 178.667 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 137' ' ' PHE . . . . . . . . . . . . . 16.2 m-85 -77.68 148.38 35.01 Favored 'General case' 0 N--CA 1.455 -0.207 0 N-CA-C 109.77 -0.455 . . . . 0.0 109.77 176.648 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 138' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -150.9 -3.39 0.33 Allowed 'General case' 0 CA--C 1.532 0.271 0 N-CA-C 114.382 1.253 . . . . 0.0 114.382 -178.322 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 139' ' ' LYS . . . . . 0.423 ' C ' ' H ' ' A' ' 141' ' ' TYR . 53.7 mttp 49.95 28.7 3.0 Favored 'General case' 0 CA--C 1.536 0.407 0 CA-C-N 118.955 0.798 . . . . 0.0 111.746 -175.776 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 140' ' ' SER . . . . . . . . . . . . . 34.0 t -68.75 26.41 0.03 OUTLIER 'General case' 0 CA--C 1.532 0.281 0 C-N-CA 124.58 1.152 . . . . 0.0 113.139 -176.06 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 141' ' ' TYR . . . . . 0.423 ' H ' ' C ' ' A' ' 139' ' ' LYS . 43.7 p90 -137.24 2.18 2.5 Favored 'General case' 0 N--CA 1.452 -0.34 0 C-N-CA 123.562 0.745 . . . . 0.0 111.001 178.837 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 142' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -80.65 147.83 30.49 Favored 'General case' 0 N--CA 1.455 -0.192 0 N-CA-C 109.379 -0.6 . . . . 0.0 109.379 175.957 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 4.4 m120 -63.34 -15.06 56.24 Favored 'General case' 0 CA--C 1.53 0.194 0 C-N-CA 122.713 0.405 . . . . 0.0 111.805 -178.692 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . -72.15 -32.5 66.94 Favored 'General case' 0 N--CA 1.45 -0.432 0 C-N-CA 122.185 0.194 . . . . 0.0 110.586 178.356 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 145' ' ' ILE . . . . . . . . . . . . . 38.5 mm -70.54 -35.11 60.12 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.209 0 N-CA-C 110.069 -0.345 . . . . 0.0 110.069 -178.114 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 146' ' ' ARG . . . . . . . . . . . . . 9.2 tpp180 -73.61 -31.9 63.8 Favored 'General case' 0 N--CA 1.454 -0.233 0 N-CA-C 108.905 -0.776 . . . . 0.0 108.905 176.495 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 147' ' ' SER . . . . . . . . . . . . . 42.9 t 46.45 52.65 10.59 Favored 'General case' 0 N--CA 1.456 -0.143 0 CA-C-O 120.941 0.401 . . . . 0.0 110.433 178.275 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 148' ' ' LYS . . . . . 0.478 ' HD3' ' H ' ' A' ' 148' ' ' LYS . 0.0 OUTLIER -49.22 -18.85 0.39 Allowed 'General case' 0 N--CA 1.453 -0.32 0 C-N-CA 125.004 1.322 . . . . 0.0 113.608 -175.527 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 149' ' ' CYS . . . . . . . . . . . . . 60.1 m -62.73 -34.53 77.38 Favored 'General case' 0 N--CA 1.452 -0.368 0 CA-C-N 118.575 0.625 . . . . 0.0 110.226 178.231 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 150' ' ' PHE . . . . . . . . . . . . . 70.2 t80 -69.83 -28.3 65.58 Favored 'General case' 0 N--CA 1.452 -0.339 0 N-CA-C 110.212 -0.292 . . . . 0.0 110.212 179.495 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 151' ' ' ALA . . . . . . . . . . . . . . . -76.44 -27.52 56.23 Favored 'General case' 0 N--CA 1.452 -0.337 0 C-N-CA 122.16 0.184 . . . . 0.0 110.573 177.073 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 152' ' ' MET . . . . . . . . . . . . . 96.4 mmm -75.84 -27.11 57.71 Favored 'General case' 0 N--CA 1.455 -0.202 0 N-CA-C 110.435 -0.209 . . . . 0.0 110.435 175.143 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 153' ' ' ASP . . . . . . . . . . . . . 67.0 m-20 -73.55 -42.98 60.95 Favored 'General case' 0 N--CA 1.454 -0.265 0 N-CA-C 110.305 -0.258 . . . . 0.0 110.305 175.144 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 154' ' ' LEU . . . . . . . . . . . . . 49.2 mt -143.11 121.17 12.11 Favored 'General case' 0 CA--C 1.53 0.176 0 C-N-CA 123.174 0.59 . . . . 0.0 109.962 177.772 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 155' ' ' GLU . . . . . . . . . . . . . 92.0 mt-10 -73.76 0.76 12.09 Favored 'General case' 0 CA--C 1.53 0.195 0 C-N-CA 122.405 0.282 . . . . 0.0 111.071 178.055 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 156' ' ' HIS . . . . . . . . . . . . . 33.2 m170 -76.41 13.41 0.96 Allowed 'General case' 0 N--CA 1.456 -0.16 0 C-N-CA 124.092 0.957 . . . . 0.0 112.678 -175.57 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 157' ' ' HIS . . . . . . . . . . . . . 76.6 m-70 -137.63 147.91 45.35 Favored 'General case' 0 N--CA 1.454 -0.256 0 CA-C-N 118.214 0.461 . . . . 0.0 111.849 -174.733 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 158' ' ' HIS . . . . . . . . . . . . . 20.8 p80 -156.04 5.19 0.19 Allowed 'General case' 0 C--O 1.227 -0.099 0 C-N-CA 123.87 0.868 . . . . 0.0 110.384 178.042 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 159' ' ' HIS . . . . . . . . . . . . . 13.6 m80 . . . . . 0 C--O 1.248 0.993 0 CA-C-O 117.282 -1.342 . . . . 0.0 111.21 -174.44 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' B' B 2052 ' ' ASP . . . . . . . . . . . . . 3.0 m-20 . . . . . 0 N--CA 1.467 0.399 0 N-CA-C 110.407 -0.22 . . . . 0.0 110.407 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' B' B 2053 ' ' ASP . . . . . . . . . . . . . 19.4 m-20 -68.78 175.55 3.53 Favored 'General case' 0 CA--C 1.53 0.176 0 C-N-CA 123.16 0.584 . . . . 0.0 112.518 -178.045 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B 2054 ' ' ASP . . . . . . . . . . . . . 42.4 p30 -136.32 23.2 3.22 Favored 'General case' 0 CA--C 1.533 0.297 0 C-N-CA 123.79 0.836 . . . . 0.0 112.882 -170.036 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B 2055 ' ' GLU . . . . . . . . . . . . . 65.0 tt0 -149.17 48.0 0.98 Allowed 'General case' 0 CA--C 1.528 0.123 0 O-C-N 121.742 -0.599 . . . . 0.0 110.617 -177.088 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B 2056 ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -67.78 13.16 0.08 Allowed 'General case' 0 CA--C 1.535 0.372 0 N-CA-C 114.304 1.224 . . . . 0.0 114.304 -176.004 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B 2057 ' ' ASP . . . . . . . . . . . . . 47.4 t0 -157.11 74.18 0.77 Allowed 'General case' 0 N--CA 1.453 -0.316 0 CA-C-N 118.469 0.577 . . . . 0.0 110.289 172.897 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B 2058 ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -59.14 131.52 51.28 Favored 'General case' 0 C--N 1.341 0.231 0 N-CA-C 108.994 -0.743 . . . . 0.0 108.994 175.832 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B 2059 ' ' THR . . . . . . . . . . . . . 49.2 m -83.37 115.76 60.93 Favored Pre-proline 0 N--CA 1.454 -0.27 0 N-CA-C 108.94 -0.763 . . . . 0.0 108.94 179.07 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B 2060 ' ' PRO . . . . . . . . . . . . . 98.7 Cg_endo -74.22 122.18 7.38 Favored 'Trans proline' 0 N--CA 1.447 -1.23 0 C-N-CA 122.819 2.346 . . . . 0.0 110.832 -178.934 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B 2061 ' ' SER . . . . . . . . . . . . . 76.6 p -79.46 126.55 31.0 Favored 'General case' 0 N--CA 1.451 -0.393 0 N-CA-C 108.158 -1.053 . . . . 0.0 108.158 173.207 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B 2062 ' ' ILE . . . . . 0.435 HD11 ' HB2' ' A' ' 133' ' ' ARG . 4.6 tp -151.86 133.05 4.78 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.382 0 N-CA-C 112.308 0.484 . . . . 0.0 112.308 -175.963 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B 2063 ' ' SER . . . . . 0.481 ' C ' HH21 ' A' ' 133' ' ' ARG . 35.1 m . . . . . 0 C--O 1.252 1.205 0 CA-C-O 117.628 -1.177 . . . . 0.0 109.548 175.418 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 2.9 mpp? . . . . . 0 N--CA 1.475 0.806 0 CA-C-O 119.983 -0.056 . . . . 0.0 111.1 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 5.1 pm0 -150.35 -19.09 0.24 Allowed 'General case' 0 CA--C 1.532 0.265 0 N-CA-C 111.972 0.36 . . . . 0.0 111.972 -179.82 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 18.8 pt20 -157.69 20.31 0.27 Allowed 'General case' 0 CA--C 1.529 0.139 0 N-CA-C 107.496 -1.298 . . . . 0.0 107.496 173.455 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 11.0 p30 -158.32 -179.97 8.6 Favored 'General case' 0 N--CA 1.445 -0.724 0 C-N-CA 125.892 1.677 . . . . 0.0 108.312 -168.502 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 8.4 m-20 56.94 20.13 5.1 Favored 'General case' 0 N--CA 1.456 -0.146 0 C-N-CA 123.604 0.762 . . . . 0.0 112.848 179.5 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 26.8 p-10 -73.44 -28.85 62.19 Favored 'General case' 0 N--CA 1.454 -0.27 0 C-N-CA 123.13 0.572 . . . . 0.0 110.017 -178.764 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 1.6 t80 -53.83 -37.54 63.7 Favored 'General case' 0 N--CA 1.45 -0.461 0 CA-C-N 115.965 -0.561 . . . . 0.0 109.983 178.966 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 53.3 tp60 -56.58 -32.17 64.95 Favored 'General case' 0 N--CA 1.452 -0.369 0 C-N-CA 123.166 0.586 . . . . 0.0 111.813 -177.017 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 13.7 t-20 -71.45 -34.45 70.25 Favored 'General case' 0 N--CA 1.452 -0.346 0 N-CA-C 109.832 -0.433 . . . . 0.0 109.832 177.964 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 10' ' ' PHE . . . . . 0.464 ' CE2' ' HB2' ' A' ' 32' ' ' LEU . 6.7 t80 -68.97 -38.85 79.61 Favored 'General case' 0 N--CA 1.45 -0.43 0 C-N-CA 123.176 0.591 . . . . 0.0 109.5 176.014 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 87.4 t -64.48 -55.14 23.05 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.316 0 N-CA-C 109.092 -0.707 . . . . 0.0 109.092 178.279 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -59.7 -28.45 67.33 Favored 'General case' 0 N--CA 1.452 -0.334 0 C-N-CA 122.973 0.509 . . . . 0.0 112.1 -178.932 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 90.7 m -74.57 -39.94 61.94 Favored 'General case' 0 N--CA 1.456 -0.174 0 N-CA-C 109.222 -0.659 . . . . 0.0 109.222 176.99 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.466 ' HA ' ' CD1' ' A' ' 17' ' ' PHE . 13.0 tp -65.77 -44.48 85.71 Favored 'General case' 0 N--CA 1.452 -0.367 0 N-CA-C 109.3 -0.63 . . . . 0.0 109.3 179.366 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 67.7 mm-40 -62.48 -29.65 70.69 Favored 'General case' 0 N--CA 1.45 -0.458 0 C-N-CA 124.304 1.042 . . . . 0.0 109.446 177.591 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 40.8 t -69.13 -28.44 66.45 Favored 'General case' 0 N--CA 1.451 -0.392 0 CA-C-O 119.052 -0.499 . . . . 0.0 110.147 177.52 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 17' ' ' PHE . . . . . 0.532 ' CD1' HD11 ' A' ' 68' ' ' ILE . 29.2 m-85 -71.98 -36.67 69.86 Favored 'General case' 0 C--N 1.339 0.115 0 CA-C-N 118.693 0.679 . . . . 0.0 110.824 171.979 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 80.6 mttt -63.25 -24.21 67.77 Favored 'General case' 0 C--N 1.339 0.144 0 N-CA-C 110.169 -0.308 . . . . 0.0 110.169 177.429 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 30.1 t0 -76.59 -16.76 59.5 Favored 'General case' 0 CA--C 1.538 0.505 0 N-CA-C 112.466 0.543 . . . . 0.0 112.466 176.697 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 20' ' ' LEU . . . . . 0.505 HD22 ' HA ' ' B' 2053 ' ' ASP . 10.1 mt -85.44 161.08 19.56 Favored 'General case' 0 N--CA 1.457 -0.107 0 CA-C-N 118.728 0.694 . . . . 0.0 111.983 -174.043 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 21' ' ' LYS . . . . . 0.51 ' HE3' ' N ' ' A' ' 21' ' ' LYS . 0.8 OUTLIER -82.64 -36.59 25.9 Favored 'General case' 0 N--CA 1.454 -0.229 0 N-CA-C 108.803 -0.814 . . . . 0.0 108.803 176.797 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 35.9 t -90.16 -24.77 20.96 Favored 'General case' 0 C--N 1.341 0.231 0 C-N-CA 124.034 0.934 . . . . 0.0 111.648 -179.791 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 77.7 -10.52 24.14 Favored Glycine 0 CA--C 1.532 1.146 0 CA-C-O 119.675 -0.514 . . . . 0.0 111.896 -177.372 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 70.0 mt -96.05 148.93 4.93 Favored 'Isoleucine or valine' 0 C--N 1.34 0.188 0 CA-C-N 117.507 0.654 . . . . 0.0 111.155 178.447 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 19.1 t -167.68 100.82 0.48 Allowed 'General case' 0 CA--C 1.518 -0.252 0 N-CA-C 108.777 -0.823 . . . . 0.0 108.777 176.177 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -54.67 -45.62 77.68 Favored Glycine 0 CA--C 1.527 0.8 0 C-N-CA 120.861 -0.685 . . . . 0.0 112.025 -175.106 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 8.9 m -64.51 -42.72 95.64 Favored 'General case' 0 N--CA 1.456 -0.135 0 CA-C-N 118.232 1.016 . . . . 0.0 111.349 -177.327 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 28.7 mtt180 -74.63 -39.12 62.32 Favored 'General case' 0 N--CA 1.453 -0.281 0 CA-C-N 118.231 0.468 . . . . 0.0 110.083 -177.821 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 69.8 mt -58.95 -45.23 92.12 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.607 0 N-CA-C 109.045 -0.724 . . . . 0.0 109.045 174.516 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 50.4 mtmt -69.18 -25.04 64.14 Favored 'General case' 0 C--O 1.231 0.092 0 CA-C-O 119.069 -0.491 . . . . 0.0 111.403 -179.994 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 31' ' ' LYS . . . . . 0.466 ' CE ' ' HA ' ' A' ' 31' ' ' LYS . 3.1 mmpt? -66.22 -55.95 13.71 Favored 'General case' 0 N--CA 1.455 -0.203 0 CA-C-N 118.662 0.665 . . . . 0.0 110.14 177.856 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.473 HD12 ' N ' ' A' ' 33' ' ' THR . 1.6 pp -75.43 -17.64 60.11 Favored 'General case' 0 CA--C 1.53 0.207 0 C-N-CA 119.165 -1.014 . . . . 0.0 111.554 -179.613 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 33' ' ' THR . . . . . 0.473 ' N ' HD12 ' A' ' 32' ' ' LEU . 29.8 m -73.03 -41.6 64.06 Favored 'General case' 0 C--N 1.341 0.201 0 N-CA-C 108.926 -0.768 . . . . 0.0 108.926 176.378 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 97.0 m -69.59 -37.92 77.12 Favored 'General case' 0 N--CA 1.449 -0.499 0 N-CA-C 110.414 -0.217 . . . . 0.0 110.414 -178.36 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 14.8 t80 -62.92 -40.12 96.64 Favored 'General case' 0 N--CA 1.455 -0.216 0 N-CA-C 110.103 -0.332 . . . . 0.0 110.103 175.576 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -70.92 -31.95 68.72 Favored 'General case' 0 N--CA 1.45 -0.455 0 C-N-CA 122.337 0.255 . . . . 0.0 111.148 179.954 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.455 HD21 ' HB1' ' A' ' 75' ' ' ALA . 20.1 mt -71.34 -40.08 70.94 Favored 'General case' 0 N--CA 1.453 -0.296 0 C-N-CA 122.618 0.367 . . . . 0.0 110.733 179.844 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 42.6 t0 -65.55 -23.41 66.86 Favored 'General case' 0 N--CA 1.453 -0.285 0 CA-C-N 116.463 -0.335 . . . . 0.0 110.847 177.037 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 98.1 m-70 -149.27 98.39 2.8 Favored 'General case' 0 N--CA 1.452 -0.336 0 CA-C-O 121.071 0.462 . . . . 0.0 111.651 -175.96 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 40' ' ' ILE . . . . . 0.628 ' H ' HD13 ' A' ' 40' ' ' ILE . 0.0 OUTLIER -76.59 -10.54 13.35 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.368 0 C-N-CA 122.847 0.459 . . . . 0.0 110.357 175.385 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 8.0 m-20 -57.42 -23.99 52.83 Favored 'General case' 0 N--CA 1.455 -0.18 0 C-N-CA 123.0 0.52 . . . . 0.0 111.66 -178.322 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 42' ' ' ILE . . . . . 0.479 ' HB ' ' HE2' ' A' ' 45' ' ' LYS . 0.0 OUTLIER -101.92 15.77 5.07 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.244 0 C-N-CA 122.877 0.471 . . . . 0.0 112.163 177.999 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 3.0 pp20? -52.43 -29.64 25.42 Favored 'General case' 0 CA--C 1.531 0.247 0 CA-C-N 119.067 0.849 . . . . 0.0 110.812 179.262 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 39.5 t -62.0 -52.61 63.31 Favored 'General case' 0 C--O 1.234 0.28 0 N-CA-C 112.028 0.381 . . . . 0.0 112.028 -178.706 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 45' ' ' LYS . . . . . 0.479 ' HE2' ' HB ' ' A' ' 42' ' ' ILE . 17.7 pttt -68.43 -25.89 65.25 Favored 'General case' 0 C--N 1.34 0.184 0 CA-C-N 118.245 0.475 . . . . 0.0 109.924 179.897 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 87.0 mt -73.28 -45.8 51.89 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.493 0 C-N-CA 122.649 0.38 . . . . 0.0 110.425 -176.656 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 34.2 mm -64.89 -34.7 72.17 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.215 0 N-CA-C 109.584 -0.525 . . . . 0.0 109.584 177.84 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 23.3 t -63.78 -46.84 83.42 Favored 'General case' 0 C--O 1.227 -0.09 0 C-N-CA 119.968 -0.693 . . . . 0.0 110.367 177.708 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 6.6 mp -66.65 -30.65 70.96 Favored 'General case' 0 N--CA 1.454 -0.273 0 CA-C-O 118.635 -0.698 . . . . 0.0 112.317 -175.135 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 20.3 pt -71.93 -42.76 68.88 Favored 'Isoleucine or valine' 0 C--N 1.34 0.192 0 CA-C-N 119.64 1.109 . . . . 0.0 110.126 176.982 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 38.0 pt -68.94 -42.33 82.27 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.239 0 C-N-CA 119.459 -0.896 . . . . 0.0 110.487 179.395 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 74.3 m-20 -62.54 -37.68 87.07 Favored 'General case' 0 N--CA 1.455 -0.201 0 CA-C-N 117.779 0.263 . . . . 0.0 110.806 179.767 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 26.8 t80 -72.79 -29.75 63.53 Favored 'General case' 0 CA--C 1.528 0.118 0 N-CA-C 110.29 -0.263 . . . . 0.0 110.29 177.211 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 37.7 m -75.28 -21.94 58.15 Favored 'General case' 0 N--CA 1.455 -0.221 0 N-CA-C 111.952 0.353 . . . . 0.0 111.952 179.532 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 22.6 mmm180 -93.95 -53.23 4.07 Favored 'General case' 0 N--CA 1.453 -0.284 0 N-CA-C 112.686 0.624 . . . . 0.0 112.686 -179.569 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 46.6 mt -74.18 -46.11 44.18 Favored 'General case' 0 C--N 1.334 -0.099 0 N-CA-C 112.507 0.558 . . . . 0.0 112.507 -170.188 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 57' ' ' CYS . . . . . 0.469 ' HB3' ' HD2' ' A' ' 58' ' ' PRO . 74.4 m -74.08 158.28 85.87 Favored Pre-proline 0 CA--C 1.535 0.382 0 C-N-CA 122.539 0.336 . . . . 0.0 111.598 -176.209 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 58' ' ' PRO . . . . . 0.469 ' HD2' ' HB3' ' A' ' 57' ' ' CYS . 91.8 Cg_endo -76.89 175.09 11.82 Favored 'Trans proline' 0 N--CA 1.453 -0.894 0 C-N-CA 125.127 3.885 . . . . 0.0 112.009 -169.46 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 35.3 p-10 -46.95 -46.33 21.41 Favored 'General case' 0 CA--C 1.528 0.115 0 C-N-CA 125.182 1.393 . . . . 0.0 113.677 -171.728 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 36.3 m -67.36 -36.3 81.1 Favored 'General case' 0 N--CA 1.453 -0.298 0 N-CA-C 109.992 -0.373 . . . . 0.0 109.992 -177.17 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 61' ' ' HIS . . . . . 0.431 ' ND1' ' HD2' ' A' ' 58' ' ' PRO . 53.6 m170 -75.41 -23.9 57.06 Favored 'General case' 0 N--CA 1.452 -0.366 0 N-CA-C 110.023 -0.362 . . . . 0.0 110.023 178.261 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 57.2 mttm -68.55 -34.42 75.8 Favored 'General case' 0 CA--C 1.528 0.107 0 N-CA-C 109.405 -0.591 . . . . 0.0 109.405 172.978 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -64.64 -44.47 90.37 Favored 'General case' 0 CA--C 1.532 0.261 0 N-CA-C 108.029 -1.1 . . . . 0.0 108.029 174.579 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -66.6 -28.45 73.75 Favored Glycine 0 C--N 1.336 0.576 0 N-CA-C 111.538 -0.625 . . . . 0.0 111.538 -179.749 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 38.7 t -69.88 -44.16 70.34 Favored 'General case' 0 N--CA 1.451 -0.401 0 CA-C-N 117.387 0.594 . . . . 0.0 110.08 177.371 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 60.6 mt -65.7 -25.04 67.14 Favored 'General case' 0 N--CA 1.453 -0.307 0 N-CA-C 109.581 -0.526 . . . . 0.0 109.581 178.781 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 1.2 m-85 -72.24 -37.67 69.08 Favored 'General case' 0 N--CA 1.454 -0.235 0 C-N-CA 122.617 0.367 . . . . 0.0 110.811 174.585 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 68' ' ' ILE . . . . . 0.532 HD11 ' CD1' ' A' ' 17' ' ' PHE . 20.2 mt -69.72 -46.76 73.84 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.317 0 N-CA-C 109.137 -0.69 . . . . 0.0 109.137 176.226 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 93.7 mt -57.6 -34.14 46.51 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.258 0 C-N-CA 123.556 0.742 . . . . 0.0 110.784 176.86 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 18.7 t70 -68.73 -43.68 75.42 Favored 'General case' 0 N--CA 1.451 -0.393 0 CA-C-N 118.123 0.419 . . . . 0.0 110.757 178.165 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 30.3 t -69.31 -56.55 7.2 Favored 'General case' 0 N--CA 1.452 -0.352 0 CA-C-N 116.401 -0.363 . . . . 0.0 110.65 -177.304 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -74.97 -31.34 25.09 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.253 0 N-CA-C 110.177 -0.305 . . . . 0.0 110.177 -176.623 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -66.42 -55.61 17.33 Favored Glycine 0 C--N 1.336 0.561 0 N-CA-C 111.214 -0.754 . . . . 0.0 111.214 -176.523 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 37.6 mtm105 -66.41 -40.84 89.82 Favored 'General case' 0 N--CA 1.452 -0.349 0 C-N-CA 120.489 -0.485 . . . . 0.0 109.934 -179.358 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 75' ' ' ALA . . . . . 0.455 ' HB1' HD21 ' A' ' 37' ' ' LEU . . . -64.48 -30.29 71.32 Favored 'General case' 0 N--CA 1.45 -0.426 0 C-N-CA 120.058 -0.657 . . . . 0.0 110.998 -177.893 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 1.3 m-30 -69.66 -46.66 65.62 Favored 'General case' 0 C--N 1.34 0.191 0 CA-C-N 118.18 0.446 . . . . 0.0 110.858 177.55 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 50.0 tp -71.82 -38.5 70.17 Favored 'General case' 0 N--CA 1.451 -0.419 0 C-N-CA 118.01 -1.476 . . . . 0.0 109.451 -179.611 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 91.1 m-20 -60.98 -47.84 84.6 Favored 'General case' 0 CA--C 1.529 0.156 0 N-CA-C 112.893 0.701 . . . . 0.0 112.893 178.548 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 21.3 mm-40 -66.84 -45.53 77.92 Favored 'General case' 0 CA--C 1.522 -0.098 0 CA-C-N 119.221 0.919 . . . . 0.0 111.342 179.877 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 80' ' ' THR . . . . . 0.416 HG21 ' HB3' ' A' ' 94' ' ' CYS . 60.0 p -65.34 -30.76 71.63 Favored 'General case' 0 N--CA 1.456 -0.142 0 C-N-CA 120.195 -0.602 . . . . 0.0 110.632 179.847 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 38.2 ttp-105 -72.15 -30.86 65.43 Favored 'General case' 0 N--CA 1.454 -0.226 0 CA-C-N 117.98 0.355 . . . . 0.0 111.631 175.415 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 17.2 m -92.34 -23.89 19.1 Favored 'General case' 0 N--CA 1.457 -0.102 0 N-CA-C 113.495 0.924 . . . . 0.0 113.495 -174.422 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 76.1 m-20 -137.71 20.48 2.88 Favored 'General case' 0 N--CA 1.455 -0.2 0 N-CA-C 113.354 0.872 . . . . 0.0 113.354 -172.454 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 42.3 t -150.63 153.34 35.49 Favored 'General case' 0 N--CA 1.456 -0.175 0 O-C-N 121.765 -0.585 . . . . 0.0 111.377 176.705 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 74.5 m-20 -85.8 167.52 15.13 Favored 'General case' 0 N--CA 1.453 -0.323 0 N-CA-C 109.427 -0.583 . . . . 0.0 109.427 175.282 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 41.6 t -68.25 152.58 45.25 Favored 'General case' 0 N--CA 1.454 -0.252 0 C-N-CA 122.332 0.253 . . . . 0.0 110.442 177.583 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 40.2 t -156.4 168.17 28.18 Favored 'General case' 0 N--CA 1.455 -0.197 0 C-N-CA 122.824 0.45 . . . . 0.0 110.43 -179.26 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 69.1 m -70.82 162.76 28.63 Favored 'General case' 0 N--CA 1.454 -0.273 0 C-N-CA 122.683 0.393 . . . . 0.0 110.188 179.284 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -66.3 104.8 1.27 Allowed 'General case' 0 N--CA 1.451 -0.393 0 N-CA-C 110.285 -0.265 . . . . 0.0 110.285 179.689 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 90' ' ' LYS . . . . . 0.504 ' HA ' ' HE3' ' A' ' 90' ' ' LYS . 0.0 OUTLIER -140.65 141.1 23.82 Favored Pre-proline 0 N--CA 1.454 -0.274 0 N-CA-C 108.729 -0.841 . . . . 0.0 108.729 178.091 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 57.5 Cg_exo -54.31 153.6 21.66 Favored 'Trans proline' 0 N--CA 1.452 -0.959 0 C-N-CA 123.036 2.491 . . . . 0.0 111.154 176.218 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 90.52 16.55 54.95 Favored Glycine 0 CA--C 1.523 0.571 0 CA-C-O 119.278 -0.735 . . . . 0.0 112.878 178.539 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 30.9 p -153.04 167.95 27.51 Favored 'General case' 0 CA--C 1.52 -0.202 0 CA-C-N 118.399 1.1 . . . . 0.0 110.591 177.864 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 94' ' ' CYS . . . . . 0.429 ' HB2' HD13 ' A' ' 98' ' ' ILE . 31.1 p -58.34 -24.3 59.33 Favored 'General case' 0 N--CA 1.451 -0.402 0 CA-C-N 115.478 -0.783 . . . . 0.0 110.27 175.561 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -60.9 -59.82 4.77 Favored 'General case' 0 N--CA 1.446 -0.638 0 N-CA-C 109.497 -0.557 . . . . 0.0 109.497 -175.722 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 72.4 t60 -73.56 -32.78 64.35 Favored 'General case' 0 N--CA 1.449 -0.492 0 N-CA-C 110.553 -0.166 . . . . 0.0 110.553 -178.92 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -66.08 -52.53 48.01 Favored 'General case' 0 N--CA 1.453 -0.323 0 N-CA-C 111.836 0.309 . . . . 0.0 111.836 -177.86 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 98' ' ' ILE . . . . . 0.429 HD13 ' HB2' ' A' ' 94' ' ' CYS . 1.8 mp -71.01 -33.87 53.3 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.146 0 O-C-N 121.916 -0.49 . . . . 0.0 109.908 -178.829 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 75.8 m-20 -68.1 -43.37 78.64 Favored 'General case' 0 N--CA 1.45 -0.429 0 CA-C-N 118.242 0.474 . . . . 0.0 111.626 179.34 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 91.3 m -68.32 -37.6 80.75 Favored 'General case' 0 N--CA 1.455 -0.221 0 CA-C-N 117.886 0.312 . . . . 0.0 110.472 -177.579 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 65.2 tp -75.81 -36.73 59.63 Favored 'General case' 0 N--CA 1.451 -0.424 0 CA-C-N 116.661 -0.245 . . . . 0.0 111.283 179.906 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -65.56 -22.78 69.99 Favored Glycine 0 CA--C 1.522 0.527 0 CA-C-O 119.67 -0.517 . . . . 0.0 112.437 -175.187 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 103' ' ' GLU . . . . . 0.44 ' HA ' ' HE3' ' A' ' 139' ' ' LYS . 17.6 mm-40 -72.68 -44.89 61.21 Favored 'General case' 0 N--CA 1.452 -0.359 0 CA-C-N 118.201 1.0 . . . . 0.0 111.873 178.138 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 25.0 m -92.1 -1.6 10.27 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.171 0 O-C-N 123.928 0.767 . . . . 0.0 112.369 -174.63 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 105' ' ' ILE . . . . . . . . . . . . . 10.1 tp -66.68 -25.15 34.15 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.167 0 CA-C-N 118.384 0.538 . . . . 0.0 110.954 -176.25 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 15.2 pt20 -71.76 -34.29 69.36 Favored 'General case' 0 N--CA 1.452 -0.345 0 CA-C-O 119.181 -0.438 . . . . 0.0 109.841 -178.631 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 57.9 mp0 -73.69 -37.96 65.05 Favored 'General case' 0 C--N 1.341 0.203 0 CA-C-N 118.929 0.786 . . . . 0.0 110.38 177.001 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 94.1 mt -71.74 -41.36 68.57 Favored 'General case' 0 N--CA 1.452 -0.343 0 CA-C-O 119.186 -0.435 . . . . 0.0 111.053 -177.568 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 81.5 mt -69.66 -55.62 9.5 Favored 'General case' 0 N--CA 1.45 -0.441 0 C-N-CA 120.494 -0.483 . . . . 0.0 110.146 179.156 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 14.2 p -49.18 -51.76 30.65 Favored 'General case' 0 CA--C 1.52 -0.181 0 CA-C-N 118.243 0.474 . . . . 0.0 111.48 -177.506 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 43.2 t0 -69.0 -31.17 69.8 Favored 'General case' 0 N--CA 1.447 -0.585 0 C-N-CA 120.897 -0.321 . . . . 0.0 110.508 -177.14 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -72.52 -31.27 65.19 Favored 'General case' 0 N--CA 1.448 -0.545 0 C-N-CA 120.822 -0.351 . . . . 0.0 110.496 178.902 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 113' ' ' ILE . . . . . . . . . . . . . 36.5 mm -66.31 -36.89 78.46 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.175 0 N-CA-C 108.317 -0.994 . . . . 0.0 108.317 176.375 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -74.56 -40.08 61.9 Favored 'General case' 0 N--CA 1.454 -0.26 0 N-CA-C 112.205 0.446 . . . . 0.0 112.205 177.92 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -77.24 -36.46 54.54 Favored 'General case' 0 C--N 1.339 0.123 0 N-CA-C 112.531 0.567 . . . . 0.0 112.531 -175.536 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 116' ' ' SER . . . . . 0.516 ' HB2' ' CB ' ' A' ' 120' ' ' HIS . 83.8 p -79.38 153.74 29.52 Favored 'General case' 0 N--CA 1.454 -0.246 0 N-CA-C 112.991 0.737 . . . . 0.0 112.991 -170.952 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 47.2 t30 -75.62 167.43 21.9 Favored 'General case' 0 C--O 1.225 -0.22 0 C-N-CA 123.772 0.829 . . . . 0.0 110.251 -178.611 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 118' ' ' GLN . . . . . . . . . . . . . 59.8 mt-30 -45.87 -55.67 6.38 Favored 'General case' 0 C--N 1.34 0.187 0 C-N-CA 123.478 0.711 . . . . 0.0 111.542 -174.438 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 3.9 p30 -63.15 -36.88 85.1 Favored 'General case' 0 C--O 1.232 0.143 0 C-N-CA 122.778 0.431 . . . . 0.0 110.95 -177.341 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 120' ' ' HIS . . . . . 0.516 ' CB ' ' HB2' ' A' ' 116' ' ' SER . 34.0 m170 -64.93 -39.04 92.9 Favored 'General case' 0 N--CA 1.449 -0.501 0 CA-C-O 119.168 -0.444 . . . . 0.0 110.14 176.441 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 57.6 mttm -57.54 -46.88 83.36 Favored 'General case' 0 C--N 1.342 0.271 0 N-CA-C 109.329 -0.619 . . . . 0.0 109.329 179.285 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 40.1 mm-40 -64.22 -40.53 96.23 Favored 'General case' 0 N--CA 1.452 -0.354 0 C-N-CA 122.397 0.279 . . . . 0.0 111.605 -177.022 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 63.5 mttm -64.35 -29.34 70.41 Favored 'General case' 0 N--CA 1.453 -0.277 0 C-N-CA 120.342 -0.543 . . . . 0.0 110.39 179.594 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 124' ' ' ILE . . . . . . . . . . . . . 51.8 mt -75.77 -33.13 25.3 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.218 0 N-CA-C 109.874 -0.417 . . . . 0.0 109.874 176.0 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 11.3 mmm180 -66.44 -39.06 88.67 Favored 'General case' 0 C--N 1.339 0.147 0 CA-C-N 118.135 0.425 . . . . 0.0 110.466 179.676 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 126' ' ' MET . . . . . . . . . . . . . 27.8 ptm -72.43 -33.28 66.98 Favored 'General case' 0 N--CA 1.455 -0.218 0 C-N-CA 120.314 -0.554 . . . . 0.0 109.674 177.793 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 3.3 mp -64.69 -33.96 77.17 Favored 'General case' 0 N--CA 1.455 -0.212 0 N-CA-C 109.644 -0.502 . . . . 0.0 109.644 175.042 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 31.6 tp -66.4 -42.25 88.12 Favored 'General case' 0 N--CA 1.452 -0.329 0 N-CA-C 110.077 -0.342 . . . . 0.0 110.077 179.134 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 18.0 t0 -64.7 -44.72 89.35 Favored 'General case' 0 N--CA 1.455 -0.218 0 N-CA-C 110.243 -0.281 . . . . 0.0 110.243 177.856 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 59.7 mt -58.79 -35.22 54.83 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.203 0 N-CA-C 110.238 -0.282 . . . . 0.0 110.238 -179.176 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 131' ' ' TRP . . . . . . . . . . . . . 45.6 m0 -75.43 -35.97 60.86 Favored 'General case' 0 N--CA 1.455 -0.182 0 N-CA-C 112.874 0.694 . . . . 0.0 112.874 -179.917 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 65.2 m-20 -67.39 -29.88 69.51 Favored 'General case' 0 N--CA 1.456 -0.139 0 CA-C-N 118.392 0.542 . . . . 0.0 110.112 178.206 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 133' ' ' ARG . . . . . 0.402 ' HB2' HD13 ' B' 2062 ' ' ILE . 17.8 mtp180 -74.76 -31.89 61.92 Favored 'General case' 0 N--CA 1.456 -0.158 0 C-N-CA 123.684 0.794 . . . . 0.0 110.261 175.851 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 32.1 t -75.08 -10.69 59.7 Favored 'General case' 0 CA--C 1.529 0.142 0 C-N-CA 122.928 0.491 . . . . 0.0 112.262 179.012 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 135' ' ' GLY . . . . . . . . . . . . . . . 75.27 12.73 83.36 Favored Glycine 0 CA--C 1.529 0.957 0 CA-C-O 119.472 -0.627 . . . . 0.0 112.782 178.745 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 136' ' ' LEU . . . . . . . . . . . . . 34.0 mt -62.59 146.1 52.78 Favored 'General case' 0 N--CA 1.457 -0.12 0 CA-C-N 118.051 0.926 . . . . 0.0 109.545 178.417 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 137' ' ' PHE . . . . . . . . . . . . . 7.1 m-30 -77.59 30.98 0.15 Allowed 'General case' 0 CA--C 1.53 0.191 0 C-N-CA 123.773 0.829 . . . . 0.0 112.931 -174.87 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 138' ' ' GLN . . . . . 0.432 ' C ' ' H ' ' A' ' 140' ' ' SER . 24.5 mm-40 -68.45 152.54 45.26 Favored 'General case' 0 N--CA 1.456 -0.136 0 CA-C-O 120.776 0.322 . . . . 0.0 111.312 -177.292 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 139' ' ' LYS . . . . . 0.44 ' HE3' ' HA ' ' A' ' 103' ' ' GLU . 98.8 mttt -76.58 30.08 0.13 Allowed 'General case' 0 CA--C 1.531 0.218 0 C-N-CA 123.288 0.635 . . . . 0.0 110.728 174.971 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 140' ' ' SER . . . . . 0.432 ' H ' ' C ' ' A' ' 138' ' ' GLN . 80.5 p -67.51 -0.74 4.06 Favored 'General case' 0 N--CA 1.453 -0.314 0 C-N-CA 123.913 0.885 . . . . 0.0 112.022 -176.938 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 141' ' ' TYR . . . . . . . . . . . . . 50.7 p90 -90.31 -7.72 52.64 Favored 'General case' 0 CA--C 1.535 0.39 0 CA-C-N 118.094 0.406 . . . . 0.0 111.723 176.779 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 142' ' ' LEU . . . . . . . . . . . . . 90.2 mt -82.69 148.77 27.72 Favored 'General case' 0 CA--C 1.529 0.135 0 CA-C-O 121.269 0.556 . . . . 0.0 111.857 -179.821 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 28.7 p-10 -75.11 -17.38 60.44 Favored 'General case' 0 N--CA 1.455 -0.189 0 C-N-CA 123.171 0.588 . . . . 0.0 111.041 178.746 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . -63.71 -29.73 70.92 Favored 'General case' 0 N--CA 1.453 -0.314 0 N-CA-C 110.427 -0.212 . . . . 0.0 110.427 178.336 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 145' ' ' ILE . . . . . . . . . . . . . 32.9 mm -67.6 -25.91 34.17 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.336 0 C-N-CA 122.218 0.207 . . . . 0.0 110.674 178.122 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 146' ' ' ARG . . . . . . . . . . . . . 9.4 mpt_? -79.12 -55.9 4.77 Favored 'General case' 0 N--CA 1.455 -0.182 0 N-CA-C 109.491 -0.559 . . . . 0.0 109.491 178.707 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 147' ' ' SER . . . . . . . . . . . . . 72.4 m 37.69 57.59 1.44 Allowed 'General case' 0 C--N 1.34 0.153 0 C-N-CA 123.597 0.759 . . . . 0.0 111.261 -179.874 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 148' ' ' LYS . . . . . 0.608 ' HD3' ' H ' ' A' ' 148' ' ' LYS . 0.1 OUTLIER -52.87 -17.67 1.51 Allowed 'General case' 0 CA--C 1.53 0.188 0 C-N-CA 123.754 0.821 . . . . 0.0 112.931 -175.818 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 149' ' ' CYS . . . . . . . . . . . . . 66.4 m -59.94 -34.7 73.59 Favored 'General case' 0 N--CA 1.451 -0.401 0 CA-C-N 118.225 0.466 . . . . 0.0 109.961 179.904 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 150' ' ' PHE . . . . . . . . . . . . . 18.3 m-85 -67.25 -14.45 62.93 Favored 'General case' 0 N--CA 1.453 -0.281 0 CA-C-N 117.714 0.234 . . . . 0.0 111.253 -179.721 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 151' ' ' ALA . . . . . . . . . . . . . . . -101.4 -14.73 17.45 Favored 'General case' 0 N--CA 1.454 -0.275 0 C-N-CA 123.088 0.555 . . . . 0.0 111.068 174.896 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 152' ' ' MET . . . . . . . . . . . . . 93.2 mtp -88.7 -26.41 21.83 Favored 'General case' 0 CA--C 1.528 0.106 0 C-N-CA 122.741 0.416 . . . . 0.0 111.445 173.853 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 153' ' ' ASP . . . . . . . . . . . . . 90.9 m-20 -68.34 -21.63 64.73 Favored 'General case' 0 CA--C 1.53 0.194 0 C-N-CA 123.648 0.779 . . . . 0.0 112.29 -179.522 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 154' ' ' LEU . . . . . . . . . . . . . 4.3 pp -134.27 164.35 27.59 Favored 'General case' 0 N--CA 1.447 -0.579 0 C-N-CA 123.92 0.888 . . . . 0.0 110.017 178.745 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 155' ' ' GLU . . . . . . . . . . . . . 2.1 pp20? -69.38 148.68 49.31 Favored 'General case' 0 N--CA 1.455 -0.202 0 CA-C-O 120.661 0.267 . . . . 0.0 110.825 -177.181 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 156' ' ' HIS . . . . . . . . . . . . . 14.0 t-80 -147.82 150.24 33.83 Favored 'General case' 0 N--CA 1.451 -0.394 0 N-CA-C 109.295 -0.631 . . . . 0.0 109.295 175.737 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 157' ' ' HIS . . . . . . . . . . . . . 2.8 m-70 -76.9 4.63 9.43 Favored 'General case' 0 N--CA 1.453 -0.281 0 N-CA-C 112.431 0.53 . . . . 0.0 112.431 -171.971 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 158' ' ' HIS . . . . . . . . . . . . . 7.7 p80 -105.61 2.4 28.19 Favored 'General case' 0 CA--C 1.532 0.27 0 CA-C-O 119.427 -0.321 . . . . 0.0 111.392 174.304 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 159' ' ' HIS . . . . . . . . . . . . . 46.4 m170 . . . . . 0 C--O 1.249 1.071 0 CA-C-O 116.656 -1.64 . . . . 0.0 110.117 176.165 . . . . . . . . 0 0 . 1 . 011 nuclear build full ' B' B 2052 ' ' ASP . . . . . . . . . . . . . 11.1 p-10 . . . . . 0 N--CA 1.473 0.695 0 N-CA-C 109.685 -0.487 . . . . 0.0 109.685 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' B' B 2053 ' ' ASP . . . . . 0.505 ' HA ' HD22 ' A' ' 20' ' ' LEU . 0.4 OUTLIER -73.76 138.76 44.77 Favored 'General case' 0 N--CA 1.456 -0.126 0 CA-C-O 120.923 0.392 . . . . 0.0 111.948 -177.676 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' B' B 2054 ' ' ASP . . . . . . . . . . . . . 40.8 p30 -157.34 154.62 29.26 Favored 'General case' 0 N--CA 1.452 -0.354 0 C-N-CA 123.752 0.821 . . . . 0.0 109.547 176.189 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B 2055 ' ' GLU . . . . . . . . . . . . . 60.0 tt0 44.16 41.36 4.17 Favored 'General case' 0 CA--C 1.531 0.241 0 C-N-CA 123.602 0.761 . . . . 0.0 111.718 178.382 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B 2056 ' ' ASP . . . . . . . . . . . . . 51.1 t0 -61.42 138.48 58.26 Favored 'General case' 0 N--CA 1.451 -0.403 0 N-CA-C 108.697 -0.853 . . . . 0.0 108.697 177.436 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B 2057 ' ' ASP . . . . . . . . . . . . . 56.6 t0 49.75 86.55 0.03 OUTLIER 'General case' 0 N--CA 1.455 -0.212 0 C-N-CA 124.938 1.295 . . . . 0.0 111.528 -170.045 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B 2058 ' ' TYR . . . . . . . . . . . . . 2.7 p90 -64.9 0.99 1.0 Allowed 'General case' 0 N--CA 1.455 -0.178 0 N-CA-C 112.419 0.526 . . . . 0.0 112.419 -177.929 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B 2059 ' ' THR . . . . . . . . . . . . . 60.4 m 54.23 77.86 0.42 Allowed Pre-proline 0 N--CA 1.455 -0.216 0 C-N-CA 124.362 1.065 . . . . 0.0 111.072 177.224 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B 2060 ' ' PRO . . . . . . . . . . . . . 61.3 Cg_endo -66.62 156.2 66.77 Favored 'Trans proline' 0 N--CA 1.45 -1.066 0 C-N-CA 123.43 2.753 . . . . 0.0 111.209 -179.231 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B 2061 ' ' SER . . . . . . . . . . . . . 46.0 t -152.36 154.46 35.67 Favored 'General case' 0 N--CA 1.455 -0.176 0 C-N-CA 123.231 0.612 . . . . 0.0 109.934 179.454 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B 2062 ' ' ILE . . . . . 0.402 HD13 ' HB2' ' A' ' 133' ' ' ARG . 14.2 tt -162.85 151.68 3.48 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.309 0 C-N-CA 123.122 0.569 . . . . 0.0 109.904 -176.91 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B 2063 ' ' SER . . . . . . . . . . . . . 93.1 p . . . . . 0 C--O 1.25 1.079 0 CA-C-O 117.618 -1.182 . . . . 0.0 109.282 174.334 . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 68.0 mtm . . . . . 0 N--CA 1.475 0.813 0 N-CA-C 109.854 -0.425 . . . . 0.0 109.854 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 58.1 mm-40 -97.82 -170.02 1.92 Allowed 'General case' 0 C--N 1.333 -0.131 0 N-CA-C 108.101 -1.074 . . . . 0.0 108.101 175.785 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 14.0 pt20 -63.64 -20.27 65.55 Favored 'General case' 0 CA--C 1.53 0.176 0 N-CA-C 109.426 -0.583 . . . . 0.0 109.426 174.072 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 11.8 p30 -156.18 126.28 6.53 Favored 'General case' 0 N--CA 1.449 -0.508 0 C-N-CA 124.463 1.105 . . . . 0.0 108.67 176.78 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 68.0 m-20 -90.97 17.84 7.42 Favored 'General case' 0 CA--C 1.522 -0.103 0 N-CA-C 112.998 0.74 . . . . 0.0 112.998 -177.179 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 21.2 p-10 -73.91 -29.73 62.2 Favored 'General case' 0 N--CA 1.455 -0.196 0 N-CA-C 108.549 -0.908 . . . . 0.0 108.549 178.156 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 7' ' ' PHE . . . . . 0.445 ' CD1' ' HD3' ' A' ' 45' ' ' LYS . 1.0 OUTLIER -55.35 -33.06 63.05 Favored 'General case' 0 N--CA 1.447 -0.606 0 C-N-CA 125.584 1.554 . . . . 0.0 111.462 -177.253 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 51.1 tp60 -51.8 -36.89 49.37 Favored 'General case' 0 N--CA 1.454 -0.272 0 C-N-CA 123.201 0.601 . . . . 0.0 112.21 -176.993 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 27.6 m-80 -71.29 -36.22 71.59 Favored 'General case' 0 N--CA 1.455 -0.223 0 CA-C-O 121.175 0.512 . . . . 0.0 110.016 -179.437 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 10' ' ' PHE . . . . . 0.424 ' CE2' ' HB2' ' A' ' 32' ' ' LEU . 7.1 t80 -69.96 -39.8 75.8 Favored 'General case' 0 N--CA 1.451 -0.408 0 C-N-CA 124.05 0.94 . . . . 0.0 109.349 177.139 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 83.2 t -66.17 -51.72 56.2 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.493 0 N-CA-C 109.042 -0.725 . . . . 0.0 109.042 179.693 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -59.45 -32.12 69.93 Favored 'General case' 0 CA--C 1.53 0.175 0 C-N-CA 122.508 0.323 . . . . 0.0 111.381 -179.422 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 85.5 m -71.55 -39.53 70.62 Favored 'General case' 0 CA--C 1.531 0.246 0 N-CA-C 109.025 -0.732 . . . . 0.0 109.025 176.484 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.552 ' HA ' ' CD1' ' A' ' 17' ' ' PHE . 4.9 tp -64.84 -42.15 95.14 Favored 'General case' 0 N--CA 1.45 -0.471 0 CA-C-O 121.215 0.531 . . . . 0.0 110.208 178.624 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 69.0 mm-40 -63.83 -28.06 69.6 Favored 'General case' 0 N--CA 1.45 -0.469 0 C-N-CA 124.762 1.225 . . . . 0.0 109.337 178.09 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 43.6 t -70.23 -27.35 64.4 Favored 'General case' 0 N--CA 1.449 -0.516 0 N-CA-C 110.417 -0.216 . . . . 0.0 110.417 174.942 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 17' ' ' PHE . . . . . 0.582 ' CE1' HD11 ' A' ' 68' ' ' ILE . 21.8 m-85 -71.42 -41.1 69.95 Favored 'General case' 0 C--N 1.338 0.108 0 C-N-CA 119.335 -0.946 . . . . 0.0 110.879 170.441 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 18' ' ' LYS . . . . . 0.529 ' HG2' ' CE1' ' A' ' 53' ' ' TYR . 65.9 mttt -60.62 -25.55 66.36 Favored 'General case' 0 C--N 1.34 0.19 0 CA-C-N 118.138 0.426 . . . . 0.0 111.008 175.799 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 10.6 t0 -72.47 -47.06 51.78 Favored 'General case' 0 C--N 1.331 -0.22 0 C-N-CA 123.231 0.612 . . . . 0.0 110.26 178.784 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 63.3 mt -66.78 136.31 55.28 Favored 'General case' 0 N--CA 1.453 -0.306 0 CA-C-O 120.967 0.413 . . . . 0.0 110.405 -178.769 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 1.2 mppt? -75.3 -24.24 57.46 Favored 'General case' 0 N--CA 1.454 -0.236 0 N-CA-C 109.105 -0.702 . . . . 0.0 109.105 177.35 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 80.7 p -80.94 -23.4 38.87 Favored 'General case' 0 N--CA 1.457 -0.119 0 C-N-CA 123.773 0.829 . . . . 0.0 110.391 175.845 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 72.35 -33.73 0.67 Allowed Glycine 0 CA--C 1.526 0.728 0 C-N-CA 124.846 1.212 . . . . 0.0 112.938 178.239 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 63.0 mt -76.16 147.38 7.89 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.333 0 CA-C-N 117.528 0.664 . . . . 0.0 110.109 178.112 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 32.9 t -162.37 94.2 0.88 Allowed 'General case' 0 N--CA 1.455 -0.198 0 N-CA-C 109.058 -0.719 . . . . 0.0 109.058 171.67 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 26' ' ' GLY . . . . . 0.429 ' O ' ' HE2' ' A' ' 30' ' ' LYS . . . -55.28 -38.33 67.95 Favored Glycine 0 CA--C 1.524 0.613 0 C-N-CA 121.12 -0.562 . . . . 0.0 111.91 -172.426 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 27' ' ' SER . . . . . 0.524 ' H ' ' HB2' ' B' 2055 ' ' GLU . 74.7 p -71.71 -48.66 45.69 Favored 'General case' 0 N--CA 1.452 -0.354 0 CA-C-N 118.21 1.005 . . . . 0.0 110.898 -177.196 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 28' ' ' ARG . . . . . 0.407 HH12 ' CG ' ' B' 2054 ' ' ASP . 71.5 mmt-85 -65.53 -38.56 90.0 Favored 'General case' 0 C--O 1.233 0.2 0 N-CA-C 109.617 -0.512 . . . . 0.0 109.617 -179.637 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 47.9 mt -59.96 -44.41 94.49 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.814 0 N-CA-C 108.71 -0.848 . . . . 0.0 108.71 176.06 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 30' ' ' LYS . . . . . 0.432 ' HE3' ' HA ' ' A' ' 27' ' ' SER . 49.2 mtmt -66.17 -25.79 67.12 Favored 'General case' 0 C--N 1.34 0.166 0 CA-C-O 118.727 -0.654 . . . . 0.0 111.562 177.635 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 31' ' ' LYS . . . . . 0.565 ' HE2' ' HA ' ' A' ' 31' ' ' LYS . 8.9 mmpt? -66.88 -57.97 5.93 Favored 'General case' 0 C--N 1.341 0.214 0 CA-C-N 119.433 1.015 . . . . 0.0 109.95 179.435 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.528 HD12 ' N ' ' A' ' 33' ' ' THR . 1.4 pp -75.1 -20.07 59.64 Favored 'General case' 0 CA--C 1.53 0.194 0 C-N-CA 118.929 -1.109 . . . . 0.0 111.917 -176.782 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 33' ' ' THR . . . . . 0.528 ' N ' HD12 ' A' ' 32' ' ' LEU . 54.3 m -71.16 -38.28 72.2 Favored 'General case' 0 N--CA 1.452 -0.366 0 N-CA-C 108.626 -0.879 . . . . 0.0 108.626 175.548 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 63.8 m -69.76 -37.37 76.4 Favored 'General case' 0 N--CA 1.45 -0.431 0 N-CA-C 110.032 -0.358 . . . . 0.0 110.032 -178.949 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 72.8 t80 -67.39 -33.81 75.96 Favored 'General case' 0 N--CA 1.455 -0.18 0 C-N-CA 120.279 -0.569 . . . . 0.0 110.248 177.42 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -69.47 -37.11 77.13 Favored 'General case' 0 N--CA 1.45 -0.472 0 CA-C-N 116.627 -0.261 . . . . 0.0 110.588 178.207 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 2.9 mm? -71.23 -34.5 70.84 Favored 'General case' 0 N--CA 1.456 -0.154 0 C-N-CA 122.478 0.311 . . . . 0.0 110.227 179.781 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 45.5 t0 -67.17 -26.49 66.67 Favored 'General case' 0 N--CA 1.453 -0.297 0 C-N-CA 122.315 0.246 . . . . 0.0 110.475 176.289 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 39' ' ' HIS . . . . . 0.403 ' HB2' HD11 ' A' ' 42' ' ' ILE . 97.1 m-70 -149.0 100.29 3.05 Favored 'General case' 0 C--N 1.341 0.197 0 N-CA-C 111.82 0.304 . . . . 0.0 111.82 -175.737 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 40' ' ' ILE . . . . . 0.621 ' H ' HD13 ' A' ' 40' ' ' ILE . 0.0 OUTLIER -75.65 -13.49 15.06 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.488 0 CA-C-O 119.158 -0.449 . . . . 0.0 110.061 174.116 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 32.6 m-20 -58.15 -16.68 14.29 Favored 'General case' 0 CA--C 1.532 0.286 0 C-N-CA 123.124 0.57 . . . . 0.0 112.11 -176.07 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 42' ' ' ILE . . . . . 0.403 HD11 ' HB2' ' A' ' 39' ' ' HIS . 0.0 OUTLIER -113.65 19.17 7.24 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.177 0 C-N-CA 123.41 0.684 . . . . 0.0 111.834 176.903 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 2.9 pp20? -54.02 -28.84 40.8 Favored 'General case' 0 C--N 1.339 0.131 0 O-C-N 121.544 -0.722 . . . . 0.0 111.693 179.175 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 3.9 m -67.31 -44.04 80.14 Favored 'General case' 0 N--CA 1.454 -0.231 0 O-C-N 121.962 -0.461 . . . . 0.0 111.518 -176.662 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 45' ' ' LYS . . . . . 0.445 ' HD3' ' CD1' ' A' ' 7' ' ' PHE . 16.6 ptpt -73.73 -27.47 61.2 Favored 'General case' 0 C--N 1.341 0.206 0 CA-C-N 118.699 0.681 . . . . 0.0 109.789 177.56 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 64.0 mt -71.45 -53.88 19.26 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.274 0 C-N-CA 123.102 0.561 . . . . 0.0 110.721 -178.29 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 34.0 mm -68.18 -39.82 81.84 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.351 0 C-N-CA 122.381 0.272 . . . . 0.0 110.313 -176.49 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 66.0 p -68.15 -33.55 74.68 Favored 'General case' 0 N--CA 1.452 -0.347 0 C-N-CA 120.219 -0.592 . . . . 0.0 110.54 179.922 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 48.4 tp -75.21 -35.13 61.52 Favored 'General case' 0 N--CA 1.453 -0.286 0 N-CA-C 113.033 0.753 . . . . 0.0 113.033 -177.823 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 50' ' ' ILE . . . . . 0.443 HD12 HG12 ' A' ' 69' ' ' ILE . 3.4 pt -73.06 -42.61 59.21 Favored 'Isoleucine or valine' 0 CA--C 1.526 0.041 0 CA-C-N 118.788 0.722 . . . . 0.0 111.137 179.311 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 21.8 pt -65.79 -39.17 84.01 Favored 'Isoleucine or valine' 0 CA--C 1.528 0.112 0 C-N-CA 119.649 -0.821 . . . . 0.0 110.708 177.707 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 84.8 m-20 -68.79 -35.44 77.04 Favored 'General case' 0 N--CA 1.453 -0.325 0 CA-C-N 118.248 0.476 . . . . 0.0 111.279 177.901 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 53' ' ' TYR . . . . . 0.529 ' CE1' ' HG2' ' A' ' 18' ' ' LYS . 7.7 t80 -62.02 -45.33 94.04 Favored 'General case' 0 N--CA 1.453 -0.301 0 N-CA-C 108.501 -0.926 . . . . 0.0 108.501 174.781 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 20.5 m -63.27 -33.93 76.58 Favored 'General case' 0 N--CA 1.454 -0.232 0 C-N-CA 123.258 0.623 . . . . 0.0 111.99 -175.193 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 64.6 mtm180 -79.0 -42.65 26.1 Favored 'General case' 0 N--CA 1.455 -0.201 0 N-CA-C 111.883 0.327 . . . . 0.0 111.883 -176.685 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 45.2 mt -77.47 -43.29 32.81 Favored 'General case' 0 N--CA 1.457 -0.08 0 N-CA-C 112.309 0.485 . . . . 0.0 112.309 -177.743 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 57' ' ' CYS . . . . . 0.461 ' HB2' ' HD2' ' A' ' 58' ' ' PRO . 10.6 p -67.49 161.42 65.37 Favored Pre-proline 0 CA--C 1.532 0.264 0 N-CA-C 113.049 0.759 . . . . 0.0 113.049 -173.489 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 58' ' ' PRO . . . . . 0.461 ' HD2' ' HB2' ' A' ' 57' ' ' CYS . 86.3 Cg_endo -72.89 179.25 5.5 Favored 'Trans proline' 0 N--CA 1.454 -0.823 0 C-N-CA 124.249 3.299 . . . . 0.0 110.59 174.614 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 59' ' ' ASP . . . . . 0.493 ' CG ' ' HA ' ' A' ' 116' ' ' SER . 49.9 t0 -55.37 -52.52 63.24 Favored 'General case' 0 N--CA 1.453 -0.311 0 N-CA-C 113.958 1.095 . . . . 0.0 113.958 -173.479 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 97.4 p -63.4 -39.61 94.96 Favored 'General case' 0 C--O 1.231 0.131 0 CA-C-N 119.091 0.86 . . . . 0.0 110.545 -174.297 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 49.6 m170 -66.11 -34.71 78.67 Favored 'General case' 0 N--CA 1.452 -0.348 0 N-CA-C 109.666 -0.494 . . . . 0.0 109.666 175.54 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 62' ' ' LYS . . . . . 0.599 ' HE3' HD11 ' A' ' 124' ' ' ILE . 0.0 OUTLIER -72.36 -32.1 66.18 Favored 'General case' 0 N--CA 1.453 -0.283 0 C-N-CA 122.893 0.477 . . . . 0.0 111.954 -178.464 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 1.7 tm? -75.29 -35.11 61.34 Favored 'General case' 0 CA--C 1.532 0.276 0 N-CA-C 107.783 -1.192 . . . . 0.0 107.783 178.699 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -71.49 -31.64 65.42 Favored Glycine 0 CA--C 1.526 0.77 0 N-CA-C 111.601 -0.6 . . . . 0.0 111.601 176.449 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 65' ' ' SER . . . . . 0.453 ' HA ' HD12 ' A' ' 68' ' ' ILE . 82.6 p -71.96 -31.47 66.33 Favored 'General case' 0 N--CA 1.451 -0.401 0 O-C-N 121.822 -0.81 . . . . 0.0 109.882 177.797 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 76.8 mt -75.05 -25.08 58.4 Favored 'General case' 0 N--CA 1.455 -0.222 0 CA-C-O 119.568 -0.253 . . . . 0.0 110.413 174.781 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 4.1 m-30 -66.5 -36.26 82.29 Favored 'General case' 0 CA--C 1.516 -0.341 0 N-CA-C 109.453 -0.573 . . . . 0.0 109.453 172.465 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 68' ' ' ILE . . . . . 0.582 HD11 ' CE1' ' A' ' 17' ' ' PHE . 41.0 mt -68.32 -55.82 14.86 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.567 0 N-CA-C 108.758 -0.83 . . . . 0.0 108.758 178.03 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 69' ' ' ILE . . . . . 0.443 HG12 HD12 ' A' ' 50' ' ' ILE . 61.9 mt -47.87 -37.67 6.45 Favored 'Isoleucine or valine' 0 C--N 1.343 0.297 0 C-N-CA 124.089 0.956 . . . . 0.0 111.742 176.016 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 15.4 t70 -70.4 -44.07 68.73 Favored 'General case' 0 C--O 1.233 0.203 0 CA-C-N 118.557 0.617 . . . . 0.0 110.881 178.976 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 20.4 m -68.97 -52.32 30.2 Favored 'General case' 0 N--CA 1.455 -0.183 0 N-CA-C 110.202 -0.296 . . . . 0.0 110.202 -175.46 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 72' ' ' ILE . . . . . 0.476 HD11 ' CZ ' ' A' ' 76' ' ' TYR . 0.0 OUTLIER -73.97 -31.04 29.28 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.403 0 N-CA-C 109.68 -0.489 . . . . 0.0 109.68 -176.403 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -68.76 -53.84 17.87 Favored Glycine 0 C--N 1.338 0.694 0 N-CA-C 111.695 -0.562 . . . . 0.0 111.695 -175.458 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 37.8 mtm105 -68.5 -39.5 81.24 Favored 'General case' 0 N--CA 1.452 -0.335 0 C-N-CA 120.672 -0.411 . . . . 0.0 110.157 179.844 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -65.26 -30.9 71.81 Favored 'General case' 0 N--CA 1.451 -0.386 0 C-N-CA 120.457 -0.497 . . . . 0.0 110.755 -179.183 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 76' ' ' TYR . . . . . 0.476 ' CZ ' HD11 ' A' ' 72' ' ' ILE . 1.4 m-30 -68.23 -48.06 66.14 Favored 'General case' 0 CA--C 1.517 -0.318 0 CA-C-N 118.225 0.466 . . . . 0.0 110.779 176.358 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 51.3 tp -68.59 -37.25 79.69 Favored 'General case' 0 N--CA 1.448 -0.534 0 C-N-CA 118.617 -1.233 . . . . 0.0 110.021 -177.669 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 96.5 m-20 -67.87 -40.27 83.61 Favored 'General case' 0 C--N 1.333 -0.139 0 N-CA-C 113.273 0.842 . . . . 0.0 113.273 -179.584 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 13.6 mm-40 -65.8 -48.37 71.97 Favored 'General case' 0 N--CA 1.456 -0.175 0 C-N-CA 119.917 -0.713 . . . . 0.0 110.336 174.06 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 80' ' ' THR . . . . . 0.447 HG21 ' HB3' ' A' ' 94' ' ' CYS . 76.5 p -66.53 -26.86 67.35 Favored 'General case' 0 CA--C 1.529 0.145 0 CA-C-N 118.505 0.593 . . . . 0.0 111.251 -179.632 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 74.7 mtt180 -65.41 -37.75 87.88 Favored 'General case' 0 C--N 1.338 0.067 0 C-N-CA 122.717 0.407 . . . . 0.0 110.393 170.858 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 20.7 m -79.82 -41.95 25.36 Favored 'General case' 0 N--CA 1.452 -0.326 0 N-CA-C 112.07 0.396 . . . . 0.0 112.07 -176.645 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -167.22 155.84 9.86 Favored 'General case' 0 C--O 1.226 -0.164 0 C-N-CA 122.858 0.463 . . . . 0.0 110.974 -177.171 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 78.9 p -84.39 94.63 8.54 Favored 'General case' 0 N--CA 1.454 -0.265 0 N-CA-C 109.094 -0.706 . . . . 0.0 109.094 175.241 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 2.0 m120 -69.0 -13.94 62.75 Favored 'General case' 0 CA--C 1.532 0.278 0 C-N-CA 122.361 0.264 . . . . 0.0 111.583 -179.431 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 45.7 t -160.8 173.16 15.78 Favored 'General case' 0 N--CA 1.453 -0.28 0 C-N-CA 123.425 0.69 . . . . 0.0 109.487 -179.699 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 26.6 m -144.61 145.72 31.93 Favored 'General case' 0 N--CA 1.455 -0.183 0 C-N-CA 123.252 0.621 . . . . 0.0 109.941 -179.428 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 35.1 t -163.86 168.32 19.66 Favored 'General case' 0 N--CA 1.453 -0.275 0 C-N-CA 122.608 0.363 . . . . 0.0 110.263 -176.238 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 7.5 m120 -69.15 -34.86 75.66 Favored 'General case' 0 N--CA 1.454 -0.263 0 C-N-CA 122.462 0.305 . . . . 0.0 111.707 -178.312 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 90' ' ' LYS . . . . . 0.411 ' HB3' ' CD ' ' A' ' 91' ' ' PRO . 29.9 tptp -161.32 -64.28 0.02 OUTLIER Pre-proline 0 CA--C 1.535 0.379 0 CA-C-O 118.265 -0.874 . . . . 0.0 111.7 176.013 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 91' ' ' PRO . . . . . 0.411 ' CD ' ' HB3' ' A' ' 90' ' ' LYS . 91.0 Cg_endo -71.77 159.72 49.95 Favored 'Trans proline' 0 N--CA 1.454 -0.83 0 C-N-CA 122.527 2.152 . . . . 0.0 108.951 176.913 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 92' ' ' GLY . . . . . 0.413 ' HA2' ' O ' ' A' ' 40' ' ' ILE . . . 97.73 16.65 33.09 Favored Glycine 0 CA--C 1.527 0.842 0 CA-C-O 119.507 -0.607 . . . . 0.0 113.793 179.944 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 21.9 p -152.22 169.36 22.66 Favored 'General case' 0 C--O 1.231 0.099 0 CA-C-N 118.14 0.97 . . . . 0.0 110.508 178.179 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 94' ' ' CYS . . . . . 0.478 ' HB2' HD13 ' A' ' 98' ' ' ILE . 30.0 p -57.8 -23.24 51.52 Favored 'General case' 0 N--CA 1.449 -0.514 0 CA-C-N 115.956 -0.565 . . . . 0.0 109.64 175.88 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -60.38 -55.84 28.68 Favored 'General case' 0 N--CA 1.446 -0.659 0 N-CA-C 109.358 -0.608 . . . . 0.0 109.358 -178.013 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 53.9 t60 -76.06 -29.5 58.04 Favored 'General case' 0 N--CA 1.451 -0.401 0 N-CA-C 111.608 0.225 . . . . 0.0 111.608 179.997 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -67.58 -49.46 63.04 Favored 'General case' 0 N--CA 1.448 -0.528 0 N-CA-C 110.493 -0.188 . . . . 0.0 110.493 -178.596 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 98' ' ' ILE . . . . . 0.478 HD13 ' HB2' ' A' ' 94' ' ' CYS . 2.1 mp -72.47 -26.84 24.83 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.313 0 C-N-CA 120.546 -0.461 . . . . 0.0 110.062 178.78 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 3.7 m120 -63.69 -45.0 92.02 Favored 'General case' 0 N--CA 1.454 -0.264 0 CA-C-N 118.912 0.778 . . . . 0.0 110.193 173.251 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 85.0 m -65.04 -35.5 81.38 Favored 'General case' 0 N--CA 1.455 -0.189 0 C-N-CA 122.705 0.402 . . . . 0.0 110.967 -176.395 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 93.3 mt -75.74 -35.36 60.24 Favored 'General case' 0 N--CA 1.448 -0.559 0 N-CA-C 110.501 -0.185 . . . . 0.0 110.501 176.461 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -75.44 -30.23 58.73 Favored Glycine 0 CA--C 1.527 0.813 0 CA-C-O 119.785 -0.453 . . . . 0.0 112.941 -175.843 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 25.8 pt-20 -75.99 -6.11 49.43 Favored 'General case' 0 CA--C 1.53 0.183 0 CA-C-N 117.856 0.828 . . . . 0.0 111.926 -177.348 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 27.0 m -140.17 21.04 0.56 Allowed 'Isoleucine or valine' 0 CA--C 1.531 0.218 0 CA-C-N 118.102 0.41 . . . . 0.0 111.064 175.524 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 105' ' ' ILE . . . . . . . . . . . . . 10.0 tp -62.05 -39.21 82.95 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.288 0 CA-C-N 118.033 0.379 . . . . 0.0 111.768 -173.958 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 13.3 pt20 -73.86 -31.08 63.0 Favored 'General case' 0 N--CA 1.454 -0.228 0 O-C-N 122.009 -0.432 . . . . 0.0 110.19 -179.421 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 58.7 mm-40 -76.11 -41.42 50.28 Favored 'General case' 0 N--CA 1.454 -0.258 0 CA-C-N 117.743 0.247 . . . . 0.0 110.467 -179.863 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 65.7 tp -70.32 -38.49 74.94 Favored 'General case' 0 N--CA 1.45 -0.463 0 C-N-CA 122.657 0.383 . . . . 0.0 110.61 -177.775 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 88.5 mt -73.44 -42.51 61.9 Favored 'General case' 0 N--CA 1.453 -0.31 0 C-N-CA 120.692 -0.403 . . . . 0.0 110.16 177.386 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 45.6 t -58.07 -43.96 87.26 Favored 'General case' 0 N--CA 1.456 -0.129 0 CA-C-N 118.187 0.449 . . . . 0.0 110.465 178.753 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 55.0 t0 -64.48 -39.72 94.33 Favored 'General case' 0 N--CA 1.453 -0.299 0 N-CA-C 108.682 -0.859 . . . . 0.0 108.682 175.59 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 112' ' ' ALA . . . . . 0.428 ' HA ' ' HD2' ' A' ' 62' ' ' LYS . . . -66.39 -38.32 87.26 Favored 'General case' 0 N--CA 1.444 -0.742 0 N-CA-C 112.202 0.445 . . . . 0.0 112.202 -175.89 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 113' ' ' ILE . . . . . 0.451 HG22 ' HE3' ' A' ' 121' ' ' LYS . 9.3 mm -71.83 -38.99 67.26 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.287 0 CA-C-N 118.462 0.574 . . . . 0.0 109.809 179.816 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -71.26 -35.44 71.4 Favored 'General case' 0 CA--C 1.531 0.23 0 N-CA-C 112.247 0.462 . . . . 0.0 112.247 178.916 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 5.2 tppp? -74.15 -32.91 63.33 Favored 'General case' 0 N--CA 1.456 -0.141 0 C-N-CA 123.004 0.522 . . . . 0.0 110.779 178.436 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 116' ' ' SER . . . . . 0.493 ' HA ' ' CG ' ' A' ' 59' ' ' ASP . 94.4 p -90.93 142.86 27.32 Favored 'General case' 0 N--CA 1.452 -0.37 0 N-CA-C 113.188 0.811 . . . . 0.0 113.188 -169.972 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 14.0 t-20 -76.82 170.53 16.3 Favored 'General case' 0 N--CA 1.454 -0.23 0 N-CA-C 109.013 -0.736 . . . . 0.0 109.013 173.456 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 118' ' ' GLN . . . . . . . . . . . . . 13.9 mm100 -58.88 -32.2 69.27 Favored 'General case' 0 CA--C 1.528 0.097 0 N-CA-C 112.489 0.551 . . . . 0.0 112.489 -170.859 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 10.5 t0 -63.22 -51.81 64.78 Favored 'General case' 0 C--O 1.233 0.221 0 CA-C-O 121.508 0.671 . . . . 0.0 109.257 175.572 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 120' ' ' HIS . . . . . 0.404 ' HB2' ' HB2' ' A' ' 116' ' ' SER . 98.5 m-70 -72.83 -25.44 61.13 Favored 'General case' 0 N--CA 1.447 -0.595 0 CA-C-N 116.046 -0.524 . . . . 0.0 111.098 -177.555 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 121' ' ' LYS . . . . . 0.451 ' HE3' HG22 ' A' ' 113' ' ' ILE . 56.3 mttp -61.44 -44.65 96.75 Favored 'General case' 0 C--N 1.338 0.073 0 N-CA-C 108.973 -0.751 . . . . 0.0 108.973 172.012 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 41.0 tp10 -67.63 -35.78 79.56 Favored 'General case' 0 N--CA 1.454 -0.246 0 C-N-CA 122.185 0.194 . . . . 0.0 111.123 -177.223 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 43.7 mtmt -71.21 -30.23 66.12 Favored 'General case' 0 N--CA 1.454 -0.246 0 O-C-N 122.129 -0.357 . . . . 0.0 110.537 178.147 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 124' ' ' ILE . . . . . 0.599 HD11 ' HE3' ' A' ' 62' ' ' LYS . 56.4 mt -68.8 -37.69 77.78 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.195 0 N-CA-C 108.891 -0.781 . . . . 0.0 108.891 171.802 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 125' ' ' ARG . . . . . 0.422 ' HA ' ' HD2' ' A' ' 125' ' ' ARG . 6.1 mmm180 -61.5 -45.33 94.65 Favored 'General case' 0 N--CA 1.453 -0.284 0 CA-C-O 118.717 -0.659 . . . . 0.0 111.476 -179.606 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 126' ' ' MET . . . . . . . . . . . . . 28.5 ptm -64.85 -34.34 78.15 Favored 'General case' 0 N--CA 1.455 -0.176 0 C-N-CA 119.187 -1.005 . . . . 0.0 108.923 177.712 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 3.6 mp -64.41 -39.82 94.59 Favored 'General case' 0 CA--C 1.531 0.224 0 CA-C-N 118.317 0.508 . . . . 0.0 110.873 175.742 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 81.3 mt -70.23 -30.59 67.71 Favored 'General case' 0 N--CA 1.454 -0.263 0 CA-C-N 118.404 0.547 . . . . 0.0 111.191 179.755 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 48.5 m-20 -73.97 -35.86 64.52 Favored 'General case' 0 N--CA 1.456 -0.143 0 N-CA-C 109.951 -0.389 . . . . 0.0 109.951 176.102 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 60.1 mt -62.15 -35.8 70.87 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.22 0 N-CA-C 109.133 -0.691 . . . . 0.0 109.133 175.273 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 131' ' ' TRP . . . . . . . . . . . . . 43.3 m0 -73.14 -34.74 66.26 Favored 'General case' 0 N--CA 1.455 -0.21 0 N-CA-C 112.975 0.732 . . . . 0.0 112.975 179.536 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 96.0 m-20 -64.92 -35.59 81.65 Favored 'General case' 0 C--N 1.339 0.149 0 CA-C-N 118.767 0.712 . . . . 0.0 110.388 176.19 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 12.6 mtp180 -74.65 -32.02 62.14 Favored 'General case' 0 N--CA 1.456 -0.171 0 C-N-CA 122.99 0.516 . . . . 0.0 110.346 179.486 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 41.3 m -77.51 -14.65 59.62 Favored 'General case' 0 N--CA 1.452 -0.331 0 C-N-CA 123.043 0.537 . . . . 0.0 111.662 179.797 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 135' ' ' GLY . . . . . . . . . . . . . . . 66.26 15.18 62.93 Favored Glycine 0 CA--C 1.529 0.922 0 CA-C-O 119.487 -0.618 . . . . 0.0 111.571 -179.699 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 136' ' ' LEU . . . . . . . . . . . . . 3.0 tt -66.44 -52.47 46.05 Favored 'General case' 0 N--CA 1.454 -0.235 0 CA-C-N 117.826 0.813 . . . . 0.0 109.088 -178.496 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 137' ' ' PHE . . . . . . . . . . . . . 69.7 t80 -161.34 142.67 11.5 Favored 'General case' 0 N--CA 1.45 -0.447 0 N-CA-C 108.252 -1.018 . . . . 0.0 108.252 174.922 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 138' ' ' GLN . . . . . . . . . . . . . 22.6 mp0 -74.31 139.3 44.1 Favored 'General case' 0 N--CA 1.454 -0.271 0 CA-C-O 120.826 0.346 . . . . 0.0 110.749 -176.581 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 139' ' ' LYS . . . . . . . . . . . . . 4.5 ttmp? -55.44 131.05 44.99 Favored 'General case' 0 N--CA 1.452 -0.364 0 C-N-CA 123.63 0.772 . . . . 0.0 109.816 176.1 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 140' ' ' SER . . . . . . . . . . . . . 46.9 t -74.15 154.93 38.89 Favored 'General case' 0 N--CA 1.454 -0.269 0 C-N-CA 122.631 0.372 . . . . 0.0 110.211 179.447 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 141' ' ' TYR . . . . . . . . . . . . . 55.4 p90 -128.01 6.15 5.98 Favored 'General case' 0 N--CA 1.455 -0.186 0 N-CA-C 112.099 0.407 . . . . 0.0 112.099 -175.406 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 142' ' ' LEU . . . . . . . . . . . . . 10.0 mp -69.3 151.71 45.89 Favored 'General case' 0 N--CA 1.454 -0.233 0 N-CA-C 109.427 -0.582 . . . . 0.0 109.427 -179.877 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 16.2 p30 -65.43 -12.19 49.97 Favored 'General case' 0 N--CA 1.453 -0.279 0 CA-C-N 116.48 -0.327 . . . . 0.0 111.088 -179.336 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . -64.37 -38.02 89.58 Favored 'General case' 0 N--CA 1.451 -0.4 0 N-CA-C 109.128 -0.693 . . . . 0.0 109.128 174.04 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 145' ' ' ILE . . . . . . . . . . . . . 26.1 mm -68.26 -40.32 82.45 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.418 0 N-CA-C 109.124 -0.695 . . . . 0.0 109.124 176.474 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 146' ' ' ARG . . . . . . . . . . . . . 32.3 tpt180 -59.45 -29.95 68.15 Favored 'General case' 0 N--CA 1.456 -0.129 0 C-N-CA 123.002 0.521 . . . . 0.0 110.391 -177.195 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 147' ' ' SER . . . . . . . . . . . . . 17.7 m 49.15 35.95 8.15 Favored 'General case' 0 C--N 1.339 0.129 0 C-N-CA 123.187 0.595 . . . . 0.0 111.534 174.715 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 148' ' ' LYS . . . . . 0.63 ' HD3' ' H ' ' A' ' 148' ' ' LYS . 0.0 OUTLIER -40.67 -41.87 1.6 Allowed 'General case' 0 CA--C 1.531 0.227 0 C-N-CA 124.867 1.267 . . . . 0.0 113.279 -172.762 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 149' ' ' CYS . . . . . . . . . . . . . 59.7 m -70.1 -64.72 0.83 Allowed 'General case' 0 N--CA 1.454 -0.271 0 CA-C-N 118.392 0.542 . . . . 0.0 110.783 -177.97 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 150' ' ' PHE . . . . . . . . . . . . . 45.8 m-85 -62.82 -22.33 66.57 Favored 'General case' 0 N--CA 1.455 -0.223 0 N-CA-C 111.53 0.196 . . . . 0.0 111.53 -175.28 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 151' ' ' ALA . . . . . . . . . . . . . . . -75.72 -41.1 54.39 Favored 'General case' 0 N--CA 1.452 -0.344 0 C-N-CA 121.298 -0.161 . . . . 0.0 110.995 177.208 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 152' ' ' MET . . . . . . . . . . . . . 94.6 mtp -76.82 -22.74 53.17 Favored 'General case' 0 CA--C 1.529 0.152 0 N-CA-C 112.088 0.403 . . . . 0.0 112.088 178.884 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 153' ' ' ASP . . . . . . . . . . . . . 80.6 m-20 -69.61 -14.75 62.99 Favored 'General case' 0 CA--C 1.529 0.142 0 N-CA-C 112.659 0.614 . . . . 0.0 112.659 -179.813 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 154' ' ' LEU . . . . . . . . . . . . . 78.1 mt -78.24 159.27 28.6 Favored 'General case' 0 N--CA 1.456 -0.152 0 CA-C-O 121.247 0.546 . . . . 0.0 112.181 -179.305 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 155' ' ' GLU . . . . . . . . . . . . . 3.2 pm0 -72.16 -5.84 38.44 Favored 'General case' 0 N--CA 1.454 -0.247 0 C-N-CA 124.145 0.978 . . . . 0.0 112.947 -177.326 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 156' ' ' HIS . . . . . . . . . . . . . 42.1 m80 -143.59 151.36 40.09 Favored 'General case' 0 N--CA 1.454 -0.259 0 C-N-CA 123.518 0.727 . . . . 0.0 109.314 176.361 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 157' ' ' HIS . . . . . . . . . . . . . 42.7 m170 -123.64 155.06 38.45 Favored 'General case' 0 N--CA 1.455 -0.22 0 C-N-CA 123.444 0.698 . . . . 0.0 109.764 -179.06 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 158' ' ' HIS . . . . . . . . . . . . . 79.0 t60 -164.87 -22.03 0.03 OUTLIER 'General case' 0 N--CA 1.465 0.301 0 C-N-CA 123.168 0.587 . . . . 0.0 110.083 -178.016 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 159' ' ' HIS . . . . . . . . . . . . . 20.0 p-80 . . . . . 0 C--O 1.257 1.464 0 CA-C-O 116.283 -1.817 . . . . 0.0 110.164 178.061 . . . . . . . . 0 0 . 1 . 012 nuclear build full ' B' B 2052 ' ' ASP . . . . . . . . . . . . . 28.4 p-10 . . . . . 0 N--CA 1.474 0.744 0 N-CA-C 110.604 -0.147 . . . . 0.0 110.604 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' B' B 2053 ' ' ASP . . . . . . . . . . . . . 47.3 t0 -160.13 162.08 33.89 Favored 'General case' 0 N--CA 1.454 -0.265 0 C-N-CA 122.317 0.247 . . . . 0.0 111.143 -179.745 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B 2054 ' ' ASP . . . . . 0.407 ' CG ' HH12 ' A' ' 28' ' ' ARG . 0.5 OUTLIER -155.29 10.95 0.33 Allowed 'General case' 0 CA--C 1.538 0.501 0 CA-C-N 115.728 -0.669 . . . . 0.0 110.497 173.213 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' B' B 2055 ' ' GLU . . . . . 0.524 ' HB2' ' H ' ' A' ' 27' ' ' SER . 70.9 mt-10 -146.09 93.02 2.26 Favored 'General case' 0 C--N 1.34 0.167 0 C-N-CA 125.495 1.518 . . . . 0.0 107.341 173.46 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B 2056 ' ' ASP . . . . . . . . . . . . . 35.4 p-10 -70.31 -0.33 7.89 Favored 'General case' 0 CA--C 1.53 0.205 0 N-CA-C 113.153 0.797 . . . . 0.0 113.153 -171.477 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B 2057 ' ' ASP . . . . . . . . . . . . . 38.7 t0 -154.14 175.78 13.04 Favored 'General case' 0 N--CA 1.453 -0.317 0 CA-C-N 118.664 0.666 . . . . 0.0 110.565 179.619 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B 2058 ' ' TYR . . . . . . . . . . . . . 1.3 t80 -146.21 131.26 18.28 Favored 'General case' 0 N--CA 1.451 -0.418 0 C-N-CA 124.887 1.275 . . . . 0.0 107.848 179.103 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B 2059 ' ' THR . . . . . 0.413 ' HA ' ' HD2' ' B' 2060 ' ' PRO . 80.5 p -125.58 101.52 30.35 Favored Pre-proline 0 N--CA 1.454 -0.241 0 N-CA-C 109.729 -0.471 . . . . 0.0 109.729 -174.936 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B 2060 ' ' PRO . . . . . 0.413 ' HD2' ' HA ' ' B' 2059 ' ' THR . 79.5 Cg_endo -72.34 167.86 25.78 Favored 'Trans proline' 0 N--CA 1.45 -1.049 0 C-N-CA 123.391 2.727 . . . . 0.0 110.359 176.135 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B 2061 ' ' SER . . . . . . . . . . . . . 41.1 t -146.0 140.01 26.55 Favored 'General case' 0 N--CA 1.452 -0.365 0 N-CA-C 108.653 -0.869 . . . . 0.0 108.653 177.266 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B 2062 ' ' ILE . . . . . . . . . . . . . 18.8 tt -163.72 157.75 1.71 Allowed 'Isoleucine or valine' 0 N--CA 1.453 -0.301 0 N-CA-C 110.096 -0.335 . . . . 0.0 110.096 -176.116 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B 2063 ' ' SER . . . . . . . . . . . . . 81.7 p . . . . . 0 C--O 1.251 1.16 0 CA-C-O 117.272 -1.347 . . . . 0.0 109.769 175.521 . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 44.9 ttp . . . . . 0 N--CA 1.476 0.848 0 N-CA-C 109.901 -0.407 . . . . 0.0 109.901 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 42.4 tp60 -63.27 -16.9 61.71 Favored 'General case' 0 CA--C 1.531 0.232 0 C-N-CA 122.875 0.47 . . . . 0.0 111.114 179.053 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 56.7 tt0 -148.24 132.11 17.08 Favored 'General case' 0 N--CA 1.451 -0.379 0 N-CA-C 106.916 -1.513 . . . . 0.0 106.916 175.713 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 39.4 t0 58.21 174.42 0.06 Allowed 'General case' 0 CA--C 1.537 0.465 0 C-N-CA 123.309 0.644 . . . . 0.0 110.392 -170.184 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 47.5 t0 52.73 44.42 30.22 Favored 'General case' 0 CA--C 1.528 0.121 0 O-C-N 121.601 -0.687 . . . . 0.0 110.365 -179.465 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 28.6 p-10 -63.17 -32.85 74.34 Favored 'General case' 0 N--CA 1.452 -0.342 0 CA-C-N 116.385 -0.37 . . . . 0.0 110.434 -177.45 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 7' ' ' PHE . . . . . 0.472 ' CD1' ' HD3' ' A' ' 45' ' ' LYS . 1.5 t80 -59.18 -41.97 89.73 Favored 'General case' 0 N--CA 1.449 -0.508 0 CA-C-N 116.746 -0.207 . . . . 0.0 110.489 -178.984 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 9.7 tp60 -55.18 -32.74 62.41 Favored 'General case' 0 N--CA 1.454 -0.252 0 C-N-CA 122.635 0.374 . . . . 0.0 110.934 -178.793 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 27.4 m-20 -70.84 -34.64 71.88 Favored 'General case' 0 N--CA 1.45 -0.455 0 N-CA-C 109.49 -0.559 . . . . 0.0 109.49 179.856 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 10' ' ' PHE . . . . . 0.519 ' CE2' ' HB2' ' A' ' 32' ' ' LEU . 11.7 t80 -69.14 -41.45 77.29 Favored 'General case' 0 N--CA 1.453 -0.284 0 C-N-CA 123.295 0.638 . . . . 0.0 109.411 175.503 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 94.6 t -63.68 -50.1 79.42 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.36 0 N-CA-C 109.032 -0.729 . . . . 0.0 109.032 179.771 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -61.13 -28.45 69.11 Favored 'General case' 0 N--CA 1.451 -0.409 0 C-N-CA 122.702 0.401 . . . . 0.0 111.137 179.731 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 85.8 m -73.98 -38.22 64.23 Favored 'General case' 0 N--CA 1.454 -0.266 0 N-CA-C 109.335 -0.617 . . . . 0.0 109.335 175.817 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.408 ' HA ' ' CD1' ' A' ' 17' ' ' PHE . 0.1 OUTLIER -64.67 -43.82 92.36 Favored 'General case' 0 N--CA 1.453 -0.285 0 N-CA-C 108.809 -0.811 . . . . 0.0 108.809 176.916 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 66.4 mm-40 -65.22 -29.05 69.82 Favored 'General case' 0 N--CA 1.454 -0.243 0 C-N-CA 123.88 0.872 . . . . 0.0 109.988 178.633 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 67.0 m -69.76 -29.03 66.28 Favored 'General case' 0 N--CA 1.451 -0.397 0 N-CA-C 109.787 -0.449 . . . . 0.0 109.787 176.968 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 17' ' ' PHE . . . . . 0.467 ' CD1' HD11 ' A' ' 68' ' ' ILE . 18.4 m-85 -68.55 -40.49 80.62 Favored 'General case' 0 N--CA 1.456 -0.151 0 C-N-CA 120.195 -0.602 . . . . 0.0 109.869 172.814 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 18' ' ' LYS . . . . . 0.4 ' HG2' ' CE1' ' A' ' 53' ' ' TYR . 65.5 mttt -65.48 -26.14 67.8 Favored 'General case' 0 N--CA 1.463 0.187 0 CA-C-O 121.134 0.492 . . . . 0.0 110.544 178.338 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 31.7 t0 -81.04 -6.81 59.24 Favored 'General case' 0 CA--C 1.536 0.442 0 C-N-CA 123.748 0.819 . . . . 0.0 112.99 -178.537 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 20' ' ' LEU . . . . . 0.42 ' CD1' ' HB2' ' A' ' 25' ' ' SER . 18.4 mt -93.6 151.01 19.96 Favored 'General case' 0 N--CA 1.455 -0.2 0 N-CA-C 113.17 0.804 . . . . 0.0 113.17 -176.558 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -71.75 -6.36 40.77 Favored 'General case' 0 CA--C 1.53 0.188 0 C-N-CA 124.049 0.939 . . . . 0.0 112.978 178.532 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 58.9 m -137.85 -7.8 1.63 Allowed 'General case' 0 CA--C 1.522 -0.096 0 N-CA-C 112.925 0.713 . . . . 0.0 112.925 -176.875 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 72.52 -25.69 0.74 Allowed Glycine 0 CA--C 1.528 0.859 0 C-N-CA 123.758 0.694 . . . . 0.0 112.512 -179.805 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 94.8 mt -76.98 141.64 15.35 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.263 0 N-CA-C 108.012 -1.107 . . . . 0.0 108.012 175.388 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 25' ' ' SER . . . . . 0.42 ' HB2' ' CD1' ' A' ' 20' ' ' LEU . 7.5 t -160.51 79.88 0.65 Allowed 'General case' 0 CA--C 1.518 -0.254 0 N-CA-C 110.209 -0.293 . . . . 0.0 110.209 -174.598 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 26' ' ' GLY . . . . . 0.4 ' O ' ' HE2' ' A' ' 30' ' ' LYS . . . -48.28 -49.95 24.19 Favored Glycine 0 CA--C 1.527 0.782 0 CA-C-O 118.851 -0.972 . . . . 0.0 114.17 -171.002 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 27' ' ' SER . . . . . 0.522 ' HA ' ' HE3' ' A' ' 30' ' ' LYS . 47.3 p -73.27 -33.34 65.2 Favored 'General case' 0 C--N 1.339 0.14 0 CA-C-N 119.962 1.881 . . . . 0.0 111.641 -174.54 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 2.3 mpt_? -73.91 -36.8 64.76 Favored 'General case' 0 N--CA 1.456 -0.147 0 N-CA-C 109.253 -0.647 . . . . 0.0 109.253 177.344 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 74.5 mt -61.25 -47.51 93.17 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.287 0 N-CA-C 109.007 -0.738 . . . . 0.0 109.007 175.417 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 30' ' ' LYS . . . . . 0.522 ' HE3' ' HA ' ' A' ' 27' ' ' SER . 52.1 mtmt -64.87 -30.15 71.14 Favored 'General case' 0 C--N 1.339 0.122 0 CA-C-O 119.36 -0.352 . . . . 0.0 111.135 179.65 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 31' ' ' LYS . . . . . 0.47 ' CE ' ' HA ' ' A' ' 31' ' ' LYS . 2.8 mmpt? -65.87 -60.07 3.23 Favored 'General case' 0 N--CA 1.455 -0.223 0 CA-C-N 118.455 0.57 . . . . 0.0 111.328 -179.942 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.519 ' HB2' ' CE2' ' A' ' 10' ' ' PHE . 1.2 pp -75.89 -16.55 60.02 Favored 'General case' 0 CA--C 1.532 0.276 0 C-N-CA 119.247 -0.981 . . . . 0.0 111.687 -177.925 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 33' ' ' THR . . . . . 0.434 ' N ' HD12 ' A' ' 32' ' ' LEU . 24.7 m -70.26 -42.94 71.49 Favored 'General case' 0 N--CA 1.454 -0.232 0 N-CA-C 108.398 -0.964 . . . . 0.0 108.398 173.338 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 93.5 m -66.65 -41.46 88.19 Favored 'General case' 0 N--CA 1.45 -0.459 0 N-CA-C 109.664 -0.495 . . . . 0.0 109.664 -178.728 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 23.8 t80 -60.49 -36.53 78.54 Favored 'General case' 0 C--N 1.339 0.122 0 N-CA-C 110.155 -0.313 . . . . 0.0 110.155 177.073 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -72.3 -28.12 62.88 Favored 'General case' 0 N--CA 1.451 -0.391 0 CA-C-O 119.211 -0.423 . . . . 0.0 111.516 179.457 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 2.7 mm? -82.12 -34.08 29.4 Favored 'General case' 0 CA--C 1.518 -0.281 0 N-CA-C 108.822 -0.807 . . . . 0.0 108.822 -177.923 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 86.7 m-20 -64.4 -27.19 68.83 Favored 'General case' 0 N--CA 1.444 -0.766 0 C-N-CA 123.652 0.781 . . . . 0.0 110.959 174.274 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 65.8 m80 -151.53 106.62 3.29 Favored 'General case' 0 N--CA 1.454 -0.234 0 C-N-CA 122.624 0.37 . . . . 0.0 111.621 -179.187 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 40' ' ' ILE . . . . . 0.597 ' H ' HD13 ' A' ' 40' ' ' ILE . 0.0 OUTLIER -80.53 -10.15 12.3 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.359 0 C-N-CA 123.058 0.543 . . . . 0.0 109.728 173.631 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -55.4 -23.39 24.45 Favored 'General case' 0 N--CA 1.457 -0.122 0 C-N-CA 123.86 0.864 . . . . 0.0 111.86 -178.016 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -108.6 18.0 6.74 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.246 0 C-N-CA 124.032 0.933 . . . . 0.0 111.95 -179.83 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 3.0 pp20? -53.33 -30.1 37.46 Favored 'General case' 0 CA--C 1.53 0.183 0 O-C-N 121.649 -0.657 . . . . 0.0 111.598 178.985 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 47.1 t -65.33 -44.49 87.61 Favored 'General case' 0 CA--C 1.53 0.196 0 N-CA-C 111.756 0.28 . . . . 0.0 111.756 -175.89 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 45' ' ' LYS . . . . . 0.472 ' HD3' ' CD1' ' A' ' 7' ' ' PHE . 19.4 ptpt -73.94 -24.79 59.71 Favored 'General case' 0 C--N 1.341 0.22 0 O-C-N 121.738 -0.601 . . . . 0.0 110.167 179.253 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 84.8 mt -72.99 -48.17 45.4 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.327 0 C-N-CA 122.873 0.469 . . . . 0.0 109.948 -179.475 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 35.5 mm -63.92 -35.54 73.69 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.323 0 N-CA-C 109.646 -0.501 . . . . 0.0 109.646 178.977 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 15.4 t -63.25 -45.76 90.06 Favored 'General case' 0 N--CA 1.453 -0.276 0 C-N-CA 119.813 -0.755 . . . . 0.0 110.557 178.158 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 49' ' ' LEU . . . . . 0.417 HD23 ' HA ' ' A' ' 49' ' ' LEU . 25.7 mt -66.6 -33.6 76.03 Favored 'General case' 0 N--CA 1.451 -0.415 0 CA-C-O 118.677 -0.677 . . . . 0.0 112.684 -175.671 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 15.9 pt -69.58 -42.64 80.67 Favored 'Isoleucine or valine' 0 C--N 1.339 0.12 0 CA-C-N 119.553 1.069 . . . . 0.0 110.85 177.077 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 37.7 pt -71.03 -39.86 75.32 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.173 0 C-N-CA 119.926 -0.71 . . . . 0.0 111.13 179.8 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 79.7 m-20 -65.99 -42.31 89.98 Favored 'General case' 0 N--CA 1.454 -0.238 0 C-N-CA 122.492 0.317 . . . . 0.0 110.589 178.984 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 53' ' ' TYR . . . . . 0.4 ' CE1' ' HG2' ' A' ' 18' ' ' LYS . 14.5 t80 -64.95 -45.23 86.63 Favored 'General case' 0 N--CA 1.451 -0.419 0 N-CA-C 109.566 -0.531 . . . . 0.0 109.566 178.266 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 23.7 m -63.84 -30.16 71.27 Favored 'General case' 0 N--CA 1.456 -0.156 0 N-CA-C 111.502 0.186 . . . . 0.0 111.502 -177.522 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 15.6 tpp180 -75.63 -45.07 39.44 Favored 'General case' 0 N--CA 1.453 -0.281 0 O-C-N 122.957 0.161 . . . . 0.0 110.822 -177.16 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 42.0 mt -83.71 -43.4 15.56 Favored 'General case' 0 N--CA 1.456 -0.154 0 N-CA-C 113.379 0.881 . . . . 0.0 113.379 -174.912 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 9.0 p -64.42 154.42 83.85 Favored Pre-proline 0 CA--C 1.535 0.4 0 N-CA-C 113.074 0.768 . . . . 0.0 113.074 -172.088 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 94.6 Cg_endo -74.43 171.6 17.79 Favored 'Trans proline' 0 N--CA 1.455 -0.745 0 C-N-CA 125.125 3.883 . . . . 0.0 111.824 179.806 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -43.5 -49.14 7.39 Favored 'General case' 0 CA--C 1.532 0.255 0 C-N-CA 125.909 1.684 . . . . 0.0 113.794 -174.173 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 87.9 p -70.08 -35.34 74.12 Favored 'General case' 0 N--CA 1.457 -0.118 0 O-C-N 121.967 -0.458 . . . . 0.0 110.684 -176.408 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 62.3 m170 -75.33 -24.91 57.45 Favored 'General case' 0 N--CA 1.45 -0.438 0 CA-C-O 119.28 -0.39 . . . . 0.0 110.379 178.617 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 66.3 mttm -64.61 -47.76 77.43 Favored 'General case' 0 C--N 1.342 0.251 0 N-CA-C 109.094 -0.706 . . . . 0.0 109.094 172.913 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -58.93 -43.23 91.12 Favored 'General case' 0 CA--C 1.533 0.316 0 N-CA-C 108.003 -1.11 . . . . 0.0 108.003 177.454 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -63.02 -34.84 91.05 Favored Glycine 0 CA--C 1.526 0.733 0 N-CA-C 111.146 -0.782 . . . . 0.0 111.146 -179.582 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 44.6 t -67.32 -39.18 85.84 Favored 'General case' 0 N--CA 1.452 -0.337 0 CA-C-N 117.61 0.705 . . . . 0.0 109.644 177.409 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 8.0 mp -64.27 -28.92 70.05 Favored 'General case' 0 N--CA 1.453 -0.324 0 N-CA-C 110.098 -0.334 . . . . 0.0 110.098 178.38 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 0.9 OUTLIER -69.96 -41.27 74.71 Favored 'General case' 0 CA--C 1.528 0.123 0 CA-C-N 117.784 0.265 . . . . 0.0 110.59 175.673 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 68' ' ' ILE . . . . . 0.467 HD11 ' CD1' ' A' ' 17' ' ' PHE . 8.3 mt -64.19 -48.56 85.11 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.269 0 N-CA-C 109.73 -0.471 . . . . 0.0 109.73 176.874 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 91.2 mt -57.75 -33.71 46.02 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.317 0 C-N-CA 123.129 0.572 . . . . 0.0 111.504 178.117 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 17.6 t70 -69.63 -41.84 75.11 Favored 'General case' 0 CA--C 1.521 -0.139 0 CA-C-N 119.116 0.871 . . . . 0.0 110.563 176.986 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 35.4 t -66.24 -59.6 3.58 Favored 'General case' 0 N--CA 1.45 -0.431 0 C-N-CA 122.672 0.389 . . . . 0.0 110.279 -177.381 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -75.17 -33.05 27.56 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.272 0 O-C-N 122.262 -0.274 . . . . 0.0 110.511 -177.217 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -68.33 -50.32 39.41 Favored Glycine 0 CA--C 1.524 0.613 0 N-CA-C 111.739 -0.544 . . . . 0.0 111.739 -174.119 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 41.6 mtm105 -72.13 -39.17 69.0 Favored 'General case' 0 N--CA 1.452 -0.347 0 CA-C-N 117.482 0.641 . . . . 0.0 109.753 179.061 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -62.56 -30.33 71.23 Favored 'General case' 0 N--CA 1.45 -0.461 0 C-N-CA 119.788 -0.765 . . . . 0.0 110.334 -179.611 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 1.7 m-30 -70.02 -53.46 17.49 Favored 'General case' 0 CA--C 1.518 -0.25 0 CA-C-N 118.161 0.437 . . . . 0.0 111.133 176.317 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -71.4 -32.0 67.92 Favored 'General case' 0 N--CA 1.449 -0.512 0 C-N-CA 117.751 -1.58 . . . . 0.0 109.865 -175.04 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 85.5 m-20 -68.9 -45.57 70.57 Favored 'General case' 0 N--CA 1.457 -0.096 0 CA-C-N 118.218 0.463 . . . . 0.0 112.152 179.378 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 15.7 tm-20 -65.19 -50.13 67.08 Favored 'General case' 0 N--CA 1.444 -0.727 0 C-N-CA 120.764 -0.374 . . . . 0.0 110.64 179.705 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 80' ' ' THR . . . . . 0.431 HG21 ' HB3' ' A' ' 94' ' ' CYS . 69.3 p -64.74 -27.11 68.68 Favored 'General case' 0 N--CA 1.454 -0.262 0 N-CA-C 111.708 0.262 . . . . 0.0 111.708 -179.242 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 32.8 ttp-105 -75.26 -30.56 60.51 Favored 'General case' 0 N--CA 1.456 -0.156 0 C-N-CA 122.806 0.442 . . . . 0.0 110.807 175.468 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 19.8 m -85.11 -24.71 27.91 Favored 'General case' 0 N--CA 1.454 -0.232 0 C-N-CA 122.894 0.478 . . . . 0.0 111.673 -179.75 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 6.7 t-20 -88.37 160.72 17.47 Favored 'General case' 0 N--CA 1.453 -0.294 0 C-N-CA 123.201 0.6 . . . . 0.0 111.242 -177.176 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 99.6 p -86.24 12.93 8.79 Favored 'General case' 0 N--CA 1.456 -0.162 0 C-N-CA 124.006 0.922 . . . . 0.0 111.29 179.818 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -60.46 147.4 41.26 Favored 'General case' 0 N--CA 1.453 -0.28 0 C-N-CA 123.248 0.619 . . . . 0.0 112.626 -175.485 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 32.9 t -163.45 150.45 12.43 Favored 'General case' 0 N--CA 1.453 -0.296 0 N-CA-C 107.892 -1.151 . . . . 0.0 107.892 176.0 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 87.1 p -160.89 150.22 16.96 Favored 'General case' 0 N--CA 1.453 -0.293 0 CA-C-O 120.887 0.375 . . . . 0.0 111.708 -177.277 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 43.0 t -71.4 -35.8 71.15 Favored 'General case' 0 N--CA 1.455 -0.198 0 N-CA-C 108.937 -0.764 . . . . 0.0 108.937 175.812 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 8.0 p-10 -75.76 167.53 21.71 Favored 'General case' 0 N--CA 1.452 -0.373 0 N-CA-C 108.416 -0.957 . . . . 0.0 108.416 172.138 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 90' ' ' LYS . . . . . 0.628 ' H ' ' CD ' ' A' ' 91' ' ' PRO . 43.2 mmtm -124.3 -34.31 0.04 OUTLIER Pre-proline 0 N--CA 1.454 -0.239 0 CA-C-O 118.235 -0.888 . . . . 0.0 111.267 178.507 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 91' ' ' PRO . . . . . 0.628 ' CD ' ' H ' ' A' ' 90' ' ' LYS . 31.2 Cg_exo -61.91 150.45 86.14 Favored 'Trans proline' 0 N--CA 1.451 -1.022 0 C-N-CA 122.269 1.979 . . . . 0.0 109.368 167.268 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 83.6 13.81 74.9 Favored Glycine 0 CA--C 1.528 0.871 0 N-CA-C 111.65 -0.58 . . . . 0.0 111.65 -177.088 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -153.52 165.23 36.53 Favored 'General case' 0 N--CA 1.454 -0.245 0 C-N-CA 124.534 1.134 . . . . 0.0 109.469 -179.845 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 94' ' ' CYS . . . . . 0.431 ' HB3' HG21 ' A' ' 80' ' ' THR . 29.4 p -56.22 -21.35 22.76 Favored 'General case' 0 N--CA 1.453 -0.305 0 C-N-CA 123.519 0.728 . . . . 0.0 110.925 177.323 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -58.31 -63.44 1.27 Allowed 'General case' 0 N--CA 1.447 -0.616 0 O-C-N 122.297 -0.252 . . . . 0.0 110.327 -176.111 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 76.8 t60 -71.62 -33.28 68.83 Favored 'General case' 0 N--CA 1.451 -0.418 0 CA-C-N 117.609 0.186 . . . . 0.0 110.514 -179.489 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -62.75 -52.78 61.89 Favored 'General case' 0 N--CA 1.451 -0.388 0 O-C-N 123.229 0.331 . . . . 0.0 111.535 -176.837 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 98' ' ' ILE . . . . . 0.426 HD13 ' HB2' ' A' ' 94' ' ' CYS . 1.8 mp -71.82 -36.11 57.31 Favored 'Isoleucine or valine' 0 C--N 1.338 0.097 0 C-N-CA 121.001 -0.28 . . . . 0.0 110.75 -178.69 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 24.4 m-80 -69.02 -38.51 79.25 Favored 'General case' 0 N--CA 1.455 -0.2 0 CA-C-N 118.442 0.565 . . . . 0.0 111.736 -179.996 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 99.6 m -73.37 -33.68 65.18 Favored 'General case' 0 N--CA 1.456 -0.143 0 CA-C-N 118.422 0.555 . . . . 0.0 110.449 -178.98 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 62.6 tp -75.29 -37.56 60.79 Favored 'General case' 0 N--CA 1.449 -0.489 0 N-CA-C 110.317 -0.253 . . . . 0.0 110.317 179.707 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -61.96 -22.75 62.83 Favored Glycine 0 CA--C 1.527 0.81 0 CA-C-O 119.448 -0.64 . . . . 0.0 113.138 -173.752 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 13.7 mm-40 -80.14 -39.32 29.67 Favored 'General case' 0 N--CA 1.452 -0.36 0 CA-C-N 117.702 0.751 . . . . 0.0 112.403 -179.939 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 21.7 m -100.61 -14.77 7.8 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.092 0 N-CA-C 112.992 0.738 . . . . 0.0 112.992 -175.746 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 105' ' ' ILE . . . . . . . . . . . . . 9.8 tp -63.5 -26.8 41.62 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.206 0 CA-C-N 118.511 0.596 . . . . 0.0 111.206 -177.458 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 106' ' ' GLN . . . . . 0.442 ' HA ' ' CD1' ' A' ' 145' ' ' ILE . 20.3 pt20 -66.27 -29.85 70.17 Favored 'General case' 0 N--CA 1.452 -0.361 0 O-C-N 122.006 -0.434 . . . . 0.0 111.039 -179.937 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 84.0 mt-10 -73.74 -40.7 63.34 Favored 'General case' 0 N--CA 1.453 -0.31 0 N-CA-C 109.511 -0.552 . . . . 0.0 109.511 177.395 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 66.1 mt -74.96 -35.94 62.08 Favored 'General case' 0 N--CA 1.451 -0.405 0 C-N-CA 122.996 0.518 . . . . 0.0 111.343 -174.853 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 92.7 mt -70.54 -52.71 19.84 Favored 'General case' 0 N--CA 1.452 -0.341 0 N-CA-C 109.583 -0.525 . . . . 0.0 109.583 177.163 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 13.1 t -59.26 -37.43 77.6 Favored 'General case' 0 N--CA 1.453 -0.276 0 CA-C-N 117.749 0.249 . . . . 0.0 111.034 -178.153 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 36.9 t0 -62.87 -45.75 91.1 Favored 'General case' 0 N--CA 1.454 -0.267 0 N-CA-C 108.883 -0.784 . . . . 0.0 108.883 174.59 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -65.7 -30.36 71.03 Favored 'General case' 0 N--CA 1.448 -0.569 0 CA-C-O 118.959 -0.543 . . . . 0.0 110.837 -176.538 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 113' ' ' ILE . . . . . . . . . . . . . 49.6 mm -68.19 -50.78 54.91 Favored 'Isoleucine or valine' 0 C--N 1.34 0.156 0 CA-C-N 119.073 0.851 . . . . 0.0 109.56 177.647 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -69.63 -41.29 75.82 Favored 'General case' 0 N--CA 1.449 -0.501 0 O-C-N 123.03 0.207 . . . . 0.0 111.088 -175.381 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 115' ' ' LYS . . . . . 0.575 ' HE2' ' HA ' ' A' ' 115' ' ' LYS . 0.6 OUTLIER -75.61 -40.42 56.4 Favored 'General case' 0 N--CA 1.45 -0.429 0 N-CA-C 113.977 1.103 . . . . 0.0 113.977 -176.521 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 116' ' ' SER . . . . . 0.479 ' HB3' ' CB ' ' A' ' 120' ' ' HIS . 2.4 m -80.53 157.33 26.14 Favored 'General case' 0 CA--C 1.53 0.188 0 C-N-CA 120.181 -0.608 . . . . 0.0 112.539 -169.156 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 62.9 t30 -72.74 171.35 12.76 Favored 'General case' 0 CA--C 1.531 0.213 0 C-N-CA 124.05 0.94 . . . . 0.0 111.887 -174.845 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 118' ' ' GLN . . . . . . . . . . . . . 53.6 mt-30 -51.4 -44.3 62.18 Favored 'General case' 0 C--O 1.231 0.115 0 C-N-CA 123.615 0.766 . . . . 0.0 111.553 -176.826 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 22.5 t0 -65.97 -33.04 74.9 Favored 'General case' 0 N--CA 1.454 -0.234 0 CA-C-O 121.469 0.652 . . . . 0.0 109.975 -179.717 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 120' ' ' HIS . . . . . 0.479 ' CB ' ' HB3' ' A' ' 116' ' ' SER . 21.9 m170 -75.98 -45.88 32.5 Favored 'General case' 0 N--CA 1.447 -0.576 0 CA-C-N 115.746 -0.661 . . . . 0.0 110.342 -178.824 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 52.8 mttm -57.7 -37.77 74.07 Favored 'General case' 0 C--N 1.341 0.234 0 N-CA-C 108.856 -0.794 . . . . 0.0 108.856 179.792 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 7.0 tm-20 -62.48 -51.99 65.29 Favored 'General case' 0 N--CA 1.452 -0.373 0 C-N-CA 122.251 0.221 . . . . 0.0 110.758 179.004 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 3.1 mtmm -64.77 -27.12 68.68 Favored 'General case' 0 N--CA 1.454 -0.226 0 CA-C-N 116.761 -0.2 . . . . 0.0 111.244 179.866 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 124' ' ' ILE . . . . . . . . . . . . . 54.6 mt -74.81 -39.65 45.81 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.242 0 O-C-N 121.576 -0.702 . . . . 0.0 109.517 175.706 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 125' ' ' ARG . . . . . 0.424 HH11 ' HA ' ' A' ' 125' ' ' ARG . 7.2 mmm180 -59.79 -41.5 91.3 Favored 'General case' 0 N--CA 1.454 -0.271 0 CA-C-O 119.073 -0.489 . . . . 0.0 111.09 178.584 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 126' ' ' MET . . . . . . . . . . . . . 28.1 ptm -66.23 -39.98 89.93 Favored 'General case' 0 N--CA 1.449 -0.48 0 C-N-CA 118.542 -1.263 . . . . 0.0 108.409 176.663 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 4.0 mp -62.29 -36.95 83.7 Favored 'General case' 0 N--CA 1.456 -0.174 0 CA-C-N 118.839 0.745 . . . . 0.0 111.549 179.845 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 93.2 mt -67.61 -42.94 81.58 Favored 'General case' 0 N--CA 1.457 -0.099 0 CA-C-N 118.551 0.614 . . . . 0.0 110.325 178.598 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 27.6 m-20 -69.73 -32.4 70.93 Favored 'General case' 0 N--CA 1.454 -0.261 0 N-CA-C 110.045 -0.354 . . . . 0.0 110.045 178.946 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 130' ' ' ILE . . . . . 0.438 ' HA ' ' HD3' ' A' ' 133' ' ' ARG . 34.5 mt -61.98 -39.76 84.82 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.286 0 N-CA-C 109.885 -0.413 . . . . 0.0 109.885 176.641 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 131' ' ' TRP . . . . . . . . . . . . . 32.3 m0 -74.69 -30.84 61.71 Favored 'General case' 0 N--CA 1.453 -0.302 0 C-N-CA 120.372 -0.531 . . . . 0.0 112.084 -179.779 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 66.3 m-20 -75.55 -28.78 59.18 Favored 'General case' 0 CA--C 1.534 0.341 0 CA-C-N 117.961 0.346 . . . . 0.0 111.128 177.912 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 133' ' ' ARG . . . . . 0.447 HH21 ' C ' ' B' 2063 ' ' SER . 24.6 mtp180 -72.89 -36.61 67.36 Favored 'General case' 0 C--N 1.34 0.166 0 N-CA-C 110.055 -0.35 . . . . 0.0 110.055 175.018 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 47.5 m -75.15 -7.97 55.27 Favored 'General case' 0 N--CA 1.453 -0.292 0 C-N-CA 123.39 0.676 . . . . 0.0 112.306 -176.45 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 135' ' ' GLY . . . . . . . . . . . . . . . 87.62 11.71 68.05 Favored Glycine 0 CA--C 1.527 0.824 0 CA-C-O 119.17 -0.794 . . . . 0.0 113.229 175.898 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 136' ' ' LEU . . . . . . . . . . . . . 6.7 mp -75.77 46.21 0.36 Allowed 'General case' 0 CA--C 1.532 0.267 0 CA-C-N 118.351 1.076 . . . . 0.0 110.553 178.497 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 137' ' ' PHE . . . . . . . . . . . . . 69.4 m-85 -71.96 -2.26 17.47 Favored 'General case' 0 CA--C 1.529 0.161 0 O-C-N 121.85 -0.531 . . . . 0.0 112.281 -179.534 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 138' ' ' GLN . . . . . . . . . . . . . 17.7 mp0 -75.62 -14.92 60.39 Favored 'General case' 0 CA--C 1.53 0.199 0 CA-C-N 118.385 0.539 . . . . 0.0 110.971 -178.585 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 139' ' ' LYS . . . . . . . . . . . . . 23.7 pttm -79.95 163.62 24.14 Favored 'General case' 0 N--CA 1.454 -0.25 0 N-CA-C 109.407 -0.59 . . . . 0.0 109.407 175.271 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 140' ' ' SER . . . . . . . . . . . . . 30.2 t -66.91 134.99 53.14 Favored 'General case' 0 N--CA 1.454 -0.252 0 N-CA-C 109.127 -0.694 . . . . 0.0 109.127 173.054 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 141' ' ' TYR . . . . . . . . . . . . . 39.1 p90 -132.8 22.74 4.24 Favored 'General case' 0 C--O 1.231 0.089 0 C-N-CA 122.93 0.492 . . . . 0.0 110.687 -176.898 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 142' ' ' LEU . . . . . . . . . . . . . 79.6 mt -60.44 167.93 2.34 Favored 'General case' 0 N--CA 1.454 -0.265 0 CA-C-O 121.433 0.635 . . . . 0.0 111.145 -179.709 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 74.0 m-20 -59.59 -14.56 13.87 Favored 'General case' 0 N--CA 1.455 -0.205 0 N-CA-C 112.392 0.516 . . . . 0.0 112.392 -178.444 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . -66.02 -27.5 68.16 Favored 'General case' 0 N--CA 1.451 -0.413 0 C-N-CA 122.494 0.318 . . . . 0.0 111.354 178.396 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 145' ' ' ILE . . . . . 0.442 ' CD1' ' HA ' ' A' ' 106' ' ' GLN . 39.1 mm -69.98 -49.0 59.77 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.203 0 CA-C-N 117.621 0.192 . . . . 0.0 111.164 -179.782 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 146' ' ' ARG . . . . . . . . . . . . . 6.2 mpt_? -75.35 -26.42 58.55 Favored 'General case' 0 N--CA 1.454 -0.241 0 N-CA-C 109.071 -0.714 . . . . 0.0 109.071 176.802 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 147' ' ' SER . . . . . . . . . . . . . 32.0 p 57.97 0.05 0.11 Allowed 'General case' 0 C--N 1.341 0.234 0 C-N-CA 126.425 1.89 . . . . 0.0 115.978 171.502 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 33.7 mmtt 50.63 -88.26 0.01 OUTLIER 'General case' 0 CA--C 1.532 0.275 0 C-N-CA 125.561 1.544 . . . . 0.0 113.053 175.626 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 149' ' ' CYS . . . . . . . . . . . . . 48.6 t -66.17 -35.25 79.96 Favored 'General case' 0 N--CA 1.452 -0.328 0 N-CA-C 112.034 0.383 . . . . 0.0 112.034 -172.482 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 150' ' ' PHE . . . . . . . . . . . . . 95.3 m-85 -75.15 -13.43 60.47 Favored 'General case' 0 N--CA 1.452 -0.351 0 CA-C-N 118.05 0.386 . . . . 0.0 111.325 -178.807 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 151' ' ' ALA . . . . . . . . . . . . . . . -93.0 -37.4 12.21 Favored 'General case' 0 N--CA 1.451 -0.387 0 N-CA-C 110.311 -0.255 . . . . 0.0 110.311 172.834 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 152' ' ' MET . . . . . . . . . . . . . 93.5 mtp -79.35 -10.27 59.77 Favored 'General case' 0 N--CA 1.454 -0.257 0 C-N-CA 123.346 0.658 . . . . 0.0 112.109 178.902 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 153' ' ' ASP . . . . . . . . . . . . . 42.3 p-10 -51.9 -36.71 49.78 Favored 'General case' 0 CA--C 1.529 0.152 0 C-N-CA 123.416 0.686 . . . . 0.0 112.446 -174.691 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 154' ' ' LEU . . . . . . . . . . . . . 76.5 mt -138.5 37.35 2.25 Favored 'General case' 0 C--O 1.231 0.12 0 C-N-CA 124.216 1.006 . . . . 0.0 110.94 -178.735 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 155' ' ' GLU . . . . . . . . . . . . . 25.3 pt-20 -68.21 163.75 22.05 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-O 121.421 0.629 . . . . 0.0 111.467 -177.804 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 156' ' ' HIS . . . . . . . . . . . . . 92.1 m-70 -72.72 162.11 29.9 Favored 'General case' 0 N--CA 1.452 -0.342 0 CA-C-N 115.784 -0.644 . . . . 0.0 110.73 178.808 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 157' ' ' HIS . . . . . . . . . . . . . 32.2 p-80 -68.0 152.15 45.98 Favored 'General case' 0 N--CA 1.453 -0.278 0 C-N-CA 122.879 0.471 . . . . 0.0 110.691 -179.449 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 158' ' ' HIS . . . . . . . . . . . . . 88.9 m-70 -109.37 -0.41 19.03 Favored 'General case' 0 CA--C 1.529 0.153 0 C-N-CA 122.997 0.519 . . . . 0.0 111.688 -179.854 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 159' ' ' HIS . . . . . . . . . . . . . 42.0 m170 . . . . . 0 C--O 1.25 1.127 0 CA-C-O 117.353 -1.308 . . . . 0.0 109.905 -177.01 . . . . . . . . 0 0 . 1 . 013 nuclear build full ' B' B 2052 ' ' ASP . . . . . . . . . . . . . 23.1 p-10 . . . . . 0 N--CA 1.472 0.649 0 N-CA-C 109.668 -0.493 . . . . 0.0 109.668 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' B' B 2053 ' ' ASP . . . . . . . . . . . . . 68.0 m-20 -145.64 153.77 41.4 Favored 'General case' 0 N--CA 1.454 -0.269 0 C-N-CA 124.454 1.102 . . . . 0.0 109.961 178.822 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B 2054 ' ' ASP . . . . . . . . . . . . . 50.4 t0 -155.76 -169.59 3.15 Favored 'General case' 0 N--CA 1.452 -0.363 0 N-CA-C 107.735 -1.209 . . . . 0.0 107.735 -179.761 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B 2055 ' ' GLU . . . . . . . . . . . . . 12.0 pt-20 -65.83 -8.04 19.54 Favored 'General case' 0 CA--C 1.534 0.349 0 O-C-N 121.934 -0.479 . . . . 0.0 110.087 173.006 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B 2056 ' ' ASP . . . . . . . . . . . . . 51.8 m-20 48.91 15.05 0.09 Allowed 'General case' 0 CA--C 1.533 0.326 0 C-N-CA 126.651 1.98 . . . . 0.0 115.505 173.638 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B 2057 ' ' ASP . . . . . . . . . . . . . 40.6 t0 -152.04 170.64 19.41 Favored 'General case' 0 N--CA 1.454 -0.26 0 CA-C-N 118.761 0.71 . . . . 0.0 109.963 177.56 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B 2058 ' ' TYR . . . . . . . . . . . . . 0.7 OUTLIER -160.74 140.84 11.18 Favored 'General case' 0 N--CA 1.452 -0.37 0 C-N-CA 123.811 0.844 . . . . 0.0 109.286 -178.23 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B 2059 ' ' THR . . . . . 0.422 HG22 ' H ' ' B' 2061 ' ' SER . 92.4 m -107.61 126.84 28.99 Favored Pre-proline 0 CA--C 1.529 0.172 0 N-CA-C 109.687 -0.486 . . . . 0.0 109.687 -179.293 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B 2060 ' ' PRO . . . . . . . . . . . . . 91.2 Cg_endo -72.99 -16.1 25.83 Favored 'Trans proline' 0 N--CA 1.454 -0.846 0 C-N-CA 124.124 3.216 . . . . 0.0 113.159 -175.963 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B 2061 ' ' SER . . . . . 0.422 ' H ' HG22 ' B' 2059 ' ' THR . 37.5 t 51.51 35.15 13.73 Favored 'General case' 0 CA--C 1.53 0.209 0 C-N-CA 123.523 0.729 . . . . 0.0 111.972 -179.057 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B 2062 ' ' ILE . . . . . 0.445 HD11 ' HB2' ' A' ' 133' ' ' ARG . 5.8 tp -76.27 132.85 32.27 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.259 0 N-CA-C 114.225 1.194 . . . . 0.0 114.225 -172.356 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B 2063 ' ' SER . . . . . 0.447 ' C ' HH21 ' A' ' 133' ' ' ARG . 83.5 p . . . . . 0 C--O 1.254 1.342 0 CA-C-O 117.549 -1.215 . . . . 0.0 109.371 172.918 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 64.1 mtt . . . . . 0 N--CA 1.474 0.742 0 CA-C-O 120.573 0.225 . . . . 0.0 110.527 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 4.2 pm0 -153.19 157.71 40.68 Favored 'General case' 0 N--CA 1.456 -0.15 0 N-CA-C 109.328 -0.619 . . . . 0.0 109.328 -179.215 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 37.4 mm-40 -128.19 4.4 5.8 Favored 'General case' 0 CA--C 1.529 0.171 0 C-N-CA 123.053 0.541 . . . . 0.0 111.454 -177.759 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 6.1 m-20 -71.14 127.93 34.21 Favored 'General case' 0 N--CA 1.452 -0.34 0 N-CA-C 109.476 -0.564 . . . . 0.0 109.476 179.161 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 25.0 m-20 47.63 34.66 3.77 Favored 'General case' 0 CA--C 1.532 0.261 0 C-N-CA 123.211 0.605 . . . . 0.0 111.388 -176.546 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 21.3 p-10 -53.69 -49.71 67.43 Favored 'General case' 0 CA--C 1.518 -0.28 0 C-N-CA 123.129 0.572 . . . . 0.0 111.678 -172.718 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -75.65 -41.58 53.7 Favored 'General case' 0 N--CA 1.441 -0.905 0 C-N-CA 120.356 -0.538 . . . . 0.0 111.534 -170.501 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 52.2 tp60 -52.52 -36.57 55.62 Favored 'General case' 0 N--CA 1.453 -0.298 0 N-CA-C 112.169 0.433 . . . . 0.0 112.169 -176.179 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 54.2 m-80 -71.74 -35.64 70.2 Favored 'General case' 0 N--CA 1.453 -0.291 0 C-N-CA 120.541 -0.463 . . . . 0.0 110.139 179.391 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 10' ' ' PHE . . . . . 0.426 ' CE1' HD22 ' A' ' 32' ' ' LEU . 1.9 t80 -71.99 -37.49 69.84 Favored 'General case' 0 N--CA 1.451 -0.394 0 C-N-CA 123.011 0.524 . . . . 0.0 110.891 178.987 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 99.3 t -65.79 -57.3 11.23 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.337 0 N-CA-C 108.625 -0.88 . . . . 0.0 108.625 179.6 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -59.06 -31.35 68.79 Favored 'General case' 0 N--CA 1.453 -0.284 0 C-N-CA 122.894 0.477 . . . . 0.0 112.021 -177.246 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 79.2 m -70.31 -39.36 74.85 Favored 'General case' 0 N--CA 1.456 -0.144 0 CA-C-N 118.723 0.692 . . . . 0.0 109.588 176.707 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.441 ' HA ' ' CD1' ' A' ' 17' ' ' PHE . 2.8 tp -70.15 -39.66 75.24 Favored 'General case' 0 N--CA 1.453 -0.285 0 CA-C-O 121.169 0.509 . . . . 0.0 110.489 -179.479 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 61.7 mm-40 -64.07 -29.69 70.81 Favored 'General case' 0 N--CA 1.45 -0.431 0 N-CA-C 108.872 -0.788 . . . . 0.0 108.872 177.617 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 32.3 t -71.59 -29.18 64.41 Favored 'General case' 0 N--CA 1.45 -0.455 0 CA-C-O 119.476 -0.297 . . . . 0.0 110.427 177.306 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 17' ' ' PHE . . . . . 0.535 ' CD1' HD11 ' A' ' 68' ' ' ILE . 27.3 m-85 -67.6 -36.66 81.29 Favored 'General case' 0 C--N 1.342 0.253 0 CA-C-N 118.508 0.595 . . . . 0.0 110.845 172.503 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 18' ' ' LYS . . . . . 0.495 ' HG2' ' CE1' ' A' ' 53' ' ' TYR . 61.2 mttt -61.49 -37.72 84.66 Favored 'General case' 0 C--N 1.341 0.202 0 C-N-CA 120.088 -0.645 . . . . 0.0 109.367 176.643 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 39.1 t0 -81.07 -18.87 45.13 Favored 'General case' 0 CA--C 1.534 0.331 0 N-CA-C 113.176 0.806 . . . . 0.0 113.176 -178.908 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 20' ' ' LEU . . . . . 0.451 HD12 ' HA ' ' A' ' 17' ' ' PHE . 1.4 mt -64.8 -7.51 11.38 Favored 'General case' 0 C--O 1.227 -0.1 0 CA-C-O 118.439 -0.791 . . . . 0.0 112.816 178.722 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 36.0 mmtm 64.19 -48.08 0.29 Allowed 'General case' 0 CA--C 1.528 0.111 0 C-N-CA 126.506 1.923 . . . . 0.0 112.547 179.602 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 53.3 m -85.74 -13.26 48.9 Favored 'General case' 0 N--CA 1.451 -0.418 0 C-N-CA 123.186 0.594 . . . . 0.0 110.861 174.309 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 79.31 -34.33 1.99 Allowed Glycine 0 CA--C 1.527 0.834 0 C-N-CA 124.45 1.024 . . . . 0.0 113.16 175.553 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 93.9 mt -80.45 146.15 8.02 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.252 0 CA-C-N 118.025 0.912 . . . . 0.0 111.401 -178.933 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 35.1 t -169.02 97.68 0.36 Allowed 'General case' 0 CA--C 1.517 -0.326 0 N-CA-C 108.274 -1.01 . . . . 0.0 108.274 173.438 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -53.41 -34.72 49.22 Favored Glycine 0 CA--C 1.526 0.742 0 CA-C-O 119.405 -0.664 . . . . 0.0 111.672 -176.518 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 98.4 p -66.6 -49.92 64.74 Favored 'General case' 0 N--CA 1.456 -0.157 0 CA-C-N 118.255 1.027 . . . . 0.0 110.432 -178.261 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 28' ' ' ARG . . . . . 0.436 HH22 ' CB ' ' B' 2053 ' ' ASP . 33.8 mtm180 -73.83 -34.9 64.75 Favored 'General case' 0 C--O 1.231 0.127 0 C-N-CA 122.383 0.273 . . . . 0.0 110.788 -179.077 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 59.7 mt -58.79 -50.44 79.32 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.467 0 N-CA-C 109.228 -0.656 . . . . 0.0 109.228 174.55 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 70.9 mttt -64.47 -28.73 69.87 Favored 'General case' 0 CA--C 1.529 0.141 0 CA-C-O 118.904 -0.569 . . . . 0.0 111.43 178.773 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 31' ' ' LYS . . . . . 0.439 ' CE ' ' HA ' ' A' ' 31' ' ' LYS . 3.4 mmpt? -63.41 -58.88 5.65 Favored 'General case' 0 N--CA 1.457 -0.083 0 CA-C-N 118.624 0.647 . . . . 0.0 111.205 179.124 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.514 HD12 ' N ' ' A' ' 33' ' ' THR . 1.4 pp -75.78 -18.42 59.53 Favored 'General case' 0 N--CA 1.454 -0.256 0 C-N-CA 118.732 -1.187 . . . . 0.0 111.739 -178.714 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 33' ' ' THR . . . . . 0.514 ' N ' HD12 ' A' ' 32' ' ' LEU . 38.6 m -70.76 -41.49 71.68 Favored 'General case' 0 N--CA 1.455 -0.201 0 N-CA-C 108.664 -0.865 . . . . 0.0 108.664 175.931 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 98.2 m -69.54 -38.31 77.43 Favored 'General case' 0 N--CA 1.45 -0.46 0 CA-C-N 116.459 -0.337 . . . . 0.0 110.441 -178.188 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 26.6 t80 -69.89 -29.81 67.1 Favored 'General case' 0 N--CA 1.454 -0.259 0 C-N-CA 119.826 -0.75 . . . . 0.0 110.899 178.369 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -68.94 -32.15 71.55 Favored 'General case' 0 N--CA 1.448 -0.571 0 N-CA-C 110.313 -0.254 . . . . 0.0 110.313 176.53 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -76.98 -34.26 57.56 Favored 'General case' 0 N--CA 1.456 -0.154 0 N-CA-C 110.173 -0.306 . . . . 0.0 110.173 174.171 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 40.4 t0 -60.55 -24.81 65.7 Favored 'General case' 0 CA--C 1.531 0.229 0 C-N-CA 122.926 0.49 . . . . 0.0 110.563 175.547 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 27.3 m-70 -158.32 110.19 2.25 Favored 'General case' 0 N--CA 1.455 -0.193 0 C-N-CA 123.374 0.67 . . . . 0.0 111.28 172.691 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 40' ' ' ILE . . . . . 0.584 ' H ' HD13 ' A' ' 40' ' ' ILE . 0.0 OUTLIER -77.35 -11.39 13.59 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.385 0 N-CA-C 109.626 -0.509 . . . . 0.0 109.626 173.45 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 48.0 m-20 -59.33 -19.91 50.28 Favored 'General case' 0 CA--C 1.532 0.264 0 C-N-CA 122.987 0.515 . . . . 0.0 111.87 -177.916 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -102.95 13.36 6.93 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.195 0 C-N-CA 123.068 0.547 . . . . 0.0 111.848 176.576 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 3.0 pp20? -52.78 -32.01 41.51 Favored 'General case' 0 CA--C 1.527 0.093 0 O-C-N 121.613 -0.679 . . . . 0.0 112.096 -179.659 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 48.2 t -61.99 -48.86 78.46 Favored 'General case' 0 N--CA 1.455 -0.199 0 O-C-N 122.172 -0.33 . . . . 0.0 111.563 -176.113 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 19.6 ptpt -71.9 -24.66 61.69 Favored 'General case' 0 C--N 1.34 0.156 0 O-C-N 121.857 -0.527 . . . . 0.0 109.837 179.764 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 46' ' ' ILE . . . . . 0.42 HG12 ' CZ ' ' A' ' 10' ' ' PHE . 89.6 mt -71.87 -46.0 62.51 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.263 0 C-N-CA 122.763 0.425 . . . . 0.0 110.427 -179.393 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 33.9 mm -63.99 -35.67 74.26 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.224 0 N-CA-C 109.478 -0.564 . . . . 0.0 109.478 178.058 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 13.3 t -63.25 -41.6 99.08 Favored 'General case' 0 N--CA 1.453 -0.319 0 C-N-CA 119.644 -0.822 . . . . 0.0 110.36 177.801 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 4.4 mp -67.99 -37.13 81.12 Favored 'General case' 0 N--CA 1.454 -0.272 0 CA-C-O 118.791 -0.623 . . . . 0.0 112.172 -176.202 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 15.6 pt -69.33 -41.54 80.98 Favored 'Isoleucine or valine' 0 C--O 1.23 0.076 0 CA-C-N 119.168 0.895 . . . . 0.0 110.597 179.901 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 27.5 pt -71.48 -39.75 71.3 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.178 0 C-N-CA 120.084 -0.647 . . . . 0.0 110.646 179.164 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 90.1 m-20 -68.19 -41.67 81.05 Favored 'General case' 0 N--CA 1.452 -0.33 0 CA-C-N 118.1 0.409 . . . . 0.0 112.002 -179.93 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 53' ' ' TYR . . . . . 0.495 ' CE1' ' HG2' ' A' ' 18' ' ' LYS . 8.5 t80 -67.1 -47.04 72.42 Favored 'General case' 0 N--CA 1.453 -0.292 0 N-CA-C 109.202 -0.666 . . . . 0.0 109.202 178.512 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 39.8 t -65.19 -28.16 69.2 Favored 'General case' 0 N--CA 1.453 -0.288 0 N-CA-C 111.589 0.218 . . . . 0.0 111.589 -178.052 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 55.7 ttp85 -75.48 -41.46 55.44 Favored 'General case' 0 N--CA 1.454 -0.232 0 C-N-CA 123.405 0.682 . . . . 0.0 112.251 -179.078 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 46.8 mt -86.98 -43.54 12.28 Favored 'General case' 0 C--O 1.227 -0.111 0 N-CA-C 112.541 0.571 . . . . 0.0 112.541 -176.448 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 8.2 p -66.48 156.8 84.83 Favored Pre-proline 0 CA--C 1.538 0.486 0 N-CA-C 113.416 0.895 . . . . 0.0 113.416 -172.666 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 87.2 Cg_endo -73.49 173.3 14.06 Favored 'Trans proline' 0 N--CA 1.456 -0.711 0 C-N-CA 124.707 3.605 . . . . 0.0 111.048 178.887 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -51.78 -42.78 62.68 Favored 'General case' 0 CA--C 1.53 0.197 0 N-CA-C 113.581 0.956 . . . . 0.0 113.581 -172.96 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 51.0 m -66.88 -40.39 87.78 Favored 'General case' 0 N--CA 1.455 -0.189 0 CA-C-N 118.076 0.398 . . . . 0.0 110.283 -177.006 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 39.9 m170 -75.78 -24.11 55.97 Favored 'General case' 0 N--CA 1.45 -0.44 0 N-CA-C 109.89 -0.411 . . . . 0.0 109.89 177.272 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 62' ' ' LYS . . . . . 0.405 ' HB2' ' HE2' ' A' ' 62' ' ' LYS . 19.7 ttmm -73.61 -34.02 64.86 Favored 'General case' 0 N--CA 1.454 -0.257 0 C-N-CA 123.744 0.817 . . . . 0.0 109.595 178.51 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -66.54 -45.18 80.28 Favored 'General case' 0 CA--C 1.53 0.186 0 N-CA-C 107.334 -1.358 . . . . 0.0 107.334 172.719 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -64.96 -30.45 78.04 Favored Glycine 0 C--N 1.34 0.768 0 N-CA-C 111.193 -0.763 . . . . 0.0 111.193 179.241 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 59.4 m -67.54 -40.63 85.02 Favored 'General case' 0 N--CA 1.454 -0.255 0 N-CA-C 109.419 -0.586 . . . . 0.0 109.419 177.649 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 59.6 mt -70.82 -24.05 62.47 Favored 'General case' 0 N--CA 1.452 -0.326 0 N-CA-C 110.187 -0.301 . . . . 0.0 110.187 178.885 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -72.43 -37.91 68.47 Favored 'General case' 0 C--O 1.231 0.101 0 CA-C-N 117.932 0.333 . . . . 0.0 110.105 175.421 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 68' ' ' ILE . . . . . 0.535 HD11 ' CD1' ' A' ' 17' ' ' PHE . 18.2 mt -68.48 -44.94 82.79 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.342 0 N-CA-C 109.114 -0.699 . . . . 0.0 109.114 176.609 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 76.2 mt -58.34 -32.01 44.06 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.114 0 C-N-CA 123.156 0.582 . . . . 0.0 110.748 175.791 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 19.7 t70 -69.57 -47.11 64.72 Favored 'General case' 0 N--CA 1.454 -0.263 0 CA-C-N 117.967 0.349 . . . . 0.0 111.325 179.696 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 99.2 p -71.59 -47.35 55.38 Favored 'General case' 0 N--CA 1.449 -0.503 0 C-N-CA 121.092 -0.243 . . . . 0.0 110.73 -176.538 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -75.66 -34.04 27.88 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.28 0 N-CA-C 109.879 -0.415 . . . . 0.0 109.879 -178.539 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -66.23 -52.41 36.5 Favored Glycine 0 C--N 1.334 0.466 0 N-CA-C 111.248 -0.741 . . . . 0.0 111.248 -175.745 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 44.5 mtm105 -71.46 -38.65 71.26 Favored 'General case' 0 N--CA 1.451 -0.408 0 CA-C-O 119.168 -0.444 . . . . 0.0 110.767 -179.926 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -63.16 -30.94 71.99 Favored 'General case' 0 N--CA 1.451 -0.401 0 C-N-CA 119.763 -0.775 . . . . 0.0 109.972 -179.231 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 1.8 m-30 -69.76 -52.14 27.94 Favored 'General case' 0 N--CA 1.454 -0.234 0 CA-C-O 119.265 -0.398 . . . . 0.0 110.965 176.473 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 8.0 tt -70.28 -45.53 66.17 Favored 'General case' 0 N--CA 1.448 -0.547 0 C-N-CA 117.328 -1.749 . . . . 0.0 109.458 -176.474 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 91.0 m-20 -56.96 -47.64 80.25 Favored 'General case' 0 N--CA 1.455 -0.189 0 CA-C-O 119.17 -0.443 . . . . 0.0 111.795 -176.244 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 75.5 mm-40 -70.41 -41.38 73.05 Favored 'General case' 0 N--CA 1.455 -0.22 0 CA-C-N 118.498 0.59 . . . . 0.0 111.902 -179.614 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 80.9 p -72.38 -28.14 62.82 Favored 'General case' 0 CA--C 1.529 0.148 0 CA-C-N 118.804 0.729 . . . . 0.0 111.574 -179.429 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 5.7 tmm_? -82.48 -35.05 27.79 Favored 'General case' 0 N--CA 1.457 -0.09 0 C-N-CA 123.22 0.608 . . . . 0.0 111.48 179.372 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 40.0 t -90.47 -34.68 15.49 Favored 'General case' 0 N--CA 1.457 -0.082 0 N-CA-C 113.086 0.773 . . . . 0.0 113.086 -179.326 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 28.7 m-20 -134.03 174.95 9.93 Favored 'General case' 0 N--CA 1.452 -0.338 0 CA-C-O 121.251 0.548 . . . . 0.0 112.346 -167.729 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 44.6 t -65.42 157.33 29.68 Favored 'General case' 0 N--CA 1.455 -0.192 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.324 178.9 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 8.8 p30 -154.77 -172.51 4.22 Favored 'General case' 0 N--CA 1.453 -0.284 0 N-CA-C 109.359 -0.608 . . . . 0.0 109.359 -176.553 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 38.5 t -59.66 -16.84 29.24 Favored 'General case' 0 CA--C 1.532 0.27 0 C-N-CA 123.125 0.57 . . . . 0.0 112.0 -176.396 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 33.7 t 52.85 29.14 7.25 Favored 'General case' 0 CA--C 1.532 0.285 0 N-CA-C 113.389 0.885 . . . . 0.0 113.389 174.919 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 43.2 t -65.39 162.7 17.16 Favored 'General case' 0 N--CA 1.453 -0.302 0 C-N-CA 122.596 0.358 . . . . 0.0 111.123 -179.963 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 72.1 m-20 -65.79 -34.21 77.64 Favored 'General case' 0 N--CA 1.454 -0.266 0 C-N-CA 122.533 0.333 . . . . 0.0 111.735 -175.827 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 90' ' ' LYS . . . . . 0.448 ' HB3' ' CD ' ' A' ' 91' ' ' PRO . 55.1 tptt -161.06 -67.63 0.02 OUTLIER Pre-proline 0 CA--C 1.535 0.396 0 CA-C-O 117.861 -1.066 . . . . 0.0 111.187 176.47 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 91' ' ' PRO . . . . . 0.448 ' CD ' ' HB3' ' A' ' 90' ' ' LYS . 83.7 Cg_endo -73.32 152.93 50.39 Favored 'Trans proline' 0 N--CA 1.453 -0.877 0 C-N-CA 122.523 2.148 . . . . 0.0 108.94 174.819 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 88.64 15.33 60.05 Favored Glycine 0 CA--C 1.526 0.762 0 C-N-CA 121.186 -0.53 . . . . 0.0 112.175 -177.753 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -152.48 164.35 37.75 Favored 'General case' 0 N--CA 1.455 -0.187 0 C-N-CA 124.025 0.93 . . . . 0.0 110.042 179.679 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 94' ' ' CYS . . . . . 0.593 ' SG ' HD13 ' A' ' 98' ' ' ILE . 2.5 t -52.63 -26.47 13.74 Favored 'General case' 0 N--CA 1.453 -0.317 0 C-N-CA 123.316 0.646 . . . . 0.0 110.716 175.93 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -55.74 -58.76 6.48 Favored 'General case' 0 N--CA 1.449 -0.501 0 O-C-N 122.164 -0.335 . . . . 0.0 110.598 -176.98 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 76.3 t60 -75.49 -32.96 60.74 Favored 'General case' 0 N--CA 1.453 -0.306 0 O-C-N 122.286 -0.259 . . . . 0.0 111.117 -179.833 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -65.4 -51.86 57.45 Favored 'General case' 0 N--CA 1.449 -0.493 0 O-C-N 122.977 0.173 . . . . 0.0 111.453 -176.255 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 98' ' ' ILE . . . . . 0.593 HD13 ' SG ' ' A' ' 94' ' ' CYS . 1.7 mp -72.03 -34.18 49.67 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.153 0 N-CA-C 110.18 -0.304 . . . . 0.0 110.18 -179.248 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 1.7 m120 -66.87 -46.18 75.78 Favored 'General case' 0 N--CA 1.452 -0.355 0 C-N-CA 120.319 -0.552 . . . . 0.0 111.304 178.281 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 87.8 m -67.95 -35.03 77.7 Favored 'General case' 0 N--CA 1.456 -0.125 0 CA-C-N 118.077 0.399 . . . . 0.0 110.896 -176.319 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 57.7 tp -75.9 -39.83 55.57 Favored 'General case' 0 N--CA 1.449 -0.489 0 CA-C-O 119.779 -0.153 . . . . 0.0 111.05 -179.261 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -66.37 -16.09 64.49 Favored Glycine 0 CA--C 1.528 0.849 0 CA-C-O 119.634 -0.537 . . . . 0.0 112.717 -175.549 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 103' ' ' GLU . . . . . 0.417 ' HA ' ' HE3' ' A' ' 139' ' ' LYS . 14.9 mm-40 -78.83 -34.77 44.9 Favored 'General case' 0 N--CA 1.455 -0.211 0 CA-C-N 117.754 0.777 . . . . 0.0 112.133 179.908 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 18.9 m -112.44 3.47 8.4 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.135 0 O-C-N 124.007 0.817 . . . . 0.0 112.88 -174.027 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 105' ' ' ILE . . . . . . . . . . . . . 10.9 tp -68.93 -26.93 33.68 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.224 0 O-C-N 121.927 -0.483 . . . . 0.0 111.49 -177.915 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 14.1 pt20 -70.32 -31.56 68.93 Favored 'General case' 0 N--CA 1.455 -0.214 0 O-C-N 121.786 -0.571 . . . . 0.0 110.085 -178.888 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 48.4 mp0 -71.49 -38.74 71.15 Favored 'General case' 0 N--CA 1.451 -0.394 0 CA-C-N 118.256 0.48 . . . . 0.0 110.32 177.705 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 87.3 mt -74.11 -36.24 64.2 Favored 'General case' 0 N--CA 1.455 -0.212 0 N-CA-C 110.669 -0.122 . . . . 0.0 110.669 -178.401 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 87.6 mt -71.58 -47.7 53.14 Favored 'General case' 0 N--CA 1.452 -0.344 0 C-N-CA 120.874 -0.33 . . . . 0.0 110.295 176.133 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 48.3 t -57.16 -40.34 77.06 Favored 'General case' 0 N--CA 1.457 -0.105 0 C-N-CA 122.435 0.294 . . . . 0.0 110.604 179.716 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 39.8 t0 -64.12 -42.75 96.72 Favored 'General case' 0 N--CA 1.453 -0.282 0 N-CA-C 109.256 -0.646 . . . . 0.0 109.256 176.156 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -70.79 -39.01 73.39 Favored 'General case' 0 N--CA 1.445 -0.68 0 CA-C-O 119.141 -0.457 . . . . 0.0 111.36 -175.252 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 113' ' ' ILE . . . . . . . . . . . . . 12.1 mm -68.65 -38.53 79.12 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.276 0 CA-C-N 119.592 1.087 . . . . 0.0 109.75 -179.308 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -67.2 -47.6 70.41 Favored 'General case' 0 N--CA 1.45 -0.464 0 C-N-CA 122.839 0.456 . . . . 0.0 111.707 178.234 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 115' ' ' LYS . . . . . 0.588 ' HE2' ' HA ' ' A' ' 115' ' ' LYS . 0.3 OUTLIER -84.05 -34.79 24.16 Favored 'General case' 0 N--CA 1.455 -0.194 0 N-CA-C 114.018 1.118 . . . . 0.0 114.018 -172.907 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 116' ' ' SER . . . . . 0.453 ' HB2' ' CB ' ' A' ' 120' ' ' HIS . 28.3 p -77.63 159.42 29.21 Favored 'General case' 0 CA--C 1.528 0.121 0 N-CA-C 112.527 0.565 . . . . 0.0 112.527 -172.505 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 53.8 t30 -80.35 164.58 23.02 Favored 'General case' 0 C--O 1.225 -0.22 0 C-N-CA 123.713 0.805 . . . . 0.0 111.127 -178.461 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 118' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -44.76 -48.86 10.85 Favored 'General case' 0 N--CA 1.455 -0.197 0 C-N-CA 124.034 0.934 . . . . 0.0 113.05 -179.176 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 49.8 t0 -60.76 -39.69 89.68 Favored 'General case' 0 CA--C 1.531 0.217 0 CA-C-O 121.002 0.429 . . . . 0.0 110.192 178.51 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 120' ' ' HIS . . . . . 0.453 ' CB ' ' HB2' ' A' ' 116' ' ' SER . 24.9 m170 -68.67 -40.8 79.96 Favored 'General case' 0 N--CA 1.451 -0.38 0 N-CA-C 109.69 -0.485 . . . . 0.0 109.69 -179.053 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 94.8 mttt -59.26 -34.6 72.44 Favored 'General case' 0 C--N 1.339 0.127 0 N-CA-C 109.446 -0.576 . . . . 0.0 109.446 178.87 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 24.2 tt0 -67.58 -45.98 73.97 Favored 'General case' 0 N--CA 1.455 -0.193 0 C-N-CA 122.527 0.331 . . . . 0.0 110.766 179.134 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 14.4 mptt -68.18 -35.42 77.99 Favored 'General case' 0 C--N 1.338 0.099 0 C-N-CA 120.42 -0.512 . . . . 0.0 110.386 -177.753 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 124' ' ' ILE . . . . . . . . . . . . . 63.5 mt -66.7 -38.52 81.74 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.207 0 N-CA-C 108.96 -0.756 . . . . 0.0 108.96 177.513 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 125' ' ' ARG . . . . . 0.442 ' HD2' ' HA ' ' A' ' 125' ' ' ARG . 25.0 tpt85 -66.39 -42.22 88.21 Favored 'General case' 0 N--CA 1.443 -0.776 0 N-CA-C 111.849 0.314 . . . . 0.0 111.849 -172.431 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 126' ' ' MET . . . . . . . . . . . . . 27.1 ptm -67.13 -33.28 75.1 Favored 'General case' 0 N--CA 1.45 -0.436 0 N-CA-C 108.965 -0.754 . . . . 0.0 108.965 175.606 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 2.7 mp -61.92 -34.55 76.28 Favored 'General case' 0 CA--C 1.53 0.203 0 CA-C-O 119.271 -0.395 . . . . 0.0 110.146 176.227 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 53.6 mt -68.1 -43.46 78.4 Favored 'General case' 0 N--CA 1.455 -0.201 0 CA-C-N 119.139 0.881 . . . . 0.0 110.459 178.743 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 55.3 m-20 -65.47 -37.74 87.74 Favored 'General case' 0 CA--C 1.529 0.163 0 C-N-CA 120.314 -0.555 . . . . 0.0 110.042 177.925 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 130' ' ' ILE . . . . . 0.46 ' HA ' ' HD3' ' A' ' 133' ' ' ARG . 53.1 mt -63.06 -36.39 75.65 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.319 0 C-N-CA 122.766 0.426 . . . . 0.0 110.297 178.516 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 131' ' ' TRP . . . . . . . . . . . . . 51.4 m0 -74.55 -34.86 63.06 Favored 'General case' 0 N--CA 1.453 -0.299 0 N-CA-C 112.522 0.564 . . . . 0.0 112.522 -179.27 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 90.1 m-20 -68.21 -28.42 67.23 Favored 'General case' 0 CA--C 1.53 0.188 0 CA-C-N 118.541 0.609 . . . . 0.0 110.531 175.789 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 133' ' ' ARG . . . . . 0.475 ' HB2' HD13 ' B' 2062 ' ' ILE . 13.3 mtp180 -72.42 -33.5 67.16 Favored 'General case' 0 N--CA 1.457 -0.087 0 C-N-CA 122.774 0.43 . . . . 0.0 110.832 177.301 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 30.4 t -74.37 -18.8 60.63 Favored 'General case' 0 CA--C 1.531 0.224 0 CA-C-N 118.014 0.37 . . . . 0.0 110.676 173.449 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 135' ' ' GLY . . . . . . . . . . . . . . . 87.18 17.97 58.29 Favored Glycine 0 CA--C 1.528 0.89 0 CA-C-O 119.423 -0.654 . . . . 0.0 112.221 -179.257 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 136' ' ' LEU . . . . . . . . . . . . . 42.6 mt -62.68 132.79 53.5 Favored 'General case' 0 N--CA 1.456 -0.15 0 CA-C-N 117.959 0.879 . . . . 0.0 110.174 179.641 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 137' ' ' PHE . . . . . . . . . . . . . 78.1 t80 -75.34 128.22 34.89 Favored 'General case' 0 N--CA 1.451 -0.4 0 N-CA-C 109.148 -0.686 . . . . 0.0 109.148 175.529 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 138' ' ' GLN . . . . . . . . . . . . . 20.7 pt20 -159.46 151.53 20.81 Favored 'General case' 0 N--CA 1.45 -0.427 0 CA-C-O 120.803 0.335 . . . . 0.0 111.183 -179.61 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 139' ' ' LYS . . . . . 0.417 ' HE3' ' HA ' ' A' ' 103' ' ' GLU . 95.1 mttt -84.49 17.12 2.77 Favored 'General case' 0 N--CA 1.457 -0.125 0 C-N-CA 123.706 0.803 . . . . 0.0 110.494 175.306 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 140' ' ' SER . . . . . . . . . . . . . 33.1 t -70.37 27.5 0.03 OUTLIER 'General case' 0 CA--C 1.531 0.216 0 C-N-CA 124.205 1.002 . . . . 0.0 113.356 -174.805 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 141' ' ' TYR . . . . . . . . . . . . . 12.3 m-85 -121.35 -6.52 9.32 Favored 'General case' 0 N--CA 1.454 -0.261 0 O-C-N 122.173 -0.329 . . . . 0.0 111.824 -176.93 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 142' ' ' LEU . . . . . . . . . . . . . 9.4 mp -79.47 163.07 25.04 Favored 'General case' 0 N--CA 1.454 -0.225 0 CA-C-O 121.059 0.457 . . . . 0.0 110.757 178.881 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 76.3 m-20 -66.64 -15.69 63.65 Favored 'General case' 0 CA--C 1.529 0.145 0 N-CA-C 112.442 0.534 . . . . 0.0 112.442 -178.372 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . -65.42 -31.79 73.08 Favored 'General case' 0 N--CA 1.452 -0.339 0 N-CA-C 110.115 -0.328 . . . . 0.0 110.115 179.546 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 145' ' ' ILE . . . . . . . . . . . . . 37.0 mm -64.47 -30.84 51.3 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.35 0 C-N-CA 122.462 0.305 . . . . 0.0 110.523 178.044 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 146' ' ' ARG . . . . . . . . . . . . . 7.4 mpt_? -75.51 -58.18 3.44 Favored 'General case' 0 N--CA 1.453 -0.302 0 N-CA-C 109.808 -0.441 . . . . 0.0 109.808 -179.626 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 147' ' ' SER . . . . . . . . . . . . . 69.9 m 38.77 44.68 0.84 Allowed 'General case' 0 C--N 1.341 0.23 0 C-N-CA 123.238 0.615 . . . . 0.0 111.723 -179.02 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 148' ' ' LYS . . . . . 0.623 ' HD3' ' H ' ' A' ' 148' ' ' LYS . 0.0 OUTLIER -52.18 -23.84 6.18 Favored 'General case' 0 N--CA 1.456 -0.134 0 C-N-CA 124.045 0.938 . . . . 0.0 112.466 -175.695 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 149' ' ' CYS . . . . . . . . . . . . . 59.9 m -66.11 -61.31 2.1 Favored 'General case' 0 N--CA 1.451 -0.383 0 N-CA-C 109.552 -0.536 . . . . 0.0 109.552 -179.771 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 150' ' ' PHE . . . . . . . . . . . . . 9.4 m-85 -62.61 -29.91 70.95 Favored 'General case' 0 N--CA 1.454 -0.254 0 CA-C-O 120.463 0.173 . . . . 0.0 110.716 -177.114 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 151' ' ' ALA . . . . . . . . . . . . . . . -67.5 -35.73 79.69 Favored 'General case' 0 N--CA 1.452 -0.369 0 CA-C-N 116.747 -0.206 . . . . 0.0 110.574 -179.644 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 152' ' ' MET . . . . . . . . . . . . . 5.2 mmt -88.67 -14.23 37.86 Favored 'General case' 0 CA--C 1.529 0.171 0 N-CA-C 111.935 0.346 . . . . 0.0 111.935 178.493 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 153' ' ' ASP . . . . . . . . . . . . . 94.7 m-20 -75.75 -22.59 56.37 Favored 'General case' 0 CA--C 1.531 0.218 0 N-CA-C 112.906 0.706 . . . . 0.0 112.906 179.507 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 154' ' ' LEU . . . . . . . . . . . . . 39.9 mt -109.37 4.82 22.94 Favored 'General case' 0 C--N 1.34 0.169 0 N-CA-C 113.811 1.041 . . . . 0.0 113.811 -173.22 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 155' ' ' GLU . . . . . . . . . . . . . 23.1 pt-20 -161.57 171.37 18.17 Favored 'General case' 0 C--N 1.33 -0.277 0 C-N-CA 122.71 0.404 . . . . 0.0 110.903 177.104 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 156' ' ' HIS . . . . . . . . . . . . . 69.7 t60 -62.1 154.34 27.31 Favored 'General case' 0 N--CA 1.454 -0.245 0 CA-C-O 120.928 0.394 . . . . 0.0 110.841 179.927 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 157' ' ' HIS . . . . . . . . . . . . . 2.9 m-70 -79.78 18.64 0.75 Allowed 'General case' 0 CA--C 1.531 0.221 0 N-CA-C 112.738 0.644 . . . . 0.0 112.738 -174.274 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 158' ' ' HIS . . . . . . . . . . . . . 17.7 m170 61.62 11.04 3.65 Favored 'General case' 0 CA--C 1.53 0.184 0 C-N-CA 124.388 1.075 . . . . 0.0 113.312 179.611 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 159' ' ' HIS . . . . . . . . . . . . . 56.6 m170 . . . . . 0 C--O 1.251 1.139 0 CA-C-O 117.313 -1.327 . . . . 0.0 110.595 178.054 . . . . . . . . 0 0 . 1 . 014 nuclear build full ' B' B 2052 ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 N--CA 1.471 0.589 0 N-CA-C 109.767 -0.457 . . . . 0.0 109.767 . . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B 2053 ' ' ASP . . . . . 0.436 ' CB ' HH22 ' A' ' 28' ' ' ARG . 3.9 m-20 59.69 -73.67 0.03 OUTLIER 'General case' 0 CA--C 1.53 0.192 0 C-N-CA 125.317 1.447 . . . . 0.0 114.3 -179.729 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B 2054 ' ' ASP . . . . . . . . . . . . . 41.9 p-10 -155.6 149.13 25.02 Favored 'General case' 0 N--CA 1.453 -0.307 0 C-N-CA 122.988 0.515 . . . . 0.0 111.811 -172.161 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B 2055 ' ' GLU . . . . . . . . . . . . . 47.2 mt-10 43.99 45.04 6.43 Favored 'General case' 0 C--N 1.339 0.113 0 C-N-CA 124.058 0.943 . . . . 0.0 112.331 175.745 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B 2056 ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -62.15 -1.47 0.72 Allowed 'General case' 0 CA--C 1.536 0.422 0 C-N-CA 122.988 0.515 . . . . 0.0 112.108 -177.999 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B 2057 ' ' ASP . . . . . . . . . . . . . 64.3 t0 -154.0 103.76 2.6 Favored 'General case' 0 N--CA 1.453 -0.281 0 N-CA-C 107.382 -1.34 . . . . 0.0 107.382 168.367 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B 2058 ' ' TYR . . . . . . . . . . . . . 0.8 OUTLIER -70.8 -0.62 9.4 Favored 'General case' 0 CA--C 1.529 0.145 0 N-CA-C 111.942 0.349 . . . . 0.0 111.942 -176.139 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B 2059 ' ' THR . . . . . . . . . . . . . 56.0 m 56.0 76.4 0.5 Allowed Pre-proline 0 CA--C 1.531 0.213 0 C-N-CA 124.318 1.047 . . . . 0.0 110.849 178.239 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B 2060 ' ' PRO . . . . . . . . . . . . . 57.9 Cg_endo -65.09 146.67 87.62 Favored 'Trans proline' 0 N--CA 1.451 -1.004 0 C-N-CA 123.306 2.671 . . . . 0.0 110.592 179.385 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B 2061 ' ' SER . . . . . . . . . . . . . 48.0 t -156.15 154.87 31.55 Favored 'General case' 0 N--CA 1.456 -0.154 0 N-CA-C 109.925 -0.398 . . . . 0.0 109.925 -178.767 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B 2062 ' ' ILE . . . . . 0.475 HD13 ' HB2' ' A' ' 133' ' ' ARG . 15.1 tt -164.64 161.91 0.89 Allowed 'Isoleucine or valine' 0 N--CA 1.455 -0.211 0 N-CA-C 108.777 -0.823 . . . . 0.0 108.777 -178.496 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B 2063 ' ' SER . . . . . . . . . . . . . 80.7 p . . . . . 0 C--O 1.252 1.199 0 CA-C-O 117.484 -1.246 . . . . 0.0 109.739 174.84 . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 74.2 mtm . . . . . 0 N--CA 1.476 0.826 0 N-CA-C 109.841 -0.429 . . . . 0.0 109.841 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 3.4 pm0 -63.01 -22.05 66.58 Favored 'General case' 0 N--CA 1.455 -0.195 0 C-N-CA 124.341 1.056 . . . . 0.0 109.932 173.312 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 3' ' ' GLN . . . . . 0.511 ' HG2' ' H ' ' A' ' 4' ' ' ASP . 6.6 tt0 -162.62 -174.15 3.85 Favored 'General case' 0 N--CA 1.45 -0.463 0 N-CA-C 106.545 -1.65 . . . . 0.0 106.545 177.819 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 4' ' ' ASP . . . . . 0.511 ' H ' ' HG2' ' A' ' 3' ' ' GLN . 12.1 p-10 -72.92 122.16 21.2 Favored 'General case' 0 N--CA 1.452 -0.336 0 N-CA-C 108.309 -0.997 . . . . 0.0 108.309 173.898 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 65.5 m-20 -78.26 10.6 2.9 Favored 'General case' 0 CA--C 1.521 -0.159 0 N-CA-C 114.715 1.376 . . . . 0.0 114.715 -169.892 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 23.1 p-10 -93.19 -42.7 9.22 Favored 'General case' 0 C--N 1.328 -0.348 0 N-CA-C 106.835 -1.543 . . . . 0.0 106.835 170.816 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 7' ' ' PHE . . . . . 0.44 ' CE1' HD22 ' A' ' 49' ' ' LEU . 0.7 OUTLIER -75.05 -34.3 61.82 Favored 'General case' 0 N--CA 1.441 -0.886 0 CA-C-N 115.341 -0.845 . . . . 0.0 110.129 -179.023 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 60.5 tp60 -48.19 -39.84 22.27 Favored 'General case' 0 CA--C 1.529 0.163 0 C-N-CA 123.984 0.914 . . . . 0.0 112.125 -175.427 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 4.1 m-80 -70.16 -38.65 75.49 Favored 'General case' 0 CA--C 1.529 0.173 0 CA-C-O 121.264 0.554 . . . . 0.0 110.283 -178.867 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 1.8 t80 -70.82 -37.38 73.2 Favored 'General case' 0 N--CA 1.451 -0.425 0 C-N-CA 124.289 1.036 . . . . 0.0 109.601 179.503 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 74.9 t -68.6 -52.9 31.26 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.302 0 N-CA-C 108.872 -0.788 . . . . 0.0 108.872 179.322 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -57.91 -31.43 66.77 Favored 'General case' 0 N--CA 1.453 -0.29 0 CA-C-N 117.78 0.264 . . . . 0.0 111.519 -179.135 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 82.9 m -69.31 -42.67 75.1 Favored 'General case' 0 CA--C 1.534 0.332 0 N-CA-C 109.015 -0.735 . . . . 0.0 109.015 175.366 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.459 HD11 ' CD2' ' A' ' 53' ' ' TYR . 0.1 OUTLIER -64.09 -40.23 95.77 Favored 'General case' 0 N--CA 1.454 -0.232 0 C-N-CA 122.947 0.499 . . . . 0.0 110.039 179.152 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 73.1 mm-40 -65.27 -32.5 74.19 Favored 'General case' 0 N--CA 1.451 -0.38 0 C-N-CA 123.565 0.746 . . . . 0.0 109.702 179.558 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 16.2 p -65.14 -34.28 78.02 Favored 'General case' 0 N--CA 1.454 -0.253 0 N-CA-C 109.537 -0.542 . . . . 0.0 109.537 176.068 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 17' ' ' PHE . . . . . 0.536 ' CD1' HD11 ' A' ' 68' ' ' ILE . 14.8 m-30 -67.18 -34.26 77.15 Favored 'General case' 0 N--CA 1.458 -0.038 0 C-N-CA 121.187 -0.205 . . . . 0.0 111.529 175.845 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 18' ' ' LYS . . . . . 0.513 ' HG2' ' CE1' ' A' ' 53' ' ' TYR . 53.2 mttt -68.99 -24.9 64.28 Favored 'General case' 0 C--O 1.227 -0.089 0 N-CA-C 110.084 -0.339 . . . . 0.0 110.084 175.172 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 30.6 t0 -78.43 -23.9 46.41 Favored 'General case' 0 CA--C 1.534 0.359 0 C-N-CA 123.106 0.563 . . . . 0.0 111.811 178.23 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 93.3 mt -75.53 164.93 25.84 Favored 'General case' 0 CA--C 1.529 0.17 0 CA-C-O 121.132 0.492 . . . . 0.0 111.196 179.101 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -94.01 -45.53 7.55 Favored 'General case' 0 N--CA 1.455 -0.212 0 N-CA-C 108.573 -0.899 . . . . 0.0 108.573 177.533 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 53.9 m -80.43 -16.35 54.62 Favored 'General case' 0 CA--C 1.529 0.139 0 C-N-CA 122.949 0.5 . . . . 0.0 111.563 -179.235 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 72.6 -29.05 0.73 Allowed Glycine 0 CA--C 1.529 0.963 0 C-N-CA 124.29 0.948 . . . . 0.0 113.203 178.134 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 94.6 mt -75.81 147.54 7.95 Favored 'Isoleucine or valine' 0 C--N 1.339 0.109 0 CA-C-N 117.94 0.87 . . . . 0.0 109.455 177.028 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 6.4 t -163.7 78.23 0.41 Allowed 'General case' 0 N--CA 1.453 -0.312 0 N-CA-C 110.322 -0.251 . . . . 0.0 110.322 -178.495 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -45.72 -52.74 9.12 Favored Glycine 0 CA--C 1.527 0.798 0 CA-C-O 118.928 -0.929 . . . . 0.0 114.126 -170.63 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 37.8 t -65.5 -45.04 85.12 Favored 'General case' 0 N--CA 1.456 -0.157 0 CA-C-N 119.432 1.616 . . . . 0.0 110.918 -175.374 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 17.1 mtm180 -70.48 -37.64 74.26 Favored 'General case' 0 CA--C 1.527 0.091 0 CA-C-O 119.385 -0.341 . . . . 0.0 111.228 -179.356 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 63.4 mt -56.5 -43.92 79.25 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.474 0 N-CA-C 108.185 -1.042 . . . . 0.0 108.185 172.105 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 46.0 mtmt -70.81 -19.3 62.69 Favored 'General case' 0 N--CA 1.452 -0.337 0 CA-C-O 118.653 -0.689 . . . . 0.0 111.753 179.382 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 31' ' ' LYS . . . . . 0.518 ' HE3' ' HA ' ' A' ' 31' ' ' LYS . 0.0 OUTLIER -69.32 -55.17 11.21 Favored 'General case' 0 C--N 1.343 0.284 0 CA-C-N 119.223 0.919 . . . . 0.0 109.585 174.793 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.422 HD12 ' N ' ' A' ' 33' ' ' THR . 3.2 pp -75.18 -19.71 59.69 Favored 'General case' 0 N--CA 1.456 -0.145 0 C-N-CA 119.567 -0.853 . . . . 0.0 111.177 -178.773 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 33' ' ' THR . . . . . 0.422 ' N ' HD12 ' A' ' 32' ' ' LEU . 53.3 m -71.84 -43.18 65.97 Favored 'General case' 0 N--CA 1.453 -0.314 0 N-CA-C 108.923 -0.769 . . . . 0.0 108.923 175.535 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 80.6 m -67.39 -37.53 83.27 Favored 'General case' 0 N--CA 1.453 -0.284 0 O-C-N 122.359 -0.213 . . . . 0.0 110.449 -177.7 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 81.0 t80 -68.68 -34.42 75.65 Favored 'General case' 0 N--CA 1.45 -0.467 0 O-C-N 122.285 -0.259 . . . . 0.0 110.493 177.451 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -68.48 -36.18 78.58 Favored 'General case' 0 N--CA 1.451 -0.421 0 O-C-N 122.288 -0.257 . . . . 0.0 110.352 177.688 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -69.86 -33.84 72.8 Favored 'General case' 0 N--CA 1.455 -0.208 0 C-N-CA 122.729 0.412 . . . . 0.0 110.32 179.357 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 43.5 t0 -69.44 -21.59 63.72 Favored 'General case' 0 N--CA 1.451 -0.393 0 C-N-CA 122.564 0.346 . . . . 0.0 110.767 176.129 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 95.6 m-70 -150.67 95.62 2.25 Favored 'General case' 0 C--N 1.341 0.22 0 N-CA-C 112.208 0.447 . . . . 0.0 112.208 -175.413 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 40' ' ' ILE . . . . . 0.617 ' H ' HD13 ' A' ' 40' ' ' ILE . 0.0 OUTLIER -74.28 -13.28 15.64 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.291 0 CA-C-O 119.529 -0.272 . . . . 0.0 110.311 175.09 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 19.1 m-20 -57.68 -22.46 46.16 Favored 'General case' 0 N--CA 1.456 -0.131 0 C-N-CA 122.975 0.51 . . . . 0.0 112.104 -176.997 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -108.77 18.38 6.6 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.185 0 C-N-CA 122.897 0.479 . . . . 0.0 112.255 178.384 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 3.1 pp20? -52.85 -27.58 19.03 Favored 'General case' 0 C--O 1.226 -0.165 0 CA-C-N 118.365 0.529 . . . . 0.0 109.582 174.785 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 90.3 p -58.94 -55.11 39.42 Favored 'General case' 0 N--CA 1.453 -0.294 0 C-N-CA 123.668 0.787 . . . . 0.0 111.315 -178.708 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 45' ' ' LYS . . . . . 0.435 ' HD3' ' CD1' ' A' ' 7' ' ' PHE . 17.0 ptpt -73.76 -21.5 60.17 Favored 'General case' 0 C--N 1.338 0.108 0 O-C-N 122.298 -0.251 . . . . 0.0 110.98 -179.858 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 93.5 mt -74.37 -45.61 46.01 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.198 0 N-CA-C 110.045 -0.354 . . . . 0.0 110.045 -179.81 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 34.6 mm -66.35 -38.85 82.71 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.126 0 N-CA-C 109.422 -0.584 . . . . 0.0 109.422 178.66 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 27.4 t -63.05 -38.92 93.11 Favored 'General case' 0 N--CA 1.453 -0.278 0 C-N-CA 119.657 -0.817 . . . . 0.0 109.887 177.332 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 49' ' ' LEU . . . . . 0.44 HD22 ' CE1' ' A' ' 7' ' ' PHE . 32.7 tp -72.03 -31.89 66.61 Favored 'General case' 0 N--CA 1.449 -0.52 0 N-CA-C 112.615 0.598 . . . . 0.0 112.615 -173.772 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 14.4 pt -70.82 -41.34 77.33 Favored 'Isoleucine or valine' 0 C--N 1.34 0.169 0 CA-C-N 118.785 0.72 . . . . 0.0 110.099 175.996 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 42.4 pt -71.38 -37.74 66.24 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.171 0 C-N-CA 119.875 -0.73 . . . . 0.0 110.85 179.664 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 84.5 m-20 -65.37 -44.99 85.88 Favored 'General case' 0 C--O 1.233 0.214 0 CA-C-N 117.927 0.331 . . . . 0.0 111.307 177.849 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 53' ' ' TYR . . . . . 0.513 ' CE1' ' HG2' ' A' ' 18' ' ' LYS . 9.3 t80 -60.64 -42.94 97.94 Favored 'General case' 0 C--N 1.34 0.189 0 N-CA-C 108.893 -0.78 . . . . 0.0 108.893 176.365 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 25.0 m -69.21 -26.93 65.06 Favored 'General case' 0 N--CA 1.453 -0.319 0 C-N-CA 122.197 0.199 . . . . 0.0 111.479 -177.899 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 51.9 tpt85 -75.78 -35.13 60.21 Favored 'General case' 0 N--CA 1.455 -0.194 0 O-C-N 121.985 -0.447 . . . . 0.0 111.336 -178.697 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 32.4 mt -89.08 -43.17 11.27 Favored 'General case' 0 N--CA 1.457 -0.113 0 N-CA-C 112.772 0.656 . . . . 0.0 112.772 -177.548 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 57' ' ' CYS . . . . . 0.44 ' HB2' ' CB ' ' A' ' 61' ' ' HIS . 3.4 p -65.89 157.86 78.08 Favored Pre-proline 0 CA--C 1.536 0.422 0 N-CA-C 114.981 1.474 . . . . 0.0 114.981 -169.715 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 58' ' ' PRO . . . . . 0.415 ' HD2' ' HB2' ' A' ' 57' ' ' CYS . 51.5 Cg_endo -78.12 -166.92 0.43 Allowed 'Trans proline' 0 N--CA 1.456 -0.677 1 C-N-CA 125.72 4.28 . . . . 0.0 111.243 175.29 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 29.9 p-10 -61.7 -52.26 65.05 Favored 'General case' 0 CA--C 1.53 0.2 0 C-N-CA 125.131 1.372 . . . . 0.0 113.793 -172.15 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 40.3 m -67.73 -34.25 76.47 Favored 'General case' 0 N--CA 1.455 -0.198 0 CA-C-O 120.709 0.29 . . . . 0.0 110.615 -174.234 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 61' ' ' HIS . . . . . 0.44 ' CB ' ' HB2' ' A' ' 57' ' ' CYS . 55.3 m170 -74.33 -23.29 59.03 Favored 'General case' 0 N--CA 1.452 -0.33 0 N-CA-C 109.901 -0.407 . . . . 0.0 109.901 176.132 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 4.4 tppt? -67.36 -39.8 85.73 Favored 'General case' 0 N--CA 1.455 -0.215 0 N-CA-C 108.978 -0.749 . . . . 0.0 108.978 176.558 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -67.49 -42.41 82.96 Favored 'General case' 0 N--CA 1.454 -0.254 0 N-CA-C 108.875 -0.787 . . . . 0.0 108.875 177.221 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -66.14 -31.0 77.94 Favored Glycine 0 C--N 1.339 0.738 0 N-CA-C 111.116 -0.794 . . . . 0.0 111.116 179.533 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 50.5 m -67.29 -43.04 82.75 Favored 'General case' 0 N--CA 1.455 -0.189 0 N-CA-C 109.808 -0.442 . . . . 0.0 109.808 177.571 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 61.3 mt -68.51 -25.98 65.22 Favored 'General case' 0 N--CA 1.453 -0.311 0 CA-C-O 119.554 -0.26 . . . . 0.0 110.79 179.384 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 1.4 m-85 -70.94 -37.81 72.87 Favored 'General case' 0 N--CA 1.455 -0.215 0 CA-C-N 117.778 0.263 . . . . 0.0 110.721 175.473 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 68' ' ' ILE . . . . . 0.536 HD11 ' CD1' ' A' ' 17' ' ' PHE . 14.7 mt -67.69 -46.9 81.78 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.472 0 N-CA-C 108.859 -0.793 . . . . 0.0 108.859 176.401 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 95.7 mt -57.39 -37.5 57.69 Favored 'Isoleucine or valine' 0 C--N 1.339 0.128 0 C-N-CA 123.49 0.716 . . . . 0.0 111.071 176.641 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 17.6 t70 -69.42 -43.6 73.07 Favored 'General case' 0 N--CA 1.455 -0.19 0 CA-C-N 118.161 0.437 . . . . 0.0 110.291 178.421 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 29.4 t -66.63 -57.33 7.42 Favored 'General case' 0 N--CA 1.451 -0.385 0 C-N-CA 122.733 0.413 . . . . 0.0 110.988 -176.993 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -75.57 -32.32 24.71 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.408 0 N-CA-C 109.868 -0.419 . . . . 0.0 109.868 -176.733 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -64.84 -50.55 57.77 Favored Glycine 0 C--N 1.337 0.606 0 N-CA-C 111.385 -0.686 . . . . 0.0 111.385 -175.587 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 37.1 mtm105 -71.88 -39.13 69.84 Favored 'General case' 0 N--CA 1.451 -0.383 0 CA-C-N 117.481 0.64 . . . . 0.0 110.134 178.81 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -62.16 -33.94 75.46 Favored 'General case' 0 N--CA 1.452 -0.357 0 C-N-CA 120.54 -0.464 . . . . 0.0 110.751 -179.122 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 1.4 m-30 -69.79 -49.85 48.8 Favored 'General case' 0 CA--C 1.52 -0.204 0 CA-C-N 118.419 0.554 . . . . 0.0 111.023 175.764 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 2.5 tm? -67.93 -35.85 79.14 Favored 'General case' 0 N--CA 1.45 -0.443 0 C-N-CA 118.689 -1.204 . . . . 0.0 109.092 -175.024 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 92.6 m-20 -65.79 -46.9 76.96 Favored 'General case' 0 C--O 1.231 0.116 0 N-CA-C 112.488 0.551 . . . . 0.0 112.488 177.166 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 13.6 tm-20 -65.02 -47.77 76.25 Favored 'General case' 0 N--CA 1.448 -0.573 0 C-N-CA 121.096 -0.241 . . . . 0.0 110.55 -179.027 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 80' ' ' THR . . . . . 0.568 HG21 ' HB3' ' A' ' 94' ' ' CYS . 68.4 p -67.27 -28.33 67.94 Favored 'General case' 0 N--CA 1.45 -0.463 0 CA-C-O 119.502 -0.285 . . . . 0.0 110.913 179.727 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 36.8 ttp-105 -69.93 -26.88 64.35 Favored 'General case' 0 C--N 1.338 0.088 0 CA-C-N 118.544 0.611 . . . . 0.0 110.182 173.401 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 22.5 m -86.29 -29.36 23.12 Favored 'General case' 0 N--CA 1.454 -0.242 0 N-CA-C 112.965 0.728 . . . . 0.0 112.965 -177.669 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 73.1 m-20 -136.41 10.22 3.2 Favored 'General case' 0 C--N 1.341 0.211 0 N-CA-C 113.758 1.022 . . . . 0.0 113.758 -172.852 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 21.9 t -155.12 -158.47 0.84 Allowed 'General case' 0 CA--C 1.533 0.311 0 CA-C-N 118.689 0.677 . . . . 0.0 110.216 -177.253 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 19.7 t-20 -151.35 139.17 19.85 Favored 'General case' 0 CA--C 1.532 0.254 0 N-CA-C 110.071 -0.344 . . . . 0.0 110.071 178.686 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 29.0 t -76.59 -5.4 47.56 Favored 'General case' 0 C--N 1.339 0.141 0 N-CA-C 113.064 0.765 . . . . 0.0 113.064 -174.557 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 80.1 p -73.38 -7.87 53.49 Favored 'General case' 0 C--O 1.231 0.095 0 CA-C-N 118.431 0.56 . . . . 0.0 110.181 175.427 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 77.6 p -75.2 53.49 0.64 Allowed 'General case' 0 CA--C 1.53 0.197 0 C-N-CA 124.301 1.041 . . . . 0.0 110.314 176.192 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 89' ' ' ASN . . . . . 0.403 ' HA ' ' HB1' ' A' ' 95' ' ' ALA . 69.3 m-80 -61.12 77.41 0.01 OUTLIER 'General case' 0 C--N 1.342 0.277 0 C-N-CA 125.407 1.483 . . . . 0.0 112.785 -176.657 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -155.73 163.35 25.01 Favored Pre-proline 0 N--CA 1.454 -0.259 0 C-N-CA 124.557 1.143 . . . . 0.0 108.465 172.747 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_exo -58.48 154.87 39.1 Favored 'Trans proline' 0 N--CA 1.453 -0.875 0 C-N-CA 123.415 2.743 . . . . 0.0 111.707 177.419 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 89.31 17.17 56.07 Favored Glycine 0 CA--C 1.528 0.851 0 CA-C-O 119.525 -0.597 . . . . 0.0 113.238 176.427 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -156.21 165.37 36.58 Favored 'General case' 0 N--CA 1.457 -0.076 0 CA-C-N 117.904 0.852 . . . . 0.0 109.557 178.724 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 94' ' ' CYS . . . . . 0.568 ' HB3' HG21 ' A' ' 80' ' ' THR . 31.5 p -55.55 -23.08 24.75 Favored 'General case' 0 N--CA 1.453 -0.317 0 C-N-CA 123.611 0.764 . . . . 0.0 110.813 178.729 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 95' ' ' ALA . . . . . 0.403 ' HB1' ' HA ' ' A' ' 89' ' ' ASN . . . -60.18 -60.35 3.96 Favored 'General case' 0 N--CA 1.445 -0.681 0 N-CA-C 110.098 -0.334 . . . . 0.0 110.098 -176.076 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 75.0 t60 -72.71 -31.45 65.02 Favored 'General case' 0 N--CA 1.451 -0.386 0 O-C-N 122.052 -0.405 . . . . 0.0 110.728 179.417 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -64.33 -53.67 45.04 Favored 'General case' 0 N--CA 1.452 -0.348 0 CA-C-O 119.686 -0.197 . . . . 0.0 111.366 -178.36 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 98' ' ' ILE . . . . . 0.424 HD13 ' HB2' ' A' ' 94' ' ' CYS . 1.9 mp -70.91 -34.31 55.33 Favored 'Isoleucine or valine' 0 C--N 1.339 0.109 0 CA-C-N 118.074 0.397 . . . . 0.0 110.244 -179.757 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 73.0 m-20 -62.56 -42.28 99.44 Favored 'General case' 0 N--CA 1.456 -0.165 0 CA-C-N 118.159 0.436 . . . . 0.0 110.883 177.719 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 92.2 m -74.54 -31.78 62.23 Favored 'General case' 0 N--CA 1.455 -0.178 0 N-CA-C 110.443 -0.206 . . . . 0.0 110.443 -178.705 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -70.82 -41.11 71.98 Favored 'General case' 0 N--CA 1.452 -0.359 0 C-N-CA 122.632 0.373 . . . . 0.0 110.742 -179.01 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -62.47 -20.74 61.6 Favored Glycine 0 CA--C 1.529 0.928 0 CA-C-O 119.63 -0.539 . . . . 0.0 113.741 -173.767 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 55.9 mm-40 -85.58 -36.06 20.66 Favored 'General case' 0 N--CA 1.455 -0.21 0 CA-C-N 118.362 1.081 . . . . 0.0 112.666 -179.837 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 59.0 t -92.14 -26.57 4.89 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.155 0 O-C-N 123.26 0.35 . . . . 0.0 111.765 -176.985 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 105' ' ' ILE . . . . . . . . . . . . . 10.5 tp -62.45 -26.0 39.32 Favored 'Isoleucine or valine' 0 C--N 1.338 0.075 0 O-C-N 122.111 -0.368 . . . . 0.0 111.672 -174.126 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 24.0 pt20 -69.73 -40.69 76.04 Favored 'General case' 0 N--CA 1.451 -0.404 0 C-N-CA 120.96 -0.296 . . . . 0.0 110.695 -178.765 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 76.8 mm-40 -80.89 -26.15 37.05 Favored 'General case' 0 N--CA 1.454 -0.252 0 CA-C-N 118.367 0.531 . . . . 0.0 110.743 176.696 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 6.8 tt -67.69 -42.59 81.81 Favored 'General case' 0 N--CA 1.454 -0.248 0 N-CA-C 108.891 -0.781 . . . . 0.0 108.891 176.277 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 69.2 mt -68.9 -45.42 70.95 Favored 'General case' 0 N--CA 1.449 -0.475 0 N-CA-C 109.192 -0.67 . . . . 0.0 109.192 173.921 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 43.2 t -47.4 -52.07 17.91 Favored 'General case' 0 C--O 1.234 0.264 0 CA-C-N 118.041 0.382 . . . . 0.0 111.087 178.471 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 40.7 t0 -62.09 -43.8 98.05 Favored 'General case' 0 N--CA 1.455 -0.175 0 N-CA-C 109.135 -0.691 . . . . 0.0 109.135 179.362 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -65.08 -39.69 93.56 Favored 'General case' 0 N--CA 1.45 -0.472 0 N-CA-C 112.237 0.458 . . . . 0.0 112.237 -176.424 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 113' ' ' ILE . . . . . . . . . . . . . 26.8 mm -69.08 -39.44 79.53 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.502 0 CA-C-N 119.133 0.879 . . . . 0.0 109.756 -176.714 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -74.95 -43.83 51.87 Favored 'General case' 0 N--CA 1.453 -0.291 0 C-N-CA 120.624 -0.431 . . . . 0.0 111.878 178.935 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 33.3 ttmt -80.0 -30.74 39.7 Favored 'General case' 0 C--O 1.227 -0.11 0 N-CA-C 113.892 1.071 . . . . 0.0 113.892 -173.159 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 116' ' ' SER . . . . . 0.457 ' HB2' ' CB ' ' A' ' 120' ' ' HIS . 50.6 p -80.0 157.28 26.84 Favored 'General case' 0 CA--C 1.529 0.166 0 N-CA-C 111.974 0.361 . . . . 0.0 111.974 -174.139 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 53.1 t30 -76.21 166.5 23.37 Favored 'General case' 0 N--CA 1.454 -0.226 0 C-N-CA 123.323 0.649 . . . . 0.0 110.269 -179.056 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 118' ' ' GLN . . . . . . . . . . . . . 21.2 mm100 -55.11 -38.46 68.19 Favored 'General case' 0 CA--C 1.528 0.13 0 N-CA-C 112.778 0.658 . . . . 0.0 112.778 -172.426 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 8.0 p30 -69.4 -37.77 77.66 Favored 'General case' 0 N--CA 1.457 -0.084 0 N-CA-C 109.667 -0.494 . . . . 0.0 109.667 178.617 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 120' ' ' HIS . . . . . 0.457 ' CB ' ' HB2' ' A' ' 116' ' ' SER . 31.0 m170 -65.47 -42.11 92.61 Favored 'General case' 0 N--CA 1.45 -0.451 0 N-CA-C 109.445 -0.576 . . . . 0.0 109.445 176.798 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 52.8 mttm -56.74 -38.69 72.75 Favored 'General case' 0 C--N 1.341 0.234 0 N-CA-C 109.299 -0.63 . . . . 0.0 109.299 178.147 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 3.5 tm-20 -68.18 -48.93 63.95 Favored 'General case' 0 N--CA 1.456 -0.142 0 CA-C-O 119.47 -0.3 . . . . 0.0 111.71 179.179 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 40.9 mmtm -58.67 -33.65 70.36 Favored 'General case' 0 N--CA 1.456 -0.133 0 CA-C-N 118.112 0.414 . . . . 0.0 111.05 178.31 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 124' ' ' ILE . . . . . . . . . . . . . 57.1 mt -74.17 -37.41 46.18 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.291 0 N-CA-C 109.606 -0.516 . . . . 0.0 109.606 178.122 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 5.9 tpt180 -68.09 -36.68 80.2 Favored 'General case' 0 N--CA 1.45 -0.451 0 O-C-N 122.07 -0.394 . . . . 0.0 111.066 -176.84 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 126' ' ' MET . . . . . . . . . . . . . 5.6 ppp? -75.05 -27.03 59.86 Favored 'General case' 0 C--O 1.226 -0.139 0 N-CA-C 109.913 -0.402 . . . . 0.0 109.913 176.255 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 1.1 mp -62.11 -39.34 92.18 Favored 'General case' 0 CA--C 1.528 0.119 0 CA-C-N 117.928 0.331 . . . . 0.0 110.269 172.066 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -69.44 -37.81 77.53 Favored 'General case' 0 N--CA 1.457 -0.085 0 CA-C-N 118.162 0.437 . . . . 0.0 109.96 178.158 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 18.6 t70 -59.05 -45.03 91.8 Favored 'General case' 0 N--CA 1.452 -0.337 0 N-CA-C 109.27 -0.641 . . . . 0.0 109.27 175.666 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 55.0 mt -60.14 -35.68 63.19 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.24 0 N-CA-C 110.407 -0.22 . . . . 0.0 110.407 179.909 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 131' ' ' TRP . . . . . . . . . . . . . 46.2 m0 -75.08 -34.58 61.79 Favored 'General case' 0 N--CA 1.453 -0.305 0 N-CA-C 112.937 0.717 . . . . 0.0 112.937 -178.589 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 62.8 m-20 -69.69 -30.36 68.0 Favored 'General case' 0 N--CA 1.456 -0.16 0 CA-C-N 118.313 0.506 . . . . 0.0 110.325 179.107 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 23.3 mtp180 -75.27 -34.49 61.35 Favored 'General case' 0 N--CA 1.455 -0.197 0 C-N-CA 123.393 0.677 . . . . 0.0 109.988 176.439 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 46.6 m -76.74 -14.8 59.9 Favored 'General case' 0 N--CA 1.452 -0.353 0 C-N-CA 123.24 0.616 . . . . 0.0 111.555 -179.943 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 135' ' ' GLY . . . . . . . . . . . . . . . 79.77 16.15 77.91 Favored Glycine 0 CA--C 1.53 1.015 0 CA-C-O 119.341 -0.699 . . . . 0.0 113.773 174.379 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 136' ' ' LEU . . . . . . . . . . . . . 10.7 mp -70.69 -28.58 64.87 Favored 'General case' 0 CA--C 1.53 0.176 0 CA-C-N 118.687 1.244 . . . . 0.0 110.749 179.158 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 137' ' ' PHE . . . . . 0.406 ' C ' ' H ' ' A' ' 139' ' ' LYS . 22.1 m-85 42.69 55.49 4.24 Favored 'General case' 0 CA--C 1.531 0.242 0 C-N-CA 124.014 0.925 . . . . 0.0 112.705 175.12 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 138' ' ' GLN . . . . . . . . . . . . . 18.9 mp0 -69.45 28.35 0.03 OUTLIER 'General case' 0 CA--C 1.534 0.35 0 C-N-CA 123.611 0.765 . . . . 0.0 112.978 -177.784 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 139' ' ' LYS . . . . . 0.406 ' H ' ' C ' ' A' ' 137' ' ' PHE . 65.6 pttt 47.96 20.08 0.22 Allowed 'General case' 0 CA--C 1.532 0.284 0 C-N-CA 125.92 1.688 . . . . 0.0 113.451 -177.854 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 140' ' ' SER . . . . . . . . . . . . . 38.7 t -76.46 54.92 0.96 Allowed 'General case' 0 N--CA 1.455 -0.218 0 C-N-CA 124.464 1.105 . . . . 0.0 111.124 -179.51 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 141' ' ' TYR . . . . . . . . . . . . . 29.8 m-85 -129.36 3.65 5.14 Favored 'General case' 0 CA--C 1.529 0.145 0 N-CA-C 111.869 0.322 . . . . 0.0 111.869 -176.558 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 142' ' ' LEU . . . . . . . . . . . . . 75.0 mt -81.22 165.57 21.37 Favored 'General case' 0 N--CA 1.453 -0.299 0 C-N-CA 122.735 0.414 . . . . 0.0 110.599 178.93 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 74.0 m-20 -61.51 -14.22 27.45 Favored 'General case' 0 CA--C 1.53 0.206 0 C-N-CA 122.449 0.3 . . . . 0.0 110.907 178.032 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 144' ' ' ALA . . . . . 0.47 ' HA ' ' HE3' ' A' ' 148' ' ' LYS . . . -58.82 -31.81 68.81 Favored 'General case' 0 N--CA 1.45 -0.465 0 N-CA-C 109.887 -0.412 . . . . 0.0 109.887 176.735 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 145' ' ' ILE . . . . . . . . . . . . . 26.7 mm -75.1 -27.45 19.83 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.251 0 N-CA-C 109.794 -0.447 . . . . 0.0 109.794 178.549 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 146' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -71.6 -14.77 62.17 Favored 'General case' 0 N--CA 1.454 -0.24 0 N-CA-C 108.77 -0.826 . . . . 0.0 108.77 174.586 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 147' ' ' SER . . . . . . . . . . . . . 17.2 t 65.09 43.47 3.69 Favored 'General case' 0 N--CA 1.454 -0.247 0 N-CA-C 114.136 1.162 . . . . 0.0 114.136 169.282 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 148' ' ' LYS . . . . . 0.47 ' HE3' ' HA ' ' A' ' 144' ' ' ALA . 2.5 mptt 42.25 -85.8 0.01 OUTLIER 'General case' 0 N--CA 1.464 0.263 0 C-N-CA 126.535 1.934 . . . . 0.0 113.963 170.434 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 149' ' ' CYS . . . . . . . . . . . . . 63.4 m -58.7 -39.45 80.79 Favored 'General case' 0 N--CA 1.449 -0.495 0 O-C-N 121.989 -0.444 . . . . 0.0 110.086 -179.075 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 150' ' ' PHE . . . . . . . . . . . . . 91.1 t80 -68.58 -18.26 64.3 Favored 'General case' 0 N--CA 1.453 -0.298 0 CA-C-N 117.983 0.356 . . . . 0.0 111.152 179.942 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 151' ' ' ALA . . . . . . . . . . . . . . . -75.58 -39.88 57.43 Favored 'General case' 0 N--CA 1.451 -0.391 0 O-C-N 121.964 -0.46 . . . . 0.0 110.194 176.199 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 152' ' ' MET . . . . . . . . . . . . . 89.4 mtp -75.75 -36.92 59.73 Favored 'General case' 0 CA--C 1.532 0.287 0 N-CA-C 110.132 -0.321 . . . . 0.0 110.132 175.429 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 153' ' ' ASP . . . . . . . . . . . . . 50.5 m-20 -86.92 14.57 7.1 Favored 'General case' 0 CA--C 1.531 0.238 0 C-N-CA 125.436 1.494 . . . . 0.0 113.119 -178.05 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 154' ' ' LEU . . . . . . . . . . . . . 3.7 pp -57.49 155.34 9.61 Favored 'General case' 0 N--CA 1.456 -0.15 0 CA-C-N 118.575 0.625 . . . . 0.0 111.828 -175.799 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 155' ' ' GLU . . . . . . . . . . . . . 8.1 mp0 -84.13 -41.64 16.87 Favored 'General case' 0 N--CA 1.453 -0.324 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.523 179.431 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 156' ' ' HIS . . . . . . . . . . . . . 98.2 m-70 -156.59 165.14 37.14 Favored 'General case' 0 N--CA 1.455 -0.202 0 C-N-CA 124.349 1.059 . . . . 0.0 109.538 -177.743 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 157' ' ' HIS . . . . . . . . . . . . . 49.7 m170 -84.05 2.4 39.35 Favored 'General case' 0 CA--C 1.53 0.184 0 C-N-CA 123.044 0.538 . . . . 0.0 111.558 178.208 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 158' ' ' HIS . . . . . . . . . . . . . 28.4 m80 -72.56 -7.68 51.37 Favored 'General case' 0 CA--C 1.529 0.137 0 N-CA-C 112.523 0.564 . . . . 0.0 112.523 -177.211 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 159' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 C--O 1.251 1.166 0 CA-C-O 117.527 -1.225 . . . . 0.0 110.518 178.932 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B 2052 ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.476 0.843 0 N-CA-C 109.8 -0.445 . . . . 0.0 109.8 . . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B 2053 ' ' ASP . . . . . . . . . . . . . 6.3 p-10 -71.91 163.01 28.6 Favored 'General case' 0 N--CA 1.449 -0.479 0 N-CA-C 107.764 -1.199 . . . . 0.0 107.764 171.01 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B 2054 ' ' ASP . . . . . . . . . . . . . 41.2 t0 62.79 170.89 0.14 Allowed 'General case' 0 CA--C 1.535 0.366 0 CA-C-O 121.669 0.747 . . . . 0.0 111.026 -173.369 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B 2055 ' ' GLU . . . . . . . . . . . . . 63.2 tt0 -68.05 90.78 0.33 Allowed 'General case' 0 N--CA 1.451 -0.378 0 C-N-CA 125.265 1.426 . . . . 0.0 109.709 179.469 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B 2056 ' ' ASP . . . . . . . . . . . . . 18.1 p30 -72.27 7.2 1.84 Allowed 'General case' 0 CA--C 1.534 0.35 0 N-CA-C 113.166 0.802 . . . . 0.0 113.166 -174.5 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B 2057 ' ' ASP . . . . . . . . . . . . . 65.7 t0 -155.42 94.77 1.63 Allowed 'General case' 0 N--CA 1.454 -0.252 0 N-CA-C 107.725 -1.213 . . . . 0.0 107.725 168.988 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B 2058 ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -67.77 2.57 1.86 Allowed 'General case' 0 C--N 1.34 0.179 0 N-CA-C 113.367 0.877 . . . . 0.0 113.367 -173.898 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B 2059 ' ' THR . . . . . . . . . . . . . 38.0 m 44.48 74.18 0.84 Allowed Pre-proline 0 C--N 1.34 0.16 0 C-N-CA 124.66 1.184 . . . . 0.0 111.771 169.691 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B 2060 ' ' PRO . . . . . . . . . . . . . 55.2 Cg_endo -65.97 122.42 9.97 Favored 'Trans proline' 0 N--CA 1.451 -0.971 0 C-N-CA 123.076 2.518 . . . . 0.0 110.733 -176.119 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B 2061 ' ' SER . . . . . . . . . . . . . 39.5 t -75.16 144.23 42.87 Favored 'General case' 0 N--CA 1.452 -0.361 0 CA-C-N 116.222 -0.444 . . . . 0.0 109.904 177.153 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B 2062 ' ' ILE . . . . . . . . . . . . . 6.4 tp -159.83 141.8 4.61 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.204 0 CA-C-O 120.792 0.33 . . . . 0.0 110.733 -178.1 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B 2063 ' ' SER . . . . . . . . . . . . . 31.2 t . . . . . 0 C--O 1.252 1.201 0 CA-C-O 117.819 -1.086 . . . . 0.0 110.465 -178.932 . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 86.2 mmm . . . . . 0 N--CA 1.472 0.671 0 CA-C-O 120.289 0.09 . . . . 0.0 110.898 . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 2' ' ' GLN . . . . . 0.481 ' HG2' ' H ' ' A' ' 3' ' ' GLN . 7.8 tt0 -159.33 -164.81 1.44 Allowed 'General case' 0 N--CA 1.454 -0.228 0 N-CA-C 107.901 -1.148 . . . . 0.0 107.901 178.099 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 3' ' ' GLN . . . . . 0.481 ' H ' ' HG2' ' A' ' 2' ' ' GLN . 87.1 mm-40 -73.97 41.45 0.13 Allowed 'General case' 0 CA--C 1.532 0.262 0 C-N-CA 123.425 0.69 . . . . 0.0 111.564 -179.802 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 84.6 m-20 56.77 14.38 1.78 Allowed 'General case' 0 C--N 1.34 0.191 0 C-N-CA 124.595 1.158 . . . . 0.0 113.314 -174.495 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 31.8 p30 -99.83 4.15 45.07 Favored 'General case' 0 C--N 1.329 -0.295 0 C-N-CA 123.848 0.859 . . . . 0.0 110.421 175.641 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 23.5 p-10 -90.56 -30.58 17.14 Favored 'General case' 0 N--CA 1.451 -0.408 0 N-CA-C 107.003 -1.48 . . . . 0.0 107.003 171.256 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 7' ' ' PHE . . . . . 0.494 ' CD1' ' HD3' ' A' ' 45' ' ' LYS . 1.5 t80 -54.58 -34.45 61.95 Favored 'General case' 0 N--CA 1.45 -0.447 0 CA-C-N 114.839 -1.073 . . . . 0.0 109.311 175.006 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 50.9 tp60 -51.82 -35.64 45.06 Favored 'General case' 0 N--CA 1.454 -0.234 0 C-N-CA 124.564 1.145 . . . . 0.0 111.802 -178.157 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 30.3 m-80 -73.0 -34.13 66.21 Favored 'General case' 0 N--CA 1.455 -0.196 0 N-CA-C 109.826 -0.435 . . . . 0.0 109.826 -179.762 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 10' ' ' PHE . . . . . 0.451 ' CE2' ' HB2' ' A' ' 32' ' ' LEU . 5.1 t80 -69.54 -38.95 77.69 Favored 'General case' 0 N--CA 1.447 -0.59 0 C-N-CA 123.57 0.748 . . . . 0.0 109.166 175.774 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 93.3 t -65.47 -53.18 42.52 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.426 0 N-CA-C 109.167 -0.679 . . . . 0.0 109.167 178.548 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -57.59 -29.18 64.26 Favored 'General case' 0 N--CA 1.454 -0.246 0 C-N-CA 122.554 0.341 . . . . 0.0 111.359 178.884 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 87.2 m -72.31 -39.1 68.5 Favored 'General case' 0 N--CA 1.456 -0.16 0 N-CA-C 109.345 -0.613 . . . . 0.0 109.345 176.263 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -64.74 -45.61 85.73 Favored 'General case' 0 N--CA 1.454 -0.236 0 N-CA-C 109.457 -0.572 . . . . 0.0 109.457 178.356 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 57.5 mm-40 -63.83 -32.12 73.53 Favored 'General case' 0 N--CA 1.453 -0.302 0 N-CA-C 109.357 -0.609 . . . . 0.0 109.357 178.37 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 69.7 m -66.25 -34.13 77.32 Favored 'General case' 0 N--CA 1.45 -0.473 0 CA-C-O 118.722 -0.656 . . . . 0.0 110.188 177.456 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 17' ' ' PHE . . . . . 0.435 ' CD1' HD11 ' A' ' 68' ' ' ILE . 42.8 m-85 -67.77 -39.33 84.13 Favored 'General case' 0 C--N 1.343 0.296 0 CA-C-N 119.036 0.835 . . . . 0.0 110.152 176.274 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 18' ' ' LYS . . . . . 0.425 ' HG2' ' CE1' ' A' ' 53' ' ' TYR . 46.0 mttt -60.14 -31.2 69.86 Favored 'General case' 0 C--N 1.341 0.208 0 CA-C-N 118.285 0.493 . . . . 0.0 109.844 -179.715 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 45.8 t0 -74.71 -16.78 60.74 Favored 'General case' 0 CA--C 1.534 0.359 0 CA-C-N 115.33 -0.85 . . . . 0.0 112.36 -179.676 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 20' ' ' LEU . . . . . 0.4 HD11 ' HB2' ' A' ' 25' ' ' SER . 81.8 mt -73.29 158.72 34.59 Favored 'General case' 0 N--CA 1.456 -0.138 0 O-C-N 121.528 -0.732 . . . . 0.0 112.07 -176.796 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 1.5 mppt? -98.3 -2.97 38.24 Favored 'General case' 0 CA--C 1.533 0.317 0 CA-C-N 115.106 -0.952 . . . . 0.0 109.7 176.087 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 87.0 p -120.65 -20.08 7.2 Favored 'General case' 0 C--N 1.34 0.168 0 C-N-CA 123.885 0.874 . . . . 0.0 111.031 179.428 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 77.03 -28.71 1.63 Allowed Glycine 0 CA--C 1.53 0.986 0 C-N-CA 124.093 0.854 . . . . 0.0 111.952 179.424 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 92.8 mt -85.89 150.21 3.98 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.341 0 N-CA-C 108.889 -0.782 . . . . 0.0 108.889 175.181 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 25' ' ' SER . . . . . 0.5 ' HA ' ' HA ' ' B' 2056 ' ' ASP . 29.7 t -161.56 94.96 0.99 Allowed 'General case' 0 CA--C 1.513 -0.47 0 N-CA-C 109.159 -0.682 . . . . 0.0 109.159 170.006 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 26' ' ' GLY . . . . . 0.55 ' H ' ' HA ' ' B' 2056 ' ' ASP . . . -55.56 -34.56 60.36 Favored Glycine 0 N--CA 1.445 -0.722 0 N-CA-C 110.881 -0.887 . . . . 0.0 110.881 -177.646 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 15.8 t -65.28 -54.44 29.24 Favored 'General case' 0 N--CA 1.455 -0.218 0 CA-C-N 118.334 1.067 . . . . 0.0 109.905 179.327 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 17.4 mmt85 -68.19 -38.06 81.61 Favored 'General case' 0 N--CA 1.455 -0.217 0 C-N-CA 122.3 0.24 . . . . 0.0 110.69 -176.523 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 75.6 mt -59.71 -43.49 91.55 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.634 0 N-CA-C 108.615 -0.883 . . . . 0.0 108.615 176.109 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 31.6 mtmm -67.02 -27.61 67.55 Favored 'General case' 0 C--N 1.34 0.19 0 CA-C-O 118.928 -0.558 . . . . 0.0 111.466 178.108 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.55 -58.61 5.38 Favored 'General case' 0 C--N 1.343 0.291 0 CA-C-N 118.848 0.749 . . . . 0.0 110.028 -179.969 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.548 HD12 ' N ' ' A' ' 33' ' ' THR . 2.3 pp -75.31 -19.23 59.77 Favored 'General case' 0 CA--C 1.529 0.144 0 C-N-CA 119.887 -0.725 . . . . 0.0 111.589 -175.964 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 33' ' ' THR . . . . . 0.548 ' N ' HD12 ' A' ' 32' ' ' LEU . 37.9 m -71.61 -40.93 69.49 Favored 'General case' 0 N--CA 1.456 -0.158 0 N-CA-C 107.8 -1.185 . . . . 0.0 107.8 176.517 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 92.6 m -68.21 -37.24 80.67 Favored 'General case' 0 N--CA 1.453 -0.323 0 C-N-CA 121.078 -0.249 . . . . 0.0 110.384 -178.563 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 24.1 t80 -63.06 -37.62 87.93 Favored 'General case' 0 N--CA 1.456 -0.135 0 N-CA-C 109.992 -0.373 . . . . 0.0 109.992 175.749 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -73.52 -36.5 65.73 Favored 'General case' 0 N--CA 1.45 -0.434 0 C-N-CA 122.471 0.309 . . . . 0.0 110.761 -179.026 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -71.32 -34.58 70.69 Favored 'General case' 0 N--CA 1.455 -0.183 0 C-N-CA 122.568 0.347 . . . . 0.0 110.547 179.363 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 43.5 t0 -69.72 -22.81 63.36 Favored 'General case' 0 CA--C 1.534 0.344 0 C-N-CA 122.544 0.338 . . . . 0.0 110.745 176.462 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 39' ' ' HIS . . . . . 0.401 ' HB2' HD11 ' A' ' 42' ' ' ILE . 96.5 m-70 -151.68 101.23 2.76 Favored 'General case' 0 N--CA 1.454 -0.24 0 N-CA-C 111.914 0.338 . . . . 0.0 111.914 -175.461 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 40' ' ' ILE . . . . . 0.58 ' H ' HD13 ' A' ' 40' ' ' ILE . 0.0 OUTLIER -78.67 -12.78 13.57 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.294 0 N-CA-C 109.728 -0.471 . . . . 0.0 109.728 174.187 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 17.2 m-20 -57.87 -19.43 29.28 Favored 'General case' 0 N--CA 1.454 -0.235 0 C-N-CA 123.774 0.83 . . . . 0.0 112.655 -176.817 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 42' ' ' ILE . . . . . 0.401 HD11 ' HB2' ' A' ' 39' ' ' HIS . 0.0 OUTLIER -112.29 19.82 6.79 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.245 0 C-N-CA 123.31 0.644 . . . . 0.0 111.388 178.091 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 3.1 pp20? -52.89 -28.1 21.64 Favored 'General case' 0 CA--C 1.532 0.255 0 O-C-N 121.856 -0.528 . . . . 0.0 111.728 178.055 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 36.6 t -64.97 -48.42 74.11 Favored 'General case' 0 CA--C 1.532 0.269 0 N-CA-C 111.634 0.235 . . . . 0.0 111.634 -177.26 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 45' ' ' LYS . . . . . 0.494 ' HD3' ' CD1' ' A' ' 7' ' ' PHE . 17.6 ptpt -73.35 -23.6 60.24 Favored 'General case' 0 C--N 1.341 0.2 0 CA-C-N 117.95 0.341 . . . . 0.0 110.398 179.275 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 67.1 mt -72.58 -51.19 29.63 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.318 0 C-N-CA 122.999 0.52 . . . . 0.0 110.278 -178.835 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 36.6 mm -66.78 -38.35 81.33 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.352 0 N-CA-C 109.996 -0.372 . . . . 0.0 109.996 -179.716 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 33.3 t -67.85 -34.98 77.74 Favored 'General case' 0 N--CA 1.454 -0.272 0 C-N-CA 120.778 -0.369 . . . . 0.0 111.378 -179.046 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 39.7 tp -77.79 -33.67 52.5 Favored 'General case' 0 N--CA 1.451 -0.395 0 O-C-N 121.652 -0.655 . . . . 0.0 112.407 -176.46 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 50' ' ' ILE . . . . . 0.426 HD12 HG12 ' A' ' 69' ' ' ILE . 4.2 pt -70.28 -43.08 78.83 Favored 'Isoleucine or valine' 0 C--N 1.34 0.173 0 CA-C-N 118.832 0.742 . . . . 0.0 110.378 177.55 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 51' ' ' ILE . . . . . 0.404 ' HA ' HD21 ' A' ' 108' ' ' LEU . 32.3 pt -63.12 -37.32 79.09 Favored 'Isoleucine or valine' 0 N--CA 1.461 0.101 0 C-N-CA 119.444 -0.903 . . . . 0.0 110.766 177.949 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 92.6 m-20 -68.51 -41.5 79.87 Favored 'General case' 0 N--CA 1.452 -0.346 0 O-C-N 121.937 -0.477 . . . . 0.0 111.571 178.409 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 53' ' ' TYR . . . . . 0.425 ' CE1' ' HG2' ' A' ' 18' ' ' LYS . 11.2 t80 -64.15 -42.75 96.66 Favored 'General case' 0 CA--C 1.523 -0.078 0 CA-C-N 118.891 0.769 . . . . 0.0 109.227 177.027 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 24.1 t -68.75 -24.72 64.48 Favored 'General case' 0 N--CA 1.453 -0.323 0 N-CA-C 112.105 0.409 . . . . 0.0 112.105 -176.665 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 73.4 mtm180 -86.18 -31.72 21.62 Favored 'General case' 0 N--CA 1.457 -0.094 0 CA-C-N 118.7 0.682 . . . . 0.0 111.823 179.946 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 47.4 mt -84.86 -43.6 13.98 Favored 'General case' 0 CA--C 1.528 0.118 0 N-CA-C 113.02 0.748 . . . . 0.0 113.02 -179.22 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 16.7 p -60.65 155.26 51.76 Favored Pre-proline 0 CA--C 1.538 0.493 0 N-CA-C 113.705 1.002 . . . . 0.0 113.705 -173.322 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 72.3 Cg_endo -75.67 -177.76 3.82 Favored 'Trans proline' 0 N--CA 1.457 -0.619 0 C-N-CA 124.848 3.698 . . . . 0.0 111.545 177.188 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -55.02 -50.91 67.87 Favored 'General case' 0 CA--C 1.53 0.201 0 N-CA-C 114.908 1.447 . . . . 0.0 114.908 -171.913 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 45.3 m -66.99 -39.34 87.12 Favored 'General case' 0 C--N 1.331 -0.199 0 O-C-N 121.743 -0.598 . . . . 0.0 109.964 -176.609 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 71.2 m80 -75.43 -17.47 60.16 Favored 'General case' 0 N--CA 1.45 -0.437 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.526 177.378 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 62' ' ' LYS . . . . . 0.4 ' HE2' ' HB2' ' A' ' 62' ' ' LYS . 10.9 tppt? -66.95 -45.08 78.88 Favored 'General case' 0 N--CA 1.457 -0.086 0 N-CA-C 109.065 -0.716 . . . . 0.0 109.065 174.081 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -63.91 -42.76 97.32 Favored 'General case' 0 N--CA 1.454 -0.267 0 N-CA-C 108.32 -0.993 . . . . 0.0 108.32 177.789 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -66.15 -33.84 86.47 Favored Glycine 0 CA--C 1.53 0.98 0 N-CA-C 111.95 -0.46 . . . . 0.0 111.95 178.331 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 63.2 m -64.74 -42.16 95.39 Favored 'General case' 0 N--CA 1.456 -0.141 0 CA-C-N 117.927 0.864 . . . . 0.0 110.342 177.601 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 80.0 mt -68.71 -27.23 65.76 Favored 'General case' 0 N--CA 1.455 -0.224 0 N-CA-C 110.277 -0.268 . . . . 0.0 110.277 179.421 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 1.0 OUTLIER -68.42 -38.73 81.48 Favored 'General case' 0 N--CA 1.455 -0.203 0 CA-C-N 117.736 0.244 . . . . 0.0 111.413 175.739 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 68' ' ' ILE . . . . . 0.435 HD11 ' CD1' ' A' ' 17' ' ' PHE . 14.7 mt -66.42 -53.64 34.09 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.445 0 N-CA-C 109.178 -0.675 . . . . 0.0 109.178 176.679 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 69' ' ' ILE . . . . . 0.426 HG12 HD12 ' A' ' 50' ' ' ILE . 81.3 mt -50.27 -37.11 13.79 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.19 0 C-N-CA 124.233 1.013 . . . . 0.0 111.678 174.413 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 12.8 t70 -69.05 -46.2 68.47 Favored 'General case' 0 N--CA 1.455 -0.195 0 CA-C-N 118.292 0.496 . . . . 0.0 111.109 179.915 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 30.7 t -64.06 -55.51 21.64 Favored 'General case' 0 N--CA 1.45 -0.464 0 CA-C-N 116.58 -0.282 . . . . 0.0 110.646 -175.968 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -74.36 -32.9 32.25 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.246 0 N-CA-C 110.192 -0.299 . . . . 0.0 110.192 -177.18 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -66.7 -55.26 18.14 Favored Glycine 0 C--N 1.34 0.777 0 N-CA-C 111.589 -0.604 . . . . 0.0 111.589 -174.555 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 33.9 mtm105 -68.7 -37.52 79.58 Favored 'General case' 0 N--CA 1.455 -0.182 0 C-N-CA 120.099 -0.64 . . . . 0.0 110.088 179.158 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -64.7 -29.95 70.96 Favored 'General case' 0 N--CA 1.452 -0.368 0 C-N-CA 120.1 -0.64 . . . . 0.0 110.624 -179.624 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 1.3 m-30 -69.73 -46.0 66.89 Favored 'General case' 0 N--CA 1.454 -0.274 0 CA-C-N 118.401 0.546 . . . . 0.0 110.494 175.832 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -65.01 -49.09 71.57 Favored 'General case' 0 N--CA 1.449 -0.475 0 C-N-CA 118.788 -1.165 . . . . 0.0 108.047 -179.634 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 89.2 m-20 -55.92 -44.34 78.21 Favored 'General case' 0 CA--C 1.53 0.176 0 N-CA-C 112.725 0.639 . . . . 0.0 112.725 -179.689 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 8.3 tm-20 -63.42 -51.85 64.02 Favored 'General case' 0 N--CA 1.45 -0.438 0 CA-C-N 118.548 0.613 . . . . 0.0 111.32 -178.808 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 80' ' ' THR . . . . . 0.557 HG21 ' HB3' ' A' ' 94' ' ' CYS . 59.2 p -65.47 -26.24 67.84 Favored 'General case' 0 N--CA 1.454 -0.237 0 CA-C-N 117.83 0.286 . . . . 0.0 110.567 -179.957 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 35.5 ttp180 -75.62 -20.07 58.79 Favored 'General case' 0 N--CA 1.448 -0.542 0 C-N-CA 123.937 0.895 . . . . 0.0 111.051 174.349 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 27.5 m -95.85 -35.46 11.48 Favored 'General case' 0 CA--C 1.53 0.198 0 C-N-CA 122.924 0.49 . . . . 0.0 111.82 179.476 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 4.9 m-80 -145.69 156.11 43.42 Favored 'General case' 0 N--CA 1.456 -0.146 0 C-N-CA 122.946 0.498 . . . . 0.0 110.803 -176.643 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 42.7 t -80.73 139.66 35.98 Favored 'General case' 0 N--CA 1.455 -0.221 0 N-CA-C 109.767 -0.457 . . . . 0.0 109.767 174.03 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 6.4 m120 -87.12 164.01 16.65 Favored 'General case' 0 N--CA 1.454 -0.243 0 CA-C-O 120.673 0.273 . . . . 0.0 110.431 177.484 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 88.1 p -82.58 12.21 4.88 Favored 'General case' 0 CA--C 1.529 0.168 0 C-N-CA 123.364 0.665 . . . . 0.0 111.353 178.306 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 42.1 t -67.39 161.97 24.02 Favored 'General case' 0 N--CA 1.454 -0.275 0 C-N-CA 123.205 0.602 . . . . 0.0 111.186 179.55 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 44.9 t -139.71 13.71 2.51 Favored 'General case' 0 CA--C 1.531 0.24 0 C-N-CA 123.256 0.623 . . . . 0.0 110.597 179.068 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 9.9 m120 -148.28 172.72 13.93 Favored 'General case' 0 N--CA 1.454 -0.254 0 C-N-CA 124.168 0.987 . . . . 0.0 108.879 -178.168 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 90' ' ' LYS . . . . . 0.438 ' N ' ' HD2' ' A' ' 91' ' ' PRO . 81.5 tttt -66.37 -51.35 43.53 Favored Pre-proline 0 N--CA 1.451 -0.38 0 CA-C-O 118.431 -0.795 . . . . 0.0 110.629 177.444 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 91' ' ' PRO . . . . . 0.438 ' HD2' ' N ' ' A' ' 90' ' ' LYS . 67.2 Cg_endo -67.34 154.97 72.39 Favored 'Trans proline' 0 N--CA 1.453 -0.899 0 C-N-CA 122.18 1.92 . . . . 0.0 109.193 172.146 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 85.55 16.25 64.43 Favored Glycine 0 CA--C 1.525 0.674 0 N-CA-C 110.788 -0.925 . . . . 0.0 110.788 -176.272 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -155.8 167.15 31.33 Favored 'General case' 0 N--CA 1.454 -0.255 0 C-N-CA 123.7 0.8 . . . . 0.0 109.333 -179.218 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 94' ' ' CYS . . . . . 0.557 ' HB3' HG21 ' A' ' 80' ' ' THR . 30.1 p -58.15 -20.01 37.32 Favored 'General case' 0 N--CA 1.453 -0.307 0 C-N-CA 122.703 0.401 . . . . 0.0 110.807 179.087 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -58.53 -60.47 3.74 Favored 'General case' 0 N--CA 1.447 -0.577 0 C-N-CA 122.34 0.256 . . . . 0.0 110.702 -176.514 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 75.3 t60 -74.01 -32.65 63.48 Favored 'General case' 0 N--CA 1.451 -0.407 0 C-N-CA 121.003 -0.279 . . . . 0.0 110.496 -179.86 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -64.46 -53.44 48.15 Favored 'General case' 0 N--CA 1.451 -0.402 0 C-N-CA 122.407 0.283 . . . . 0.0 111.124 -176.26 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 1.7 mp -72.42 -33.12 44.6 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.291 0 N-CA-C 110.056 -0.35 . . . . 0.0 110.056 -178.737 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 1.4 m120 -66.42 -41.25 89.49 Favored 'General case' 0 C--O 1.225 -0.199 0 CA-C-N 118.27 0.486 . . . . 0.0 111.1 177.976 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 96.7 m -73.5 -32.59 64.35 Favored 'General case' 0 N--CA 1.457 -0.122 0 CA-C-N 118.242 0.474 . . . . 0.0 110.894 -177.675 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 60.5 tp -73.2 -39.6 65.44 Favored 'General case' 0 N--CA 1.45 -0.463 0 N-CA-C 111.528 0.196 . . . . 0.0 111.528 -177.268 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -69.31 -16.9 71.74 Favored Glycine 0 CA--C 1.529 0.944 0 CA-C-O 119.713 -0.493 . . . . 0.0 114.031 -173.828 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 6.2 mm-40 -87.76 -32.08 19.31 Favored 'General case' 0 CA--C 1.52 -0.173 0 CA-C-N 118.322 1.061 . . . . 0.0 111.538 178.92 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 81.7 t -93.69 -20.68 6.23 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.09 0 C-N-CA 122.759 0.424 . . . . 0.0 112.119 -177.499 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 105' ' ' ILE . . . . . 0.403 HD12 ' HA ' ' A' ' 105' ' ' ILE . 10.7 tp -60.54 -22.5 25.9 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.224 0 O-C-N 121.571 -0.706 . . . . 0.0 112.099 -175.167 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 26.4 pt20 -67.77 -25.67 65.73 Favored 'General case' 0 CA--C 1.53 0.201 0 O-C-N 121.982 -0.448 . . . . 0.0 110.511 177.236 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 72.2 mt-10 -74.3 -43.04 58.43 Favored 'General case' 0 N--CA 1.454 -0.254 0 N-CA-C 109.474 -0.565 . . . . 0.0 109.474 176.816 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 108' ' ' LEU . . . . . 0.404 HD21 ' HA ' ' A' ' 51' ' ' ILE . 10.4 mp -67.4 -45.11 77.14 Favored 'General case' 0 N--CA 1.452 -0.364 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.239 -177.847 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 3.0 mp -65.94 -53.33 40.59 Favored 'General case' 0 N--CA 1.451 -0.379 0 CA-C-O 119.146 -0.454 . . . . 0.0 110.584 -178.219 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 15.4 m -54.39 -47.22 72.94 Favored 'General case' 0 C--O 1.233 0.198 0 CA-C-N 118.139 0.427 . . . . 0.0 110.501 -178.262 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 40.5 t0 -62.21 -43.37 98.98 Favored 'General case' 0 N--CA 1.452 -0.365 0 N-CA-C 109.309 -0.626 . . . . 0.0 109.309 178.117 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 112' ' ' ALA . . . . . 0.4 ' HA ' ' HG2' ' A' ' 62' ' ' LYS . . . -67.87 -36.89 81.05 Favored 'General case' 0 N--CA 1.447 -0.619 0 CA-C-O 119.135 -0.46 . . . . 0.0 111.438 -175.148 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 113' ' ' ILE . . . . . 0.456 ' O ' ' HE2' ' A' ' 121' ' ' LYS . 19.9 mm -68.79 -40.85 81.94 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.426 0 C-N-CA 118.805 -1.158 . . . . 0.0 110.1 -179.434 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -75.56 -39.09 58.7 Favored 'General case' 0 N--CA 1.454 -0.237 0 N-CA-C 112.837 0.68 . . . . 0.0 112.837 179.836 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 115' ' ' LYS . . . . . 0.61 ' HE2' ' HA ' ' A' ' 115' ' ' LYS . 0.6 OUTLIER -78.85 -38.41 38.0 Favored 'General case' 0 N--CA 1.456 -0.165 0 N-CA-C 113.342 0.867 . . . . 0.0 113.342 -177.711 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 116' ' ' SER . . . . . 0.453 ' HB2' ' CB ' ' A' ' 120' ' ' HIS . 52.6 p -74.56 157.23 35.82 Favored 'General case' 0 CA--C 1.529 0.146 0 CA-C-N 117.918 0.326 . . . . 0.0 111.744 -172.628 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 56.5 t30 -79.57 166.21 22.15 Favored 'General case' 0 CA--C 1.531 0.23 0 C-N-CA 122.877 0.471 . . . . 0.0 110.61 -178.997 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 118' ' ' GLN . . . . . . . . . . . . . 3.4 pt20 -49.1 -46.27 44.51 Favored 'General case' 0 CA--C 1.532 0.25 0 N-CA-C 112.823 0.675 . . . . 0.0 112.823 -174.34 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 6.8 p30 -65.42 -35.85 82.18 Favored 'General case' 0 N--CA 1.456 -0.149 0 C-N-CA 123.059 0.544 . . . . 0.0 111.358 179.122 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 120' ' ' HIS . . . . . 0.453 ' CB ' ' HB2' ' A' ' 116' ' ' SER . 32.3 m170 -68.12 -43.91 77.3 Favored 'General case' 0 N--CA 1.448 -0.544 0 N-CA-C 110.145 -0.317 . . . . 0.0 110.145 176.666 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 121' ' ' LYS . . . . . 0.456 ' HE2' ' O ' ' A' ' 113' ' ' ILE . 76.0 mttt -57.0 -38.99 73.85 Favored 'General case' 0 C--N 1.342 0.254 0 N-CA-C 109.514 -0.55 . . . . 0.0 109.514 179.896 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 2.8 tm-20 -65.43 -47.61 75.61 Favored 'General case' 0 N--CA 1.456 -0.172 0 C-N-CA 122.402 0.281 . . . . 0.0 110.614 178.905 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 62.4 mttp -65.95 -28.92 69.27 Favored 'General case' 0 N--CA 1.454 -0.233 0 CA-C-O 119.836 -0.126 . . . . 0.0 111.075 -179.558 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 124' ' ' ILE . . . . . . . . . . . . . 59.2 mt -70.73 -42.97 77.7 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.297 0 N-CA-C 109.436 -0.579 . . . . 0.0 109.436 176.071 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 125' ' ' ARG . . . . . 0.468 HH11 ' HA ' ' A' ' 125' ' ' ARG . 7.3 mmm180 -59.27 -46.39 88.67 Favored 'General case' 0 N--CA 1.451 -0.383 0 CA-C-O 118.982 -0.532 . . . . 0.0 111.236 -179.503 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 126' ' ' MET . . . . . . . . . . . . . 27.6 ptm -65.47 -33.47 76.0 Favored 'General case' 0 N--CA 1.451 -0.401 0 C-N-CA 119.278 -0.969 . . . . 0.0 109.66 178.814 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 18.7 tp -69.61 -31.72 70.01 Favored 'General case' 0 CA--C 1.533 0.307 0 CA-C-N 118.025 0.375 . . . . 0.0 111.617 179.654 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 92.9 mt -75.76 -38.06 58.73 Favored 'General case' 0 N--CA 1.456 -0.167 0 O-C-N 121.909 -0.494 . . . . 0.0 110.531 177.378 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 129' ' ' ASP . . . . . 0.417 ' O ' ' HD2' ' A' ' 133' ' ' ARG . 54.7 m-20 -60.29 -38.23 82.97 Favored 'General case' 0 N--CA 1.454 -0.226 0 N-CA-C 109.117 -0.698 . . . . 0.0 109.117 176.031 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 130' ' ' ILE . . . . . 0.563 HG12 HG23 ' B' 2062 ' ' ILE . 36.5 mt -63.15 -40.7 90.02 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.359 0 C-N-CA 124.32 1.048 . . . . 0.0 110.816 176.08 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 131' ' ' TRP . . . . . . . . . . . . . 48.7 m0 -68.22 -39.5 82.35 Favored 'General case' 0 N--CA 1.452 -0.349 0 C-N-CA 120.009 -0.677 . . . . 0.0 111.178 176.949 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 50.4 m-20 -64.39 -28.91 70.01 Favored 'General case' 0 CA--C 1.531 0.227 0 CA-C-N 117.97 0.35 . . . . 0.0 110.773 179.451 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 133' ' ' ARG . . . . . 0.417 ' HD2' ' O ' ' A' ' 129' ' ' ASP . 33.2 mtt85 -74.77 -34.67 62.51 Favored 'General case' 0 C--N 1.339 0.145 0 C-N-CA 122.997 0.519 . . . . 0.0 111.087 175.125 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 25.6 p -72.26 -15.35 61.92 Favored 'General case' 0 N--CA 1.452 -0.333 0 N-CA-C 112.813 0.671 . . . . 0.0 112.813 -172.955 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 135' ' ' GLY . . . . . . . . . . . . . . . 83.16 11.24 81.32 Favored Glycine 0 CA--C 1.529 0.944 0 CA-C-O 119.393 -0.67 . . . . 0.0 112.759 179.6 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 136' ' ' LEU . . . . . . . . . . . . . 20.5 mt -60.84 165.37 4.07 Favored 'General case' 0 CA--C 1.531 0.248 0 CA-C-N 118.05 0.925 . . . . 0.0 110.032 175.403 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 137' ' ' PHE . . . . . . . . . . . . . 7.4 t80 -72.9 57.13 0.43 Allowed 'General case' 0 CA--C 1.531 0.23 0 C-N-CA 123.924 0.89 . . . . 0.0 111.123 -179.105 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 138' ' ' GLN . . . . . . . . . . . . . 16.1 mm100 -68.55 168.81 12.16 Favored 'General case' 0 N--CA 1.451 -0.383 0 C-N-CA 124.289 1.036 . . . . 0.0 110.72 178.429 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 139' ' ' LYS . . . . . . . . . . . . . 34.9 mmtp -130.15 162.09 29.64 Favored 'General case' 0 N--CA 1.453 -0.298 0 N-CA-C 108.994 -0.743 . . . . 0.0 108.994 -178.398 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 140' ' ' SER . . . . . . . . . . . . . 44.2 t -63.77 156.69 26.46 Favored 'General case' 0 N--CA 1.452 -0.346 0 CA-C-O 120.815 0.34 . . . . 0.0 110.202 179.48 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 141' ' ' TYR . . . . . . . . . . . . . 10.1 m-30 -76.49 53.91 0.89 Allowed 'General case' 0 CA--C 1.532 0.266 0 C-N-CA 123.219 0.607 . . . . 0.0 110.175 -179.847 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 142' ' ' LEU . . . . . 0.447 HD23 ' H ' ' A' ' 142' ' ' LEU . 2.5 pt? -62.57 172.54 1.56 Allowed 'General case' 0 CA--C 1.531 0.226 0 N-CA-C 112.19 0.441 . . . . 0.0 112.19 -176.652 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 4.1 m120 -53.0 -23.75 8.04 Favored 'General case' 0 N--CA 1.455 -0.176 0 C-N-CA 124.103 0.961 . . . . 0.0 113.057 -173.545 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . -71.58 -51.77 21.62 Favored 'General case' 0 N--CA 1.452 -0.338 0 CA-C-N 118.435 0.561 . . . . 0.0 109.949 178.729 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 145' ' ' ILE . . . . . . . . . . . . . 26.3 mm -64.76 -31.16 52.61 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.265 0 N-CA-C 110.206 -0.294 . . . . 0.0 110.206 178.134 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 146' ' ' ARG . . . . . . . . . . . . . 30.7 tpt180 -67.94 -37.1 81.2 Favored 'General case' 0 N--CA 1.452 -0.334 0 C-N-CA 122.886 0.474 . . . . 0.0 110.386 179.976 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 147' ' ' SER . . . . . . . . . . . . . 33.2 t 44.34 32.03 0.65 Allowed 'General case' 0 CA--C 1.535 0.397 0 C-N-CA 123.857 0.863 . . . . 0.0 112.767 176.859 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 48.12 -122.59 1.54 Allowed 'General case' 0 CA--C 1.536 0.44 0 C-N-CA 124.577 1.151 . . . . 0.0 112.4 176.893 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 149' ' ' CYS . . . . . . . . . . . . . 49.4 m -58.68 -28.9 66.18 Favored 'General case' 0 N--CA 1.455 -0.219 0 N-CA-C 112.815 0.672 . . . . 0.0 112.815 -173.836 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 150' ' ' PHE . . . . . . . . . . . . . 82.0 m-85 -64.34 -22.04 66.82 Favored 'General case' 0 N--CA 1.453 -0.307 0 CA-C-O 119.252 -0.404 . . . . 0.0 111.332 -177.523 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 151' ' ' ALA . . . . . . . . . . . . . . . -94.34 -28.61 15.46 Favored 'General case' 0 N--CA 1.456 -0.13 0 CA-C-N 118.202 0.455 . . . . 0.0 110.312 171.57 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 152' ' ' MET . . . . . . . . . . . . . 95.2 mtp -64.86 -14.59 59.98 Favored 'General case' 0 N--CA 1.456 -0.175 0 N-CA-C 111.631 0.234 . . . . 0.0 111.631 179.149 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 153' ' ' ASP . . . . . . . . . . . . . 69.7 m-20 -58.7 -16.79 18.07 Favored 'General case' 0 CA--C 1.53 0.191 0 N-CA-C 112.205 0.446 . . . . 0.0 112.205 171.974 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 154' ' ' LEU . . . . . . . . . . . . . 40.0 mt -104.45 13.86 31.12 Favored 'General case' 0 C--N 1.34 0.194 0 C-N-CA 123.062 0.545 . . . . 0.0 110.96 176.937 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 155' ' ' GLU . . . . . . . . . . . . . 57.9 mt-10 -127.51 14.3 7.07 Favored 'General case' 0 CA--C 1.536 0.418 0 C-N-CA 123.095 0.558 . . . . 0.0 112.34 -174.758 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 156' ' ' HIS . . . . . . . . . . . . . 48.0 m170 -65.51 -2.36 3.3 Favored 'General case' 0 N--CA 1.456 -0.165 0 O-C-N 121.787 -0.571 . . . . 0.0 111.498 175.605 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 157' ' ' HIS . . . . . . . . . . . . . 11.7 m80 -80.19 -4.66 53.97 Favored 'General case' 0 C--O 1.236 0.36 0 C-N-CA 124.86 1.264 . . . . 0.0 112.645 -179.485 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 158' ' ' HIS . . . . . . . . . . . . . 63.8 t60 -70.38 159.38 34.26 Favored 'General case' 0 C--O 1.243 0.735 0 C-N-CA 124.437 1.095 . . . . 0.0 110.048 -179.526 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 159' ' ' HIS . . . . . . . . . . . . . 17.8 t-160 . . . . . 0 CA--C 1.569 1.693 0 CA-C-O 115.589 -2.148 . . . . 0.0 112.891 -179.962 . . . . . . . . 0 0 . 1 . 016 nuclear build full ' B' B 2052 ' ' ASP . . . . . . . . . . . . . 21.0 p-10 . . . . . 0 N--CA 1.476 0.859 0 N-CA-C 110.395 -0.224 . . . . 0.0 110.395 . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' B' B 2053 ' ' ASP . . . . . . . . . . . . . 35.7 m-20 -85.13 158.89 20.27 Favored 'General case' 0 N--CA 1.451 -0.405 0 CA-C-O 120.958 0.409 . . . . 0.0 111.189 178.666 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B 2054 ' ' ASP . . . . . . . . . . . . . 32.2 t0 -158.66 179.76 8.81 Favored 'General case' 0 CA--C 1.53 0.201 0 N-CA-C 108.729 -0.841 . . . . 0.0 108.729 -178.878 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B 2055 ' ' GLU . . . . . . . . . . . . . 76.7 mm-40 -63.31 140.08 58.84 Favored 'General case' 0 N--CA 1.457 -0.115 0 N-CA-C 112.558 0.577 . . . . 0.0 112.558 -179.072 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B 2056 ' ' ASP . . . . . 0.55 ' HA ' ' H ' ' A' ' 26' ' ' GLY . 25.7 m-20 -102.95 30.31 4.87 Favored 'General case' 0 CA--C 1.533 0.302 0 C-N-CA 124.651 1.18 . . . . 0.0 110.412 176.985 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B 2057 ' ' ASP . . . . . . . . . . . . . 50.4 p-10 -74.24 56.1 0.62 Allowed 'General case' 0 CA--C 1.533 0.31 0 C-N-CA 124.705 1.202 . . . . 0.0 113.19 -174.681 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B 2058 ' ' TYR . . . . . . . . . . . . . 85.8 t80 -147.18 139.39 24.54 Favored 'General case' 0 C--N 1.34 0.161 0 O-C-N 121.539 -0.725 . . . . 0.0 110.923 173.467 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B 2059 ' ' THR . . . . . . . . . . . . . 2.9 m -174.55 125.1 0.39 Allowed Pre-proline 0 CA--C 1.531 0.225 0 C-N-CA 125.855 1.662 . . . . 0.0 106.688 170.917 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B 2060 ' ' PRO . . . . . . . . . . . . . 96.8 Cg_endo -73.8 165.68 31.61 Favored 'Trans proline' 0 N--CA 1.452 -0.921 0 C-N-CA 123.303 2.669 . . . . 0.0 110.508 179.293 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B 2061 ' ' SER . . . . . . . . . . . . . 86.0 p -144.77 20.67 1.64 Allowed 'General case' 0 N--CA 1.456 -0.166 0 N-CA-C 112.852 0.686 . . . . 0.0 112.852 -174.913 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B 2062 ' ' ILE . . . . . 0.563 HG23 HG12 ' A' ' 130' ' ' ILE . 1.2 tt -75.92 76.87 0.53 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.305 0 CA-C-O 121.847 0.832 . . . . 0.0 109.134 176.418 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B 2063 ' ' SER . . . . . . . . . . . . . 47.6 t . . . . . 0 C--O 1.252 1.205 0 CA-C-O 118.184 -0.913 . . . . 0.0 111.652 179.627 . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 4.0 mpp? . . . . . 0 N--CA 1.473 0.713 0 N-CA-C 110.13 -0.322 . . . . 0.0 110.13 . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 24.4 mp0 -74.5 -162.16 0.15 Allowed 'General case' 0 N--CA 1.45 -0.442 0 C-N-CA 124.004 0.922 . . . . 0.0 109.045 175.661 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 58.8 tt0 -67.79 89.15 0.26 Allowed 'General case' 0 CA--C 1.531 0.246 0 N-CA-C 107.755 -1.202 . . . . 0.0 107.755 171.62 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 79.9 m-20 -73.85 20.34 0.1 Allowed 'General case' 0 C--N 1.338 0.087 0 N-CA-C 115.532 1.679 . . . . 0.0 115.532 -170.986 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 47.8 p30 -83.39 0.63 45.2 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 121.472 0.653 . . . . 0.0 110.636 176.957 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 29.7 p-10 -82.04 -30.93 31.16 Favored 'General case' 0 N--CA 1.451 -0.389 0 N-CA-C 107.786 -1.19 . . . . 0.0 107.786 174.025 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 7' ' ' PHE . . . . . 0.511 ' CD1' ' HD3' ' A' ' 45' ' ' LYS . 1.3 t80 -59.14 -33.99 71.54 Favored 'General case' 0 N--CA 1.446 -0.67 0 C-N-CA 125.416 1.487 . . . . 0.0 109.981 -179.978 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 51.2 tp60 -49.76 -37.24 28.84 Favored 'General case' 0 N--CA 1.451 -0.395 0 C-N-CA 124.347 1.059 . . . . 0.0 111.609 -179.006 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 25.5 m-80 -73.94 -33.27 63.86 Favored 'General case' 0 N--CA 1.452 -0.356 0 O-C-N 122.202 -0.311 . . . . 0.0 110.397 -179.478 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 10' ' ' PHE . . . . . 0.417 ' CE2' ' HB2' ' A' ' 32' ' ' LEU . 6.5 t80 -71.23 -40.36 71.12 Favored 'General case' 0 N--CA 1.449 -0.515 0 C-N-CA 123.311 0.645 . . . . 0.0 109.499 177.511 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 89.1 t -63.6 -53.46 44.71 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.417 0 N-CA-C 108.407 -0.96 . . . . 0.0 108.407 179.071 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -59.54 -29.34 67.83 Favored 'General case' 0 N--CA 1.455 -0.221 0 C-N-CA 122.748 0.419 . . . . 0.0 111.774 -179.659 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 92.3 m -71.73 -37.12 70.64 Favored 'General case' 0 CA--C 1.531 0.216 0 N-CA-C 108.901 -0.777 . . . . 0.0 108.901 176.206 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.466 HD21 ' HB2' ' A' ' 53' ' ' TYR . 5.6 tp -69.03 -41.05 78.22 Favored 'General case' 0 N--CA 1.452 -0.352 0 CA-C-O 120.981 0.42 . . . . 0.0 110.379 178.751 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 64.1 mm-40 -64.88 -30.98 72.0 Favored 'General case' 0 N--CA 1.45 -0.447 0 N-CA-C 108.378 -0.971 . . . . 0.0 108.378 176.668 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 23.1 t -73.48 -20.45 60.68 Favored 'General case' 0 N--CA 1.453 -0.288 0 CA-C-N 115.844 -0.616 . . . . 0.0 109.894 178.375 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 17' ' ' PHE . . . . . 0.453 ' CD1' ' HA ' ' A' ' 14' ' ' LEU . 22.9 m-85 -75.43 -35.66 60.92 Favored 'General case' 0 N--CA 1.455 -0.188 0 C-N-CA 120.181 -0.607 . . . . 0.0 110.512 168.62 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 68.2 mttt -62.0 -28.79 69.82 Favored 'General case' 0 C--N 1.339 0.127 0 CA-C-N 118.37 0.532 . . . . 0.0 109.776 179.066 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 19.7 t0 -64.31 -20.89 66.38 Favored 'General case' 0 CA--C 1.533 0.323 0 CA-C-N 115.706 -0.679 . . . . 0.0 111.885 176.86 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 43.3 mt -70.79 155.17 41.12 Favored 'General case' 0 N--CA 1.457 -0.082 0 O-C-N 121.476 -0.765 . . . . 0.0 111.885 -175.192 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 1.4 mppt? -100.99 -3.72 28.88 Favored 'General case' 0 CA--C 1.528 0.116 0 N-CA-C 109.06 -0.719 . . . . 0.0 109.06 173.168 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 82.9 p -121.83 -20.4 6.42 Favored 'General case' 0 CA--C 1.528 0.096 0 C-N-CA 124.507 1.123 . . . . 0.0 111.091 -178.924 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 82.7 -16.8 24.04 Favored Glycine 0 CA--C 1.53 0.995 0 C-N-CA 124.153 0.882 . . . . 0.0 113.499 176.213 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 81.5 mt -101.43 148.5 7.24 Favored 'Isoleucine or valine' 0 CA--C 1.528 0.113 0 CA-C-N 118.452 1.126 . . . . 0.0 110.73 -179.671 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 41.9 t -162.54 85.59 0.56 Allowed 'General case' 0 CA--C 1.519 -0.23 0 N-CA-C 110.04 -0.356 . . . . 0.0 110.04 178.82 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 26' ' ' GLY . . . . . 0.428 ' O ' ' HE2' ' A' ' 30' ' ' LYS . . . -51.15 -39.72 42.68 Favored Glycine 0 CA--C 1.523 0.551 0 CA-C-O 119.168 -0.795 . . . . 0.0 112.236 -175.635 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 91.4 p -66.0 -48.03 72.54 Favored 'General case' 0 N--CA 1.454 -0.243 0 CA-C-N 118.999 1.399 . . . . 0.0 110.952 -176.807 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 54.5 mtm180 -73.15 -34.57 66.14 Favored 'General case' 0 CA--C 1.527 0.09 0 CA-C-N 118.014 0.37 . . . . 0.0 110.57 -179.351 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 65.1 mt -59.05 -48.45 86.67 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.487 0 N-CA-C 109.057 -0.72 . . . . 0.0 109.057 173.584 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 30' ' ' LYS . . . . . 0.428 ' HE2' ' O ' ' A' ' 26' ' ' GLY . 49.2 mtmt -68.75 -23.18 64.3 Favored 'General case' 0 N--CA 1.456 -0.173 0 CA-C-O 119.012 -0.518 . . . . 0.0 111.505 -179.564 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 31' ' ' LYS . . . . . 0.445 ' HE2' ' HA ' ' A' ' 31' ' ' LYS . 4.1 mmpt? -66.35 -57.14 8.1 Favored 'General case' 0 C--N 1.341 0.213 0 CA-C-N 118.693 0.679 . . . . 0.0 110.443 176.255 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.489 HD12 ' N ' ' A' ' 33' ' ' THR . 2.3 pp -75.43 -18.85 59.79 Favored 'General case' 0 CA--C 1.531 0.247 0 C-N-CA 119.615 -0.834 . . . . 0.0 111.505 -178.105 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 33' ' ' THR . . . . . 0.489 ' N ' HD12 ' A' ' 32' ' ' LEU . 60.1 m -72.88 -38.42 66.99 Favored 'General case' 0 N--CA 1.455 -0.222 0 N-CA-C 109.077 -0.712 . . . . 0.0 109.077 175.678 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 57.9 m -69.08 -35.59 76.67 Favored 'General case' 0 N--CA 1.453 -0.312 0 N-CA-C 110.001 -0.37 . . . . 0.0 110.001 179.918 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 9.1 t80 -62.17 -39.51 92.91 Favored 'General case' 0 C--O 1.231 0.122 0 N-CA-C 109.626 -0.509 . . . . 0.0 109.626 174.446 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -71.61 -36.79 70.92 Favored 'General case' 0 N--CA 1.448 -0.526 0 CA-C-O 119.564 -0.255 . . . . 0.0 111.685 -179.644 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -70.0 -34.07 72.85 Favored 'General case' 0 N--CA 1.456 -0.168 0 CA-C-N 117.915 0.325 . . . . 0.0 111.045 -179.825 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 43.9 t0 -68.91 -23.93 64.24 Favored 'General case' 0 CA--C 1.533 0.325 0 C-N-CA 122.132 0.173 . . . . 0.0 110.633 176.934 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 39' ' ' HIS . . . . . 0.41 ' HB2' HD11 ' A' ' 42' ' ' ILE . 97.8 m-70 -151.93 104.6 3.01 Favored 'General case' 0 N--CA 1.456 -0.167 0 N-CA-C 112.199 0.444 . . . . 0.0 112.199 -174.517 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 40' ' ' ILE . . . . . 0.581 ' H ' HD13 ' A' ' 40' ' ' ILE . 0.0 OUTLIER -79.0 -12.03 13.25 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.302 0 C-N-CA 122.736 0.414 . . . . 0.0 110.149 174.165 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 16.0 m-20 -59.44 -11.73 4.95 Favored 'General case' 0 CA--C 1.53 0.176 0 C-N-CA 123.418 0.687 . . . . 0.0 112.787 -176.794 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 42' ' ' ILE . . . . . 0.41 HD11 ' HB2' ' A' ' 39' ' ' HIS . 0.0 OUTLIER -119.46 18.06 6.58 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.198 0 C-N-CA 124.068 0.947 . . . . 0.0 111.667 177.799 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 3.0 pp20? -53.88 -28.91 39.19 Favored 'General case' 0 CA--C 1.53 0.193 0 O-C-N 121.379 -0.825 . . . . 0.0 111.296 178.092 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 47.1 t -65.21 -44.24 88.94 Favored 'General case' 0 CA--C 1.533 0.289 0 N-CA-C 111.899 0.333 . . . . 0.0 111.899 -177.878 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 45' ' ' LYS . . . . . 0.511 ' HD3' ' CD1' ' A' ' 7' ' ' PHE . 15.0 ptpt -74.87 -25.67 59.13 Favored 'General case' 0 CA--C 1.53 0.185 0 CA-C-N 118.385 0.539 . . . . 0.0 109.816 179.012 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 67.2 mt -72.72 -51.68 26.61 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.251 0 C-N-CA 123.076 0.55 . . . . 0.0 110.314 -177.476 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 38.8 mm -67.11 -39.95 84.27 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.112 0 N-CA-C 110.119 -0.326 . . . . 0.0 110.119 -179.768 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 48.0 t -66.72 -33.59 75.98 Favored 'General case' 0 N--CA 1.453 -0.313 0 C-N-CA 120.745 -0.382 . . . . 0.0 111.201 -178.841 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 49' ' ' LEU . . . . . 0.41 ' HG ' HD22 ' A' ' 14' ' ' LEU . 44.4 tp -78.68 -37.55 41.5 Favored 'General case' 0 N--CA 1.451 -0.397 0 N-CA-C 112.749 0.648 . . . . 0.0 112.749 -177.474 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 50' ' ' ILE . . . . . 0.487 HD12 HG12 ' A' ' 69' ' ' ILE . 3.6 pt -67.4 -44.01 87.3 Favored 'Isoleucine or valine' 0 C--N 1.34 0.162 0 CA-C-N 118.924 0.784 . . . . 0.0 110.172 178.933 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 16.9 pt -65.48 -38.05 81.53 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.203 0 C-N-CA 119.858 -0.737 . . . . 0.0 111.477 178.758 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 47.6 t0 -60.86 -53.63 54.95 Favored 'General case' 0 CA--C 1.528 0.104 0 CA-C-N 118.484 0.584 . . . . 0.0 110.21 177.469 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 53' ' ' TYR . . . . . 0.466 ' HB2' HD21 ' A' ' 14' ' ' LEU . 3.5 t80 -61.16 -32.49 72.22 Favored 'General case' 0 C--O 1.225 -0.21 0 CA-C-O 118.813 -0.613 . . . . 0.0 109.839 179.173 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 17.2 p -63.46 -35.99 82.26 Favored 'General case' 0 N--CA 1.456 -0.16 0 CA-C-N 118.693 0.679 . . . . 0.0 110.859 -179.89 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 1.9 tpp180 -79.49 -39.69 31.52 Favored 'General case' 0 N--CA 1.455 -0.195 0 C-N-CA 122.146 0.178 . . . . 0.0 111.181 -177.57 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 79.6 mt -77.75 -45.28 25.11 Favored 'General case' 0 N--CA 1.455 -0.215 0 C-N-CA 123.764 0.825 . . . . 0.0 113.196 -176.468 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 13.6 p -64.38 159.64 57.3 Favored Pre-proline 0 CA--C 1.533 0.3 0 N-CA-C 113.882 1.067 . . . . 0.0 113.882 -171.628 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 33.4 Cg_exo -58.03 175.65 0.45 Allowed 'Trans proline' 0 N--CA 1.454 -0.796 0 C-N-CA 125.012 3.808 . . . . 0.0 112.827 173.884 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 35.8 p-10 -63.6 -42.19 98.28 Favored 'General case' 0 CA--C 1.53 0.189 0 C-N-CA 123.916 0.886 . . . . 0.0 112.171 -174.945 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 20.0 m -72.57 -35.48 67.97 Favored 'General case' 0 N--CA 1.452 -0.362 0 C-N-CA 122.702 0.401 . . . . 0.0 110.015 -178.203 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 51.3 m80 -75.17 -23.72 57.78 Favored 'General case' 0 N--CA 1.452 -0.337 0 C-N-CA 122.814 0.446 . . . . 0.0 110.252 177.817 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 22.3 ttmm -71.94 -35.41 69.61 Favored 'General case' 0 N--CA 1.455 -0.184 0 N-CA-C 109.327 -0.619 . . . . 0.0 109.327 174.527 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -62.76 -44.29 96.58 Favored 'General case' 0 CA--C 1.532 0.269 0 N-CA-C 107.155 -1.424 . . . . 0.0 107.155 172.078 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -65.59 -29.69 75.73 Favored Glycine 0 CA--C 1.526 0.736 0 N-CA-C 111.474 -0.65 . . . . 0.0 111.474 179.99 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 35.3 t -65.56 -41.52 92.86 Favored 'General case' 0 N--CA 1.452 -0.351 0 CA-C-N 117.469 0.635 . . . . 0.0 109.449 176.814 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 81.4 mt -67.74 -27.44 66.79 Favored 'General case' 0 N--CA 1.453 -0.276 0 N-CA-C 110.473 -0.195 . . . . 0.0 110.473 178.157 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 67' ' ' TYR . . . . . 0.414 ' CD2' HD11 ' A' ' 127' ' ' LEU . 2.4 m-85 -70.09 -37.99 75.58 Favored 'General case' 0 C--N 1.34 0.153 0 CA-C-N 117.983 0.356 . . . . 0.0 110.731 174.873 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 68' ' ' ILE . . . . . 0.446 HD11 ' CE1' ' A' ' 17' ' ' PHE . 13.9 mt -69.95 -54.2 20.19 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.451 0 N-CA-C 109.259 -0.645 . . . . 0.0 109.259 178.297 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 69' ' ' ILE . . . . . 0.487 HG12 HD12 ' A' ' 50' ' ' ILE . 68.5 mt -48.11 -37.39 6.9 Favored 'Isoleucine or valine' 0 C--N 1.34 0.154 0 C-N-CA 124.141 0.976 . . . . 0.0 111.478 173.834 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 23.9 t70 -69.18 -43.89 73.31 Favored 'General case' 0 CA--C 1.52 -0.196 0 CA-C-N 118.912 0.778 . . . . 0.0 110.909 179.386 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 25.3 m -66.96 -56.01 12.05 Favored 'General case' 0 N--CA 1.449 -0.523 0 O-C-N 123.416 0.448 . . . . 0.0 110.024 -174.506 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -74.68 -32.97 30.26 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.386 0 N-CA-C 109.948 -0.39 . . . . 0.0 109.948 -176.944 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -65.57 -58.46 9.26 Favored Glycine 0 C--N 1.339 0.71 0 N-CA-C 111.388 -0.685 . . . . 0.0 111.388 -175.412 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 46.4 mtm105 -69.26 -36.41 77.1 Favored 'General case' 0 N--CA 1.456 -0.166 0 CA-C-N 117.455 0.628 . . . . 0.0 110.542 -178.972 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -64.23 -29.38 70.48 Favored 'General case' 0 N--CA 1.45 -0.433 0 C-N-CA 119.645 -0.822 . . . . 0.0 110.707 179.658 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 1.6 m-30 -71.27 -45.98 61.94 Favored 'General case' 0 C--N 1.342 0.244 0 CA-C-N 118.594 0.634 . . . . 0.0 110.637 175.399 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -64.58 -45.11 88.39 Favored 'General case' 0 N--CA 1.45 -0.452 0 N-CA-C 108.027 -1.101 . . . . 0.0 108.027 -178.123 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 92.2 m-20 -55.92 -46.85 78.34 Favored 'General case' 0 C--O 1.231 0.082 0 N-CA-C 113.463 0.912 . . . . 0.0 113.463 173.927 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 12.4 tm-20 -64.13 -47.44 79.92 Favored 'General case' 0 N--CA 1.449 -0.48 0 CA-C-N 118.604 0.638 . . . . 0.0 111.054 -178.341 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 80' ' ' THR . . . . . 0.563 HG21 ' HB3' ' A' ' 94' ' ' CYS . 75.7 p -69.34 -27.23 65.17 Favored 'General case' 0 N--CA 1.453 -0.304 0 CA-C-O 119.692 -0.194 . . . . 0.0 110.685 -179.409 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 36.4 ttp-105 -70.34 -27.69 64.56 Favored 'General case' 0 N--CA 1.451 -0.395 0 CA-C-N 118.096 0.407 . . . . 0.0 110.189 172.618 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 32.2 m -86.5 -35.94 19.29 Favored 'General case' 0 N--CA 1.453 -0.276 0 N-CA-C 113.025 0.75 . . . . 0.0 113.025 -176.417 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 53.2 m-20 -128.14 12.43 6.61 Favored 'General case' 0 CA--C 1.519 -0.242 0 N-CA-C 114.709 1.374 . . . . 0.0 114.709 -174.72 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 30.0 t 60.57 -21.26 0.03 OUTLIER 'General case' 0 N--CA 1.451 -0.41 0 N-CA-C 116.474 2.027 . . . . 0.0 116.474 173.959 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 85' ' ' ASN . . . . . 0.471 ' OD1' HG22 ' A' ' 80' ' ' THR . 1.1 m-80 55.72 -175.66 0.05 OUTLIER 'General case' 0 CA--C 1.533 0.323 0 C-N-CA 124.047 0.939 . . . . 0.0 111.058 -174.402 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 70.3 m -68.05 139.54 56.27 Favored 'General case' 0 N--CA 1.456 -0.13 0 O-C-N 122.016 -0.428 . . . . 0.0 111.133 -178.805 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 88.9 p -87.99 37.55 0.81 Allowed 'General case' 0 CA--C 1.532 0.263 0 C-N-CA 123.647 0.779 . . . . 0.0 111.378 -179.481 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 37.9 t -152.43 164.62 37.16 Favored 'General case' 0 N--CA 1.455 -0.222 0 N-CA-C 109.882 -0.414 . . . . 0.0 109.882 -177.309 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 59.4 m-20 55.96 -163.93 0.14 Allowed 'General case' 0 CA--C 1.53 0.201 0 C-N-CA 123.583 0.753 . . . . 0.0 111.049 -175.536 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 90' ' ' LYS . . . . . 0.715 ' H ' ' HD2' ' A' ' 91' ' ' PRO . 83.0 tttt -144.13 -50.49 0.02 OUTLIER Pre-proline 0 CA--C 1.531 0.24 0 CA-C-O 118.286 -0.864 . . . . 0.0 111.708 177.356 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 91' ' ' PRO . . . . . 0.715 ' HD2' ' H ' ' A' ' 90' ' ' LYS . 56.3 Cg_endo -64.47 149.88 89.23 Favored 'Trans proline' 0 N--CA 1.45 -1.047 0 N-CA-C 108.467 -1.397 . . . . 0.0 108.467 172.269 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 90.23 17.06 54.49 Favored Glycine 0 CA--C 1.524 0.628 0 CA-C-O 119.417 -0.657 . . . . 0.0 112.277 -177.289 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 38.5 p -151.61 172.5 15.95 Favored 'General case' 0 C--N 1.341 0.201 0 CA-C-N 117.946 0.873 . . . . 0.0 110.203 176.739 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 94' ' ' CYS . . . . . 0.563 ' HB3' HG21 ' A' ' 80' ' ' THR . 26.2 p -59.98 -20.99 60.61 Favored 'General case' 0 N--CA 1.449 -0.493 0 CA-C-N 115.621 -0.718 . . . . 0.0 109.936 175.682 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -60.29 -55.26 35.84 Favored 'General case' 0 N--CA 1.448 -0.53 0 N-CA-C 109.398 -0.593 . . . . 0.0 109.398 -177.261 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 69.3 t60 -75.46 -34.74 60.95 Favored 'General case' 0 N--CA 1.448 -0.546 0 CA-C-N 116.736 -0.211 . . . . 0.0 110.906 179.68 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -66.18 -49.41 67.45 Favored 'General case' 0 N--CA 1.451 -0.413 0 O-C-N 123.09 0.244 . . . . 0.0 111.126 -176.17 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 98' ' ' ILE . . . . . 0.434 HD13 ' HB2' ' A' ' 94' ' ' CYS . 1.7 mp -72.79 -34.62 47.4 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.251 0 CA-C-O 119.234 -0.413 . . . . 0.0 109.986 179.699 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 1.4 m120 -66.14 -40.23 90.47 Favored 'General case' 0 N--CA 1.453 -0.289 0 CA-C-N 118.612 0.642 . . . . 0.0 111.293 178.715 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 92.6 m -75.19 -34.85 61.56 Favored 'General case' 0 N--CA 1.454 -0.256 0 CA-C-N 118.008 0.367 . . . . 0.0 110.838 -178.471 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 58.8 tp -75.65 -38.77 58.58 Favored 'General case' 0 N--CA 1.451 -0.417 0 C-N-CA 122.886 0.474 . . . . 0.0 111.013 -178.589 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -67.18 -23.58 73.15 Favored Glycine 0 CA--C 1.528 0.856 0 CA-C-O 119.542 -0.588 . . . . 0.0 113.441 -173.479 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 16.3 mm-40 -74.63 -35.77 62.91 Favored 'General case' 0 CA--C 1.52 -0.188 0 CA-C-N 118.158 0.979 . . . . 0.0 111.179 179.41 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 25.9 m -101.77 -13.43 8.41 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.138 0 N-CA-C 113.379 0.881 . . . . 0.0 113.379 -176.114 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 105' ' ' ILE . . . . . . . . . . . . . 11.0 tp -61.84 -27.24 41.89 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.161 0 CA-C-N 119.18 0.9 . . . . 0.0 111.564 -175.282 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 19.8 pt20 -67.0 -29.86 69.8 Favored 'General case' 0 N--CA 1.453 -0.277 0 N-CA-C 109.994 -0.373 . . . . 0.0 109.994 176.704 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 86.1 mt-10 -75.75 -41.31 53.63 Favored 'General case' 0 N--CA 1.454 -0.265 0 N-CA-C 109.918 -0.401 . . . . 0.0 109.918 175.806 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 9.9 mp -64.66 -41.97 95.72 Favored 'General case' 0 C--N 1.34 0.164 0 N-CA-C 110.361 -0.237 . . . . 0.0 110.361 -178.472 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 72.3 mt -66.85 -50.78 61.44 Favored 'General case' 0 N--CA 1.453 -0.284 0 N-CA-C 109.833 -0.432 . . . . 0.0 109.833 178.952 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 16.8 m -59.51 -45.79 90.71 Favored 'General case' 0 C--O 1.232 0.155 0 CA-C-N 117.724 0.238 . . . . 0.0 111.022 -178.744 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 44.7 t0 -62.83 -38.44 90.77 Favored 'General case' 0 N--CA 1.454 -0.234 0 N-CA-C 108.932 -0.766 . . . . 0.0 108.932 179.258 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -68.03 -31.65 71.47 Favored 'General case' 0 N--CA 1.446 -0.645 0 CA-C-O 119.352 -0.356 . . . . 0.0 111.611 -176.531 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 113' ' ' ILE . . . . . . . . . . . . . 31.2 mm -70.38 -44.1 77.68 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.269 0 C-N-CA 118.856 -1.137 . . . . 0.0 109.362 178.011 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -72.91 -33.92 66.29 Favored 'General case' 0 N--CA 1.452 -0.334 0 N-CA-C 113.033 0.753 . . . . 0.0 113.033 -178.483 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -79.45 -37.01 37.94 Favored 'General case' 0 C--N 1.34 0.174 0 CA-C-N 118.293 0.497 . . . . 0.0 111.805 -179.186 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 116' ' ' SER . . . . . 0.496 ' HB2' ' CB ' ' A' ' 120' ' ' HIS . 21.0 p -85.45 164.6 17.78 Favored 'General case' 0 N--CA 1.449 -0.488 0 CA-C-O 120.93 0.395 . . . . 0.0 112.019 -171.431 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 20.4 m-80 -78.43 -100.19 0.02 OUTLIER 'General case' 0 N--CA 1.455 -0.204 0 N-CA-C 113.557 0.947 . . . . 0.0 113.557 -171.095 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 118' ' ' GLN . . . . . 0.482 ' HA ' ' HE2' ' A' ' 121' ' ' LYS . 14.8 mm100 -136.84 -49.84 0.64 Allowed 'General case' 0 CA--C 1.52 -0.174 0 CA-C-O 120.862 0.363 . . . . 0.0 110.355 -179.005 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 119' ' ' ASP . . . . . 0.407 ' N ' ' OD1' ' A' ' 119' ' ' ASP . 10.3 p-10 -62.9 -39.17 93.72 Favored 'General case' 0 N--CA 1.453 -0.3 0 N-CA-C 108.471 -0.937 . . . . 0.0 108.471 175.206 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 120' ' ' HIS . . . . . 0.496 ' CB ' ' HB2' ' A' ' 116' ' ' SER . 39.9 m170 -66.04 -40.91 91.36 Favored 'General case' 0 N--CA 1.45 -0.457 0 CA-C-N 115.687 -0.688 . . . . 0.0 110.881 176.477 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 121' ' ' LYS . . . . . 0.482 ' HE2' ' HA ' ' A' ' 118' ' ' GLN . 38.2 mtmt -63.67 -34.85 78.77 Favored 'General case' 0 N--CA 1.455 -0.213 0 N-CA-C 109.795 -0.446 . . . . 0.0 109.795 179.443 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 4.8 tm-20 -64.41 -48.66 74.55 Favored 'General case' 0 N--CA 1.456 -0.131 0 CA-C-N 117.705 0.23 . . . . 0.0 110.418 178.239 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 69.7 mmtt -59.8 -30.82 69.16 Favored 'General case' 0 N--CA 1.455 -0.214 0 CA-C-N 116.786 -0.188 . . . . 0.0 111.459 179.222 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 124' ' ' ILE . . . . . . . . . . . . . 51.3 mt -74.75 -34.34 33.7 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.293 0 O-C-N 121.882 -0.511 . . . . 0.0 110.183 178.681 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 125' ' ' ARG . . . . . 0.433 ' HE ' ' CE1' ' A' ' 159' ' ' HIS . 24.1 mmt180 -68.46 -35.83 78.12 Favored 'General case' 0 N--CA 1.455 -0.189 0 CA-C-O 119.361 -0.352 . . . . 0.0 111.244 178.394 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 126' ' ' MET . . . . . . . . . . . . . 27.8 ptm -71.91 -33.48 68.32 Favored 'General case' 0 C--N 1.34 0.154 0 C-N-CA 119.333 -0.947 . . . . 0.0 109.514 177.659 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 127' ' ' LEU . . . . . 0.414 HD11 ' CD2' ' A' ' 67' ' ' TYR . 65.2 mt -70.7 -25.7 63.08 Favored 'General case' 0 C--N 1.341 0.2 0 CA-C-N 118.109 0.413 . . . . 0.0 110.167 175.882 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 55.3 tp -68.99 -42.97 75.82 Favored 'General case' 0 N--CA 1.452 -0.327 0 N-CA-C 109.793 -0.447 . . . . 0.0 109.793 177.875 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 12.9 t70 -61.46 -46.2 91.04 Favored 'General case' 0 N--CA 1.456 -0.133 0 N-CA-C 109.576 -0.528 . . . . 0.0 109.576 175.641 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 72.9 mt -59.86 -40.42 82.7 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.392 0 CA-C-N 116.362 -0.381 . . . . 0.0 110.991 -177.42 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 131' ' ' TRP . . . . . . . . . . . . . 46.1 m0 -76.73 -25.11 53.15 Favored 'General case' 0 N--CA 1.453 -0.306 0 N-CA-C 112.754 0.65 . . . . 0.0 112.754 178.535 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 31.7 t0 -74.66 -28.78 61.0 Favored 'General case' 0 N--CA 1.456 -0.16 0 CA-C-N 118.282 0.492 . . . . 0.0 110.185 178.607 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 133' ' ' ARG . . . . . 0.488 HH21 ' C ' ' B' 2063 ' ' SER . 18.4 mtp180 -75.22 -41.69 57.06 Favored 'General case' 0 N--CA 1.456 -0.158 0 C-N-CA 124.243 1.017 . . . . 0.0 109.875 175.555 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 37.1 t -75.28 -10.45 59.47 Favored 'General case' 0 N--CA 1.454 -0.263 0 C-N-CA 123.19 0.596 . . . . 0.0 111.798 -179.238 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 135' ' ' GLY . . . . . . . . . . . . . . . 74.49 1.7 61.8 Favored Glycine 0 CA--C 1.527 0.832 0 CA-C-O 119.373 -0.682 . . . . 0.0 112.222 179.786 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 136' ' ' LEU . . . . . 0.442 HD23 ' HA ' ' A' ' 136' ' ' LEU . 13.4 mt -76.86 -17.42 58.98 Favored 'General case' 0 CA--C 1.529 0.151 0 CA-C-N 118.103 0.952 . . . . 0.0 111.057 178.294 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 137' ' ' PHE . . . . . . . . . . . . . 54.2 t80 -93.16 140.58 29.36 Favored 'General case' 0 N--CA 1.452 -0.371 0 N-CA-C 109.131 -0.692 . . . . 0.0 109.131 173.078 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 138' ' ' GLN . . . . . . . . . . . . . 20.8 pt20 -67.63 123.61 20.94 Favored 'General case' 0 N--CA 1.453 -0.321 0 N-CA-C 108.953 -0.758 . . . . 0.0 108.953 178.099 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 139' ' ' LYS . . . . . . . . . . . . . 26.2 mtpp -76.43 22.74 0.16 Allowed 'General case' 0 CA--C 1.53 0.182 0 C-N-CA 122.542 0.337 . . . . 0.0 111.407 -178.258 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 140' ' ' SER . . . . . . . . . . . . . 79.4 p -82.31 -16.69 48.43 Favored 'General case' 0 N--CA 1.456 -0.175 0 C-N-CA 123.878 0.871 . . . . 0.0 110.344 176.719 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 141' ' ' TYR . . . . . . . . . . . . . 74.2 m-85 48.17 55.3 8.95 Favored 'General case' 0 C--N 1.342 0.246 0 C-N-CA 124.052 0.941 . . . . 0.0 112.468 177.098 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 142' ' ' LEU . . . . . . . . . . . . . 64.2 mt -63.41 156.12 26.96 Favored 'General case' 0 C--O 1.233 0.187 0 CA-C-O 121.164 0.507 . . . . 0.0 112.141 -176.407 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 24.9 p-10 -71.31 -21.68 62.04 Favored 'General case' 0 N--CA 1.456 -0.137 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.89 -179.981 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . -62.18 -41.45 98.35 Favored 'General case' 0 N--CA 1.452 -0.343 0 N-CA-C 109.939 -0.393 . . . . 0.0 109.939 179.363 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 145' ' ' ILE . . . . . . . . . . . . . 18.2 mm -63.15 -29.1 46.41 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.317 0 C-N-CA 122.22 0.208 . . . . 0.0 110.913 177.275 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 146' ' ' ARG . . . . . 0.506 ' HG2' HH11 ' A' ' 146' ' ' ARG . 5.5 mmt-85 -73.21 -27.54 61.67 Favored 'General case' 0 C--N 1.339 0.134 0 N-CA-C 109.527 -0.546 . . . . 0.0 109.527 178.451 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 147' ' ' SER . . . . . . . . . . . . . 48.2 t 55.09 43.2 29.99 Favored 'General case' 0 N--CA 1.456 -0.129 0 C-N-CA 123.502 0.721 . . . . 0.0 111.849 177.836 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 148' ' ' LYS . . . . . 0.511 ' HA ' ' HE2' ' A' ' 148' ' ' LYS . 6.2 mmpt? -58.58 -18.52 30.62 Favored 'General case' 0 N--CA 1.453 -0.296 0 N-CA-C 113.347 0.869 . . . . 0.0 113.347 -175.534 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 149' ' ' CYS . . . . . . . . . . . . . 23.6 p -69.2 -50.69 45.14 Favored 'General case' 0 N--CA 1.452 -0.359 0 CA-C-N 118.795 0.725 . . . . 0.0 109.441 177.301 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 150' ' ' PHE . . . . . . . . . . . . . 36.5 t80 -71.55 -18.61 62.24 Favored 'General case' 0 N--CA 1.454 -0.26 0 N-CA-C 109.963 -0.384 . . . . 0.0 109.963 179.76 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 151' ' ' ALA . . . . . . . . . . . . . . . -74.84 -39.35 61.66 Favored 'General case' 0 N--CA 1.45 -0.427 0 N-CA-C 110.243 -0.28 . . . . 0.0 110.243 176.106 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 152' ' ' MET . . . . . . . . . . . . . 97.3 mtp -75.88 -18.61 59.35 Favored 'General case' 0 N--CA 1.456 -0.141 0 C-N-CA 122.378 0.271 . . . . 0.0 111.142 177.508 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 153' ' ' ASP . . . . . . . . . . . . . 67.3 m-20 -69.55 -5.57 25.21 Favored 'General case' 0 CA--C 1.53 0.211 0 C-N-CA 122.504 0.321 . . . . 0.0 111.033 171.21 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 154' ' ' LEU . . . . . . . . . . . . . 80.9 mt -124.54 151.91 44.12 Favored 'General case' 0 N--CA 1.454 -0.247 0 C-N-CA 123.511 0.724 . . . . 0.0 110.028 179.191 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 155' ' ' GLU . . . . . . . . . . . . . 43.2 mp0 -67.51 -13.44 62.05 Favored 'General case' 0 N--CA 1.455 -0.199 0 C-N-CA 122.689 0.396 . . . . 0.0 111.057 -178.822 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 156' ' ' HIS . . . . . . . . . . . . . 26.6 m80 -78.07 -15.99 58.42 Favored 'General case' 0 N--CA 1.454 -0.23 0 C-N-CA 122.913 0.485 . . . . 0.0 111.978 -179.892 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 157' ' ' HIS . . . . . . . . . . . . . 95.2 m-70 55.69 10.25 0.51 Allowed 'General case' 0 CA--C 1.533 0.302 0 C-N-CA 123.835 0.854 . . . . 0.0 112.931 -176.552 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 158' ' ' HIS . . . . . . . . . . . . . 99.3 m-70 -148.72 172.11 15.13 Favored 'General case' 0 N--CA 1.454 -0.246 0 C-N-CA 124.539 1.136 . . . . 0.0 109.419 -179.242 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 159' ' ' HIS . . . . . 0.433 ' CE1' ' HE ' ' A' ' 125' ' ' ARG . 17.9 p-80 . . . . . 0 C--O 1.252 1.215 0 CA-C-O 116.413 -1.756 . . . . 0.0 110.117 178.325 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B 2052 ' ' ASP . . . . . . . . . . . . . 2.9 m-20 . . . . . 0 N--CA 1.474 0.754 0 N-CA-C 110.598 -0.149 . . . . 0.0 110.598 . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' B' B 2053 ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -123.03 165.66 16.41 Favored 'General case' 0 CA--C 1.535 0.394 0 C-N-CA 124.067 0.947 . . . . 0.0 109.179 -177.434 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B 2054 ' ' ASP . . . . . 0.485 ' CG ' ' H ' ' B' 2055 ' ' GLU . 11.6 p-10 -155.81 -114.36 0.03 OUTLIER 'General case' 0 CA--C 1.538 0.509 0 CA-C-N 118.54 0.609 . . . . 0.0 112.286 -170.946 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B 2055 ' ' GLU . . . . . 0.485 ' H ' ' CG ' ' B' 2054 ' ' ASP . 67.9 tt0 -72.19 61.99 0.47 Allowed 'General case' 0 CA--C 1.532 0.265 0 C-N-CA 125.645 1.578 . . . . 0.0 109.461 178.438 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B 2056 ' ' ASP . . . . . . . . . . . . . 10.4 m-20 -68.13 15.64 0.05 OUTLIER 'General case' 0 N--CA 1.455 -0.199 0 N-CA-C 113.899 1.074 . . . . 0.0 113.899 -176.866 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B 2057 ' ' ASP . . . . . . . . . . . . . 40.3 t0 -154.61 62.06 0.67 Allowed 'General case' 0 N--CA 1.454 -0.226 0 CA-C-N 118.371 0.532 . . . . 0.0 110.486 175.097 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B 2058 ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -50.48 129.98 23.01 Favored 'General case' 0 N--CA 1.454 -0.265 0 N-CA-C 109.499 -0.556 . . . . 0.0 109.499 175.49 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B 2059 ' ' THR . . . . . . . . . . . . . 72.3 p -91.2 111.47 48.8 Favored Pre-proline 0 C--O 1.233 0.192 0 N-CA-C 109.562 -0.533 . . . . 0.0 109.562 179.923 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B 2060 ' ' PRO . . . . . . . . . . . . . 98.1 Cg_endo -73.85 128.06 12.08 Favored 'Trans proline' 0 N--CA 1.45 -1.041 0 C-N-CA 123.219 2.613 . . . . 0.0 111.245 -178.856 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B 2061 ' ' SER . . . . . . . . . . . . . 74.0 p -81.09 132.32 35.35 Favored 'General case' 0 N--CA 1.453 -0.295 0 N-CA-C 107.988 -1.115 . . . . 0.0 107.988 172.935 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B 2062 ' ' ILE . . . . . 0.437 HD11 ' HB2' ' A' ' 133' ' ' ARG . 3.8 tp -153.21 129.42 1.81 Allowed 'Isoleucine or valine' 0 C--N 1.341 0.196 0 N-CA-C 112.515 0.561 . . . . 0.0 112.515 -174.367 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B 2063 ' ' SER . . . . . 0.488 ' C ' HH21 ' A' ' 133' ' ' ARG . 39.7 m . . . . . 0 C--O 1.251 1.137 0 CA-C-O 117.674 -1.155 . . . . 0.0 109.748 174.701 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 93.5 mmm . . . . . 0 N--CA 1.471 0.617 0 N-CA-C 110.386 -0.227 . . . . 0.0 110.386 . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 6.7 tt0 -149.9 14.09 0.81 Allowed 'General case' 0 N--CA 1.455 -0.201 0 CA-C-O 120.715 0.293 . . . . 0.0 111.211 177.045 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 17.9 pm0 -76.79 52.16 0.82 Allowed 'General case' 0 CA--C 1.53 0.201 0 C-N-CA 123.552 0.741 . . . . 0.0 109.209 175.847 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 70.5 m-20 61.07 15.99 6.7 Favored 'General case' 0 N--CA 1.456 -0.127 0 C-N-CA 124.999 1.32 . . . . 0.0 113.612 -174.777 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 45.1 p-10 -97.03 1.69 50.49 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.513 0.673 . . . . 0.0 110.504 173.633 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 24.1 p-10 -91.55 -32.61 15.48 Favored 'General case' 0 N--CA 1.451 -0.385 0 N-CA-C 106.98 -1.489 . . . . 0.0 106.98 171.851 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 7' ' ' PHE . . . . . 0.471 ' CD1' ' HD3' ' A' ' 45' ' ' LYS . 1.2 t80 -56.51 -34.37 66.92 Favored 'General case' 0 N--CA 1.449 -0.509 0 C-N-CA 125.144 1.378 . . . . 0.0 109.248 176.49 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 51.7 tp60 -49.77 -37.49 30.04 Favored 'General case' 0 N--CA 1.453 -0.308 0 C-N-CA 124.452 1.101 . . . . 0.0 111.861 -178.606 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 23.9 m-80 -73.02 -34.54 66.43 Favored 'General case' 0 N--CA 1.454 -0.232 0 CA-C-O 120.871 0.367 . . . . 0.0 110.23 -179.487 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 10' ' ' PHE . . . . . 0.458 ' CD2' ' HB2' ' A' ' 32' ' ' LEU . 9.1 t80 -70.05 -39.18 75.87 Favored 'General case' 0 N--CA 1.449 -0.498 0 C-N-CA 123.442 0.697 . . . . 0.0 109.454 176.777 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 98.7 t -64.56 -51.44 67.65 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.299 0 N-CA-C 108.757 -0.831 . . . . 0.0 108.757 178.978 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -59.21 -31.41 69.01 Favored 'General case' 0 N--CA 1.455 -0.175 0 CA-C-N 117.639 0.2 . . . . 0.0 111.529 179.737 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 46.8 m -71.17 -41.51 70.25 Favored 'General case' 0 N--CA 1.457 -0.111 0 N-CA-C 109.075 -0.713 . . . . 0.0 109.075 176.56 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -62.47 -41.61 98.9 Favored 'General case' 0 N--CA 1.451 -0.421 0 N-CA-C 109.482 -0.562 . . . . 0.0 109.482 177.929 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 61.4 mm-40 -66.38 -27.81 68.16 Favored 'General case' 0 N--CA 1.453 -0.314 0 C-N-CA 123.491 0.716 . . . . 0.0 110.137 179.312 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 16.0 p -70.9 -30.65 67.05 Favored 'General case' 0 N--CA 1.455 -0.19 0 N-CA-C 110.08 -0.341 . . . . 0.0 110.08 177.068 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 17' ' ' PHE . . . . . 0.48 ' CD1' HD11 ' A' ' 68' ' ' ILE . 24.4 m-85 -71.45 -32.03 67.86 Favored 'General case' 0 N--CA 1.457 -0.123 0 C-N-CA 120.675 -0.41 . . . . 0.0 110.764 173.672 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 76.4 mttt -67.21 -28.1 67.79 Favored 'General case' 0 C--O 1.232 0.171 0 CA-C-O 121.276 0.56 . . . . 0.0 109.939 172.1 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 41.0 t0 -76.09 -38.97 56.33 Favored 'General case' 0 CA--C 1.531 0.217 0 CA-C-N 115.861 -0.609 . . . . 0.0 110.676 -179.252 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 74.5 mt -74.89 128.74 36.29 Favored 'General case' 0 N--CA 1.454 -0.245 0 N-CA-C 109.187 -0.671 . . . . 0.0 109.187 175.05 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 21' ' ' LYS . . . . . 0.529 ' HA ' ' HE3' ' A' ' 21' ' ' LYS . 0.4 OUTLIER -73.8 -12.48 60.71 Favored 'General case' 0 CA--C 1.53 0.177 0 O-C-N 121.857 -0.527 . . . . 0.0 110.485 176.946 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 80.7 p -88.04 -23.88 23.64 Favored 'General case' 0 N--CA 1.457 -0.105 0 C-N-CA 123.176 0.59 . . . . 0.0 110.388 174.395 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 70.63 -12.31 2.04 Favored Glycine 0 CA--C 1.531 1.051 0 C-N-CA 124.698 1.142 . . . . 0.0 113.582 177.763 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 74.4 mt -106.22 148.91 10.1 Favored 'Isoleucine or valine' 0 C--N 1.334 -0.092 0 CA-C-N 118.073 0.936 . . . . 0.0 110.858 -179.47 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 31.2 t -166.91 100.48 0.55 Allowed 'General case' 0 CA--C 1.519 -0.24 0 N-CA-C 108.755 -0.831 . . . . 0.0 108.755 174.979 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -50.38 -41.44 40.44 Favored Glycine 0 CA--C 1.523 0.586 0 CA-C-O 119.375 -0.681 . . . . 0.0 111.431 -176.85 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 27' ' ' SER . . . . . 0.598 ' HB3' ' HA ' ' B' 2052 ' ' ASP . 29.5 t -62.89 -52.17 64.13 Favored 'General case' 0 N--CA 1.454 -0.268 0 CA-C-N 118.484 1.142 . . . . 0.0 110.895 -178.084 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 72.3 mtt180 -70.8 -35.65 72.62 Favored 'General case' 0 CA--C 1.522 -0.122 0 C-N-CA 122.82 0.448 . . . . 0.0 110.499 -176.719 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 61.3 mt -58.09 -46.73 88.13 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.575 0 N-CA-C 108.114 -1.069 . . . . 0.0 108.114 174.719 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 63.9 mttt -65.6 -28.12 68.9 Favored 'General case' 0 C--N 1.341 0.211 0 CA-C-O 118.692 -0.671 . . . . 0.0 111.858 178.433 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.3 -57.33 10.74 Favored 'General case' 0 C--N 1.342 0.264 0 CA-C-N 118.935 0.789 . . . . 0.0 109.783 179.694 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.546 HD12 ' N ' ' A' ' 33' ' ' THR . 1.6 pp -75.63 -19.09 59.44 Favored 'General case' 0 N--CA 1.453 -0.279 0 C-N-CA 119.427 -0.909 . . . . 0.0 111.911 -177.356 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 33' ' ' THR . . . . . 0.546 ' N ' HD12 ' A' ' 32' ' ' LEU . 52.2 m -72.46 -36.44 68.5 Favored 'General case' 0 N--CA 1.454 -0.24 0 N-CA-C 108.455 -0.942 . . . . 0.0 108.455 176.925 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 96.0 m -72.5 -36.41 68.38 Favored 'General case' 0 N--CA 1.451 -0.387 0 CA-C-N 116.613 -0.267 . . . . 0.0 110.432 -179.942 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 12.2 t80 -61.21 -40.2 93.08 Favored 'General case' 0 N--CA 1.456 -0.16 0 N-CA-C 109.608 -0.516 . . . . 0.0 109.608 174.779 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -70.1 -34.67 73.41 Favored 'General case' 0 N--CA 1.448 -0.555 0 CA-C-N 116.072 -0.513 . . . . 0.0 111.135 -179.475 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 22.1 mt -71.1 -39.97 71.8 Favored 'General case' 0 N--CA 1.453 -0.313 0 C-N-CA 122.315 0.246 . . . . 0.0 111.22 179.776 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 44.4 t0 -64.69 -24.46 67.58 Favored 'General case' 0 N--CA 1.453 -0.285 0 C-N-CA 122.447 0.299 . . . . 0.0 110.784 176.864 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 39' ' ' HIS . . . . . 0.433 ' HB2' HD11 ' A' ' 42' ' ' ILE . 97.9 m-70 -149.82 102.06 3.11 Favored 'General case' 0 N--CA 1.454 -0.267 0 C-N-CA 122.499 0.319 . . . . 0.0 111.716 -176.082 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 40' ' ' ILE . . . . . 0.546 ' H ' HD13 ' A' ' 40' ' ' ILE . 0.0 OUTLIER -81.0 -15.49 12.58 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.279 0 C-N-CA 123.038 0.535 . . . . 0.0 110.872 177.009 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 2.9 m-20 -58.9 -20.12 48.55 Favored 'General case' 0 N--CA 1.454 -0.263 0 N-CA-C 112.546 0.572 . . . . 0.0 112.546 -177.128 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 42' ' ' ILE . . . . . 0.433 HD11 ' HB2' ' A' ' 39' ' ' HIS . 0.0 OUTLIER -104.35 17.65 5.14 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.258 0 C-N-CA 123.277 0.631 . . . . 0.0 111.792 176.497 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 3.0 pp20? -54.57 -27.99 42.72 Favored 'General case' 0 CA--C 1.529 0.16 0 O-C-N 121.75 -0.594 . . . . 0.0 111.281 178.299 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 32.8 t -63.93 -48.32 77.01 Favored 'General case' 0 N--CA 1.454 -0.234 0 N-CA-C 111.788 0.292 . . . . 0.0 111.788 -178.708 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 45' ' ' LYS . . . . . 0.471 ' HD3' ' CD1' ' A' ' 7' ' ' PHE . 18.2 ptpt -73.77 -23.18 59.68 Favored 'General case' 0 C--N 1.339 0.152 0 CA-C-N 118.541 0.609 . . . . 0.0 110.121 179.765 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 59.2 mt -72.85 -52.51 22.31 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.343 0 C-N-CA 122.698 0.399 . . . . 0.0 110.603 -178.999 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 39.2 mm -66.52 -36.39 77.19 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.245 0 N-CA-C 109.745 -0.465 . . . . 0.0 109.745 179.546 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 31.9 m -68.66 -40.35 80.21 Favored 'General case' 0 N--CA 1.454 -0.225 0 C-N-CA 121.114 -0.234 . . . . 0.0 111.162 -178.797 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 37.2 tp -75.97 -31.65 59.12 Favored 'General case' 0 N--CA 1.45 -0.463 0 N-CA-C 112.743 0.646 . . . . 0.0 112.743 -175.971 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 50' ' ' ILE . . . . . 0.505 HD12 HG12 ' A' ' 69' ' ' ILE . 3.3 pt -71.49 -43.87 71.69 Favored 'Isoleucine or valine' 0 C--N 1.34 0.163 0 CA-C-N 118.923 0.783 . . . . 0.0 110.596 177.165 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 25.1 pt -66.09 -38.14 81.34 Favored 'Isoleucine or valine' 0 C--N 1.339 0.136 0 C-N-CA 119.469 -0.892 . . . . 0.0 110.598 176.941 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 94.9 m-20 -68.87 -31.35 70.23 Favored 'General case' 0 N--CA 1.454 -0.232 0 CA-C-N 118.248 0.476 . . . . 0.0 111.34 177.471 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 7.8 t80 -60.0 -48.76 80.39 Favored 'General case' 0 N--CA 1.451 -0.376 0 N-CA-C 107.684 -1.228 . . . . 0.0 107.684 173.832 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 46.3 t -67.24 -27.76 67.49 Favored 'General case' 0 C--N 1.34 0.174 0 CA-C-N 117.82 0.282 . . . . 0.0 111.73 -179.404 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 55.2 ttp85 -75.16 -29.67 60.53 Favored 'General case' 0 N--CA 1.453 -0.309 0 N-CA-C 112.161 0.43 . . . . 0.0 112.161 -177.222 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 36.3 mt -99.37 -43.07 6.71 Favored 'General case' 0 N--CA 1.457 -0.101 0 N-CA-C 112.378 0.51 . . . . 0.0 112.378 -179.078 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 57' ' ' CYS . . . . . 0.478 ' HB2' ' HD2' ' A' ' 58' ' ' PRO . 9.0 p -67.75 161.36 67.11 Favored Pre-proline 0 CA--C 1.534 0.351 0 N-CA-C 113.226 0.824 . . . . 0.0 113.226 -173.084 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 58' ' ' PRO . . . . . 0.478 ' HD2' ' HB2' ' A' ' 57' ' ' CYS . 66.6 Cg_endo -78.5 178.47 7.53 Favored 'Trans proline' 0 N--CA 1.453 -0.871 0 C-N-CA 124.859 3.706 . . . . 0.0 111.743 178.119 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -44.49 -55.53 5.01 Favored 'General case' 0 CA--C 1.531 0.229 0 C-N-CA 126.016 1.726 . . . . 0.0 114.557 -171.182 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 47.8 m -68.93 -30.18 68.59 Favored 'General case' 0 N--CA 1.455 -0.213 0 O-C-N 122.126 -0.359 . . . . 0.0 110.827 -173.441 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 67.6 m170 -75.69 -28.5 58.68 Favored 'General case' 0 N--CA 1.451 -0.42 0 CA-C-O 119.554 -0.26 . . . . 0.0 110.412 176.795 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 61.3 mttm -65.57 -34.29 77.91 Favored 'General case' 0 C--N 1.34 0.177 0 N-CA-C 108.975 -0.75 . . . . 0.0 108.975 173.205 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 63' ' ' LEU . . . . . 0.515 HD11 ' HE3' ' A' ' 123' ' ' LYS . 0.2 OUTLIER -62.97 -47.54 82.73 Favored 'General case' 0 C--N 1.34 0.173 0 N-CA-C 109.088 -0.708 . . . . 0.0 109.088 175.609 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -66.42 -34.43 87.8 Favored Glycine 0 CA--C 1.524 0.6 0 CA-C-O 119.752 -0.471 . . . . 0.0 111.946 -178.287 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 27.3 t -61.3 -45.13 95.75 Favored 'General case' 0 N--CA 1.453 -0.31 0 CA-C-N 117.582 0.691 . . . . 0.0 109.543 177.452 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 80.8 mt -66.96 -27.17 67.24 Favored 'General case' 0 N--CA 1.455 -0.201 0 O-C-N 123.04 0.213 . . . . 0.0 110.517 179.363 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -71.5 -37.58 71.24 Favored 'General case' 0 C--O 1.234 0.249 0 CA-C-O 120.638 0.256 . . . . 0.0 110.964 178.198 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 68' ' ' ILE . . . . . 0.48 HD11 ' CD1' ' A' ' 17' ' ' PHE . 10.1 mt -71.5 -50.08 42.48 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.403 0 N-CA-C 109.286 -0.635 . . . . 0.0 109.286 174.498 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 69' ' ' ILE . . . . . 0.505 HG12 HD12 ' A' ' 50' ' ' ILE . 52.4 mt -48.8 -41.29 12.64 Favored 'Isoleucine or valine' 0 C--O 1.227 -0.113 0 C-N-CA 123.635 0.774 . . . . 0.0 110.78 174.977 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 10.0 t70 -67.07 -44.89 78.95 Favored 'General case' 0 N--CA 1.455 -0.218 0 CA-C-O 120.698 0.285 . . . . 0.0 110.684 179.044 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 19.6 m -69.21 -49.84 52.8 Favored 'General case' 0 N--CA 1.449 -0.483 0 CA-C-N 116.374 -0.375 . . . . 0.0 111.388 -173.762 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -75.53 -31.06 22.78 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.269 0 N-CA-C 109.678 -0.49 . . . . 0.0 109.678 -179.863 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -66.0 -49.61 57.32 Favored Glycine 0 CA--C 1.526 0.737 0 N-CA-C 111.143 -0.783 . . . . 0.0 111.143 -177.14 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 37.9 mtm105 -66.83 -43.86 82.64 Favored 'General case' 0 N--CA 1.453 -0.309 0 N-CA-C 109.585 -0.524 . . . . 0.0 109.585 177.413 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -61.77 -33.35 73.93 Favored 'General case' 0 N--CA 1.45 -0.443 0 CA-C-O 119.513 -0.28 . . . . 0.0 111.112 -176.902 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 1.5 m-30 -70.93 -46.66 62.08 Favored 'General case' 0 N--CA 1.453 -0.302 0 CA-C-N 118.162 0.437 . . . . 0.0 111.114 177.966 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -68.56 -38.49 80.79 Favored 'General case' 0 N--CA 1.45 -0.434 0 C-N-CA 117.584 -1.647 . . . . 0.0 108.057 -178.807 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 78' ' ' ASP . . . . . 0.428 ' HA ' ' HE ' ' A' ' 81' ' ' ARG . 93.8 m-20 -59.71 -48.31 82.17 Favored 'General case' 0 C--N 1.34 0.159 0 N-CA-C 112.147 0.425 . . . . 0.0 112.147 178.161 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 13.0 tm-20 -65.06 -46.74 79.95 Favored 'General case' 0 N--CA 1.446 -0.649 0 CA-C-N 117.91 0.323 . . . . 0.0 111.043 -177.425 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 80' ' ' THR . . . . . 0.503 HG21 ' HB3' ' A' ' 94' ' ' CYS . 70.5 p -68.65 -33.17 73.54 Favored 'General case' 0 N--CA 1.454 -0.241 0 CA-C-O 119.167 -0.444 . . . . 0.0 111.933 -178.257 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 81' ' ' ARG . . . . . 0.428 ' HE ' ' HA ' ' A' ' 78' ' ' ASP . 21.7 ptt180 -78.93 -23.91 44.38 Favored 'General case' 0 C--N 1.34 0.155 0 CA-C-N 118.771 0.714 . . . . 0.0 111.899 176.88 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 31.2 t -79.47 -35.3 40.52 Favored 'General case' 0 N--CA 1.454 -0.234 0 C-N-CA 123.061 0.545 . . . . 0.0 112.209 179.191 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 25.2 m-20 -125.91 137.3 53.71 Favored 'General case' 0 N--CA 1.452 -0.33 0 N-CA-C 112.092 0.404 . . . . 0.0 112.092 -169.996 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 47.1 t -79.5 48.76 0.94 Allowed 'General case' 0 CA--C 1.532 0.255 0 C-N-CA 124.146 0.978 . . . . 0.0 111.572 -178.442 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 57.3 m-20 -63.64 153.85 34.75 Favored 'General case' 0 N--CA 1.455 -0.199 0 CA-C-O 120.798 0.332 . . . . 0.0 111.114 -178.818 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 43.0 t -69.21 141.46 54.47 Favored 'General case' 0 N--CA 1.454 -0.272 0 CA-C-O 120.856 0.36 . . . . 0.0 110.071 178.841 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 78.9 p -76.52 95.54 3.91 Favored 'General case' 0 N--CA 1.453 -0.314 0 N-CA-C 109.916 -0.401 . . . . 0.0 109.916 -179.532 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 41.2 t -73.48 74.74 1.43 Allowed 'General case' 0 N--CA 1.454 -0.242 0 N-CA-C 109.02 -0.733 . . . . 0.0 109.02 175.008 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 11.5 m-80 61.15 177.2 0.11 Allowed 'General case' 0 CA--C 1.533 0.303 0 C-N-CA 124.266 1.026 . . . . 0.0 111.212 -175.913 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 60.0 tttm -67.91 -58.3 8.2 Favored Pre-proline 0 C--N 1.341 0.228 0 N-CA-C 108.706 -0.85 . . . . 0.0 108.706 174.828 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 63.7 Cg_endo -67.91 129.09 18.92 Favored 'Trans proline' 0 N--CA 1.451 -0.996 0 N-CA-C 107.51 -1.765 . . . . 0.0 107.51 169.594 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 114.64 16.82 7.31 Favored Glycine 0 CA--C 1.525 0.696 0 CA-C-O 119.468 -0.629 . . . . 0.0 112.457 -172.978 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 26.9 p -151.59 170.58 19.33 Favored 'General case' 0 N--CA 1.456 -0.17 0 C-N-CA 123.825 0.85 . . . . 0.0 110.34 177.35 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 94' ' ' CYS . . . . . 0.503 ' HB3' HG21 ' A' ' 80' ' ' THR . 23.0 p -58.93 -23.86 61.83 Favored 'General case' 0 N--CA 1.451 -0.407 0 CA-C-N 115.891 -0.595 . . . . 0.0 109.469 175.582 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -60.13 -57.68 11.77 Favored 'General case' 0 N--CA 1.447 -0.606 0 N-CA-C 109.293 -0.632 . . . . 0.0 109.293 -177.178 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 52.4 t60 -75.55 -27.02 58.49 Favored 'General case' 0 N--CA 1.451 -0.419 0 C-N-CA 121.069 -0.252 . . . . 0.0 111.565 -179.893 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -69.51 -48.3 61.0 Favored 'General case' 0 N--CA 1.453 -0.307 0 CA-C-N 117.801 0.273 . . . . 0.0 110.693 -178.652 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 98' ' ' ILE . . . . . 0.43 HD13 ' HB2' ' A' ' 94' ' ' CYS . 2.0 mp -70.57 -30.94 44.62 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.226 0 N-CA-C 109.882 -0.414 . . . . 0.0 109.882 177.815 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 4.6 m120 -63.63 -49.79 71.91 Favored 'General case' 0 N--CA 1.454 -0.266 0 CA-C-N 118.337 0.517 . . . . 0.0 110.89 175.216 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 49.7 m -70.42 -24.47 62.92 Favored 'General case' 0 N--CA 1.457 -0.11 0 O-C-N 123.131 0.269 . . . . 0.0 111.085 -175.289 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 57.2 tp -83.28 -50.24 8.6 Favored 'General case' 0 N--CA 1.45 -0.467 0 C-N-CA 122.436 0.294 . . . . 0.0 110.696 179.685 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -69.53 -18.02 73.28 Favored Glycine 0 C--N 1.338 0.658 0 CA-C-O 119.507 -0.607 . . . . 0.0 112.786 -174.237 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 26.6 pt-20 -81.8 -7.44 59.6 Favored 'General case' 0 CA--C 1.533 0.29 0 CA-C-N 118.264 1.032 . . . . 0.0 112.373 -178.832 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 17.5 m -140.61 0.02 0.51 Allowed 'Isoleucine or valine' 0 N--CA 1.463 0.213 0 N-CA-C 113.315 0.858 . . . . 0.0 113.315 176.9 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 105' ' ' ILE . . . . . . . . . . . . . 9.3 tp -60.3 -28.22 41.39 Favored 'Isoleucine or valine' 0 CA--C 1.527 0.074 0 CA-C-N 119.197 0.908 . . . . 0.0 111.953 -174.521 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 10.6 pt20 -67.15 -26.89 66.89 Favored 'General case' 0 N--CA 1.453 -0.291 0 CA-C-N 118.002 0.365 . . . . 0.0 110.319 179.261 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 59.8 mm-40 -75.51 -42.02 53.76 Favored 'General case' 0 N--CA 1.456 -0.168 0 N-CA-C 110.117 -0.327 . . . . 0.0 110.117 179.897 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -72.53 -35.26 68.03 Favored 'General case' 0 N--CA 1.454 -0.265 0 N-CA-C 109.637 -0.505 . . . . 0.0 109.637 179.708 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 68.2 mt -67.01 -53.26 32.97 Favored 'General case' 0 N--CA 1.454 -0.273 0 N-CA-C 109.974 -0.38 . . . . 0.0 109.974 176.137 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 35.9 t -53.32 -42.64 66.9 Favored 'General case' 0 C--O 1.232 0.138 0 C-N-CA 122.533 0.333 . . . . 0.0 111.86 -177.247 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 47.4 t0 -66.0 -43.11 88.68 Favored 'General case' 0 N--CA 1.451 -0.378 0 N-CA-C 109.439 -0.578 . . . . 0.0 109.439 177.113 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -67.27 -35.52 79.66 Favored 'General case' 0 N--CA 1.449 -0.504 0 CA-C-O 119.557 -0.258 . . . . 0.0 111.164 -176.387 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 113' ' ' ILE . . . . . . . . . . . . . 22.0 mm -68.55 -37.29 77.49 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.326 0 CA-C-N 118.682 0.673 . . . . 0.0 109.242 178.455 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -73.64 -38.58 64.95 Favored 'General case' 0 N--CA 1.45 -0.443 0 N-CA-C 112.094 0.405 . . . . 0.0 112.094 178.553 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 115' ' ' LYS . . . . . 0.401 ' N ' ' HZ2' ' A' ' 115' ' ' LYS . 0.0 OUTLIER -81.23 -38.68 26.55 Favored 'General case' 0 C--N 1.339 0.115 0 N-CA-C 113.075 0.769 . . . . 0.0 113.075 -175.754 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 116' ' ' SER . . . . . 0.499 ' HB2' ' CB ' ' A' ' 120' ' ' HIS . 52.5 p -81.49 158.41 24.52 Favored 'General case' 0 N--CA 1.454 -0.27 0 N-CA-C 113.314 0.857 . . . . 0.0 113.314 -169.473 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 38.9 t30 -78.92 167.92 20.44 Favored 'General case' 0 CA--C 1.531 0.224 0 C-N-CA 123.241 0.617 . . . . 0.0 110.481 -178.851 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 118' ' ' GLN . . . . . . . . . . . . . 27.8 mt-30 -56.33 -36.08 68.33 Favored 'General case' 0 CA--C 1.529 0.171 0 N-CA-C 113.054 0.761 . . . . 0.0 113.054 -171.608 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 13.3 p-10 -69.35 -37.65 77.75 Favored 'General case' 0 N--CA 1.456 -0.133 0 CA-C-O 121.176 0.512 . . . . 0.0 109.849 178.528 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 120' ' ' HIS . . . . . 0.499 ' CB ' ' HB2' ' A' ' 116' ' ' SER . 32.7 m170 -67.22 -41.14 86.22 Favored 'General case' 0 N--CA 1.45 -0.454 0 CA-C-N 115.843 -0.617 . . . . 0.0 110.112 176.63 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 50.4 mttm -58.46 -40.33 82.36 Favored 'General case' 0 C--N 1.342 0.263 0 N-CA-C 109.001 -0.741 . . . . 0.0 109.001 178.226 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 45.9 tp10 -69.91 -38.21 76.19 Favored 'General case' 0 N--CA 1.453 -0.292 0 C-N-CA 122.166 0.186 . . . . 0.0 111.202 -176.8 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 123' ' ' LYS . . . . . 0.515 ' HE3' HD11 ' A' ' 63' ' ' LEU . 50.3 mtmt -69.0 -28.21 66.39 Favored 'General case' 0 N--CA 1.453 -0.301 0 O-C-N 121.803 -0.561 . . . . 0.0 110.182 177.801 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 124' ' ' ILE . . . . . . . . . . . . . 61.5 mt -73.39 -37.68 51.65 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.297 0 N-CA-C 109.041 -0.725 . . . . 0.0 109.041 174.318 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 125' ' ' ARG . . . . . 0.462 HH11 ' HA ' ' A' ' 125' ' ' ARG . 5.7 mmm180 -60.53 -46.57 89.65 Favored 'General case' 0 N--CA 1.452 -0.331 0 CA-C-O 118.95 -0.547 . . . . 0.0 110.866 178.174 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 126' ' ' MET . . . . . . . . . . . . . 28.3 ptm -62.83 -35.75 80.95 Favored 'General case' 0 N--CA 1.452 -0.339 0 C-N-CA 118.593 -1.243 . . . . 0.0 108.736 178.12 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 2.8 mp -61.48 -35.64 78.22 Favored 'General case' 0 CA--C 1.534 0.335 0 CA-C-N 118.927 0.785 . . . . 0.0 112.033 178.59 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 128' ' ' LEU . . . . . 0.515 HD12 ' H ' ' A' ' 140' ' ' SER . 3.7 mm? -70.9 -41.76 70.83 Favored 'General case' 0 CA--C 1.527 0.092 0 CA-C-N 118.858 0.754 . . . . 0.0 109.718 178.46 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 19.4 m-20 -68.05 -30.64 69.9 Favored 'General case' 0 N--CA 1.453 -0.286 0 N-CA-C 109.704 -0.48 . . . . 0.0 109.704 179.119 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 130' ' ' ILE . . . . . 0.568 ' HA ' ' HD3' ' A' ' 133' ' ' ARG . 42.2 mt -64.24 -39.79 86.76 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.302 0 C-N-CA 122.745 0.418 . . . . 0.0 109.893 174.942 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 131' ' ' TRP . . . . . . . . . . . . . 47.4 m0 -69.8 -25.34 63.73 Favored 'General case' 0 N--CA 1.45 -0.455 0 C-N-CA 119.783 -0.767 . . . . 0.0 111.744 177.669 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 39.8 t0 -73.1 -45.78 55.13 Favored 'General case' 0 N--CA 1.454 -0.253 0 N-CA-C 110.129 -0.323 . . . . 0.0 110.129 174.855 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 133' ' ' ARG . . . . . 0.568 ' HD3' ' HA ' ' A' ' 130' ' ' ILE . 23.6 mtp85 -66.38 -38.01 86.56 Favored 'General case' 0 CA--C 1.522 -0.132 0 C-N-CA 123.353 0.661 . . . . 0.0 110.785 -178.772 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 33.6 t -75.48 -8.33 56.45 Favored 'General case' 0 N--CA 1.454 -0.246 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.697 -178.562 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 135' ' ' GLY . . . . . . . . . . . . . . . 79.02 14.54 81.84 Favored Glycine 0 CA--C 1.527 0.809 0 CA-C-O 119.549 -0.584 . . . . 0.0 113.525 175.489 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 136' ' ' LEU . . . . . . . . . . . . . 11.2 mp -71.76 -26.66 62.53 Favored 'General case' 0 CA--C 1.527 0.086 0 CA-C-N 118.493 1.147 . . . . 0.0 109.755 176.781 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 137' ' ' PHE . . . . . . . . . . . . . 20.8 m-85 54.94 12.26 0.58 Allowed 'General case' 0 CA--C 1.532 0.262 0 C-N-CA 124.815 1.246 . . . . 0.0 113.561 -179.59 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 138' ' ' GLN . . . . . . . . . . . . . 85.7 mm-40 -77.87 10.6 2.68 Favored 'General case' 0 CA--C 1.53 0.194 0 C-N-CA 122.693 0.397 . . . . 0.0 110.303 174.988 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 139' ' ' LYS . . . . . . . . . . . . . 61.2 pttt -65.42 158.65 26.14 Favored 'General case' 0 N--CA 1.452 -0.368 0 C-N-CA 123.889 0.876 . . . . 0.0 110.725 -179.34 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 140' ' ' SER . . . . . 0.515 ' H ' HD12 ' A' ' 128' ' ' LEU . 40.5 t -155.22 143.45 20.23 Favored 'General case' 0 N--CA 1.45 -0.465 0 N-CA-C 109.539 -0.541 . . . . 0.0 109.539 176.869 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 141' ' ' TYR . . . . . . . . . . . . . 70.3 m-85 -140.39 19.49 2.39 Favored 'General case' 0 N--CA 1.454 -0.272 0 C-N-CA 123.344 0.658 . . . . 0.0 110.229 -179.726 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 142' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -67.71 163.79 20.77 Favored 'General case' 0 N--CA 1.454 -0.226 0 C-N-CA 123.231 0.612 . . . . 0.0 109.41 178.335 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 17.9 p30 -63.21 -14.25 46.94 Favored 'General case' 0 N--CA 1.453 -0.276 0 N-CA-C 112.293 0.479 . . . . 0.0 112.293 -175.784 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . -67.85 -46.24 72.33 Favored 'General case' 0 N--CA 1.452 -0.344 0 N-CA-C 109.268 -0.641 . . . . 0.0 109.268 175.295 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 145' ' ' ILE . . . . . . . . . . . . . 39.8 mm -63.75 -35.93 74.78 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.212 0 C-N-CA 122.725 0.41 . . . . 0.0 110.291 177.182 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 146' ' ' ARG . . . . . . . . . . . . . 64.4 mtt180 -71.77 -23.33 61.57 Favored 'General case' 0 C--N 1.338 0.083 0 C-N-CA 122.272 0.229 . . . . 0.0 111.103 -178.162 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 147' ' ' SER . . . . . . . . . . . . . 84.3 p 46.82 51.33 12.62 Favored 'General case' 0 N--CA 1.457 -0.119 0 C-N-CA 123.766 0.826 . . . . 0.0 110.096 175.573 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 148' ' ' LYS . . . . . 0.626 ' HD3' ' H ' ' A' ' 148' ' ' LYS . 0.0 OUTLIER -46.88 -32.94 4.11 Favored 'General case' 0 CA--C 1.529 0.145 0 C-N-CA 124.88 1.272 . . . . 0.0 113.707 -172.62 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 149' ' ' CYS . . . . . . . . . . . . . 52.5 t -68.44 -57.15 6.29 Favored 'General case' 0 N--CA 1.453 -0.286 0 CA-C-N 119.062 0.846 . . . . 0.0 109.469 179.953 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 150' ' ' PHE . . . . . . . . . . . . . 45.0 m-85 -69.28 -15.62 63.39 Favored 'General case' 0 N--CA 1.453 -0.322 0 CA-C-N 116.634 -0.257 . . . . 0.0 111.304 -177.673 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 151' ' ' ALA . . . . . . . . . . . . . . . -74.85 -39.02 61.82 Favored 'General case' 0 N--CA 1.45 -0.444 0 N-CA-C 109.939 -0.393 . . . . 0.0 109.939 173.994 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 152' ' ' MET . . . . . . . . . . . . . 93.6 mtp -77.84 -21.79 50.92 Favored 'General case' 0 CA--C 1.528 0.123 0 C-N-CA 122.256 0.223 . . . . 0.0 111.585 177.11 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 153' ' ' ASP . . . . . . . . . . . . . 70.3 m-20 -72.47 -14.14 61.6 Favored 'General case' 0 CA--C 1.529 0.153 0 C-N-CA 122.628 0.371 . . . . 0.0 111.851 177.892 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 154' ' ' LEU . . . . . . . . . . . . . 88.9 mt -98.09 144.72 27.28 Favored 'General case' 0 N--CA 1.453 -0.292 0 C-N-CA 122.896 0.478 . . . . 0.0 110.016 177.335 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 155' ' ' GLU . . . . . . . . . . . . . 60.6 mt-10 -81.61 160.45 23.79 Favored 'General case' 0 N--CA 1.454 -0.266 0 CA-C-O 121.067 0.46 . . . . 0.0 111.079 179.741 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 156' ' ' HIS . . . . . . . . . . . . . 42.6 p-80 -78.39 39.27 0.32 Allowed 'General case' 0 CA--C 1.533 0.289 0 C-N-CA 124.417 1.087 . . . . 0.0 112.094 -177.594 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 157' ' ' HIS . . . . . . . . . . . . . 45.9 m170 -64.69 157.96 25.92 Favored 'General case' 0 CA--C 1.53 0.18 0 CA-C-O 120.938 0.399 . . . . 0.0 110.958 -179.754 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 158' ' ' HIS . . . . . . . . . . . . . 38.3 m80 -86.98 14.53 7.22 Favored 'General case' 0 CA--C 1.528 0.119 0 C-N-CA 123.337 0.655 . . . . 0.0 112.286 -179.97 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 159' ' ' HIS . . . . . . . . . . . . . 44.2 m80 . . . . . 0 C--O 1.251 1.137 0 CA-C-O 116.918 -1.515 . . . . 0.0 110.79 -175.83 . . . . . . . . 0 0 . 1 . 018 nuclear build full ' B' B 2052 ' ' ASP . . . . . 0.598 ' HA ' ' HB3' ' A' ' 27' ' ' SER . 15.1 m-20 . . . . . 0 N--CA 1.476 0.84 0 N-CA-C 111.881 0.326 . . . . 0.0 111.881 . . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B 2053 ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -69.71 18.16 0.05 OUTLIER 'General case' 0 CA--C 1.533 0.304 0 C-N-CA 124.306 1.042 . . . . 0.0 111.863 178.709 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B 2054 ' ' ASP . . . . . 0.488 ' H ' ' C ' ' B' 2052 ' ' ASP . 19.7 p30 -129.42 -0.74 5.02 Favored 'General case' 0 N--CA 1.451 -0.379 0 C-N-CA 125.314 1.446 . . . . 0.0 110.691 -179.079 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B 2055 ' ' GLU . . . . . . . . . . . . . 36.8 mt-10 -104.96 21.71 16.56 Favored 'General case' 0 CA--C 1.529 0.136 0 C-N-CA 122.679 0.392 . . . . 0.0 110.944 177.576 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B 2056 ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -59.94 152.36 23.79 Favored 'General case' 0 N--CA 1.456 -0.132 0 N-CA-C 109.625 -0.509 . . . . 0.0 109.625 177.178 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B 2057 ' ' ASP . . . . . . . . . . . . . 59.0 m-20 49.51 41.28 20.9 Favored 'General case' 0 CA--C 1.53 0.192 0 C-N-CA 122.635 0.374 . . . . 0.0 111.156 -172.715 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B 2058 ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -51.9 144.11 12.19 Favored 'General case' 0 CA--C 1.53 0.21 0 CA-C-N 117.581 0.173 . . . . 0.0 110.977 -176.639 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B 2059 ' ' THR . . . . . . . . . . . . . 64.8 p -81.93 122.27 79.82 Favored Pre-proline 0 CA--C 1.529 0.163 0 C-N-CA 122.14 0.176 . . . . 0.0 110.785 -178.312 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B 2060 ' ' PRO . . . . . . . . . . . . . 81.4 Cg_endo -71.2 -4.84 15.73 Favored 'Trans proline' 0 N--CA 1.455 -0.749 0 C-N-CA 124.08 3.187 . . . . 0.0 111.579 -178.971 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B 2061 ' ' SER . . . . . . . . . . . . . 19.3 m 60.64 -4.23 0.13 Allowed 'General case' 0 CA--C 1.53 0.19 0 C-N-CA 125.579 1.552 . . . . 0.0 114.525 177.168 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B 2062 ' ' ILE . . . . . 0.426 HG21 HG12 ' A' ' 130' ' ' ILE . 8.6 tt -82.02 -15.88 12.02 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.176 0 CA-C-N 118.568 0.622 . . . . 0.0 109.851 173.883 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B 2063 ' ' SER . . . . . . . . . . . . . 44.5 t . . . . . 0 C--O 1.251 1.135 0 CA-C-O 117.157 -1.402 . . . . 0.0 109.573 179.441 . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.6 tmt? . . . . . 0 N--CA 1.475 0.789 0 N-CA-C 110.124 -0.324 . . . . 0.0 110.124 . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 2.4 pm0 -65.44 -27.66 68.68 Favored 'General case' 0 N--CA 1.451 -0.375 0 N-CA-C 108.852 -0.796 . . . . 0.0 108.852 173.09 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 39.9 tp60 -157.79 141.9 15.98 Favored 'General case' 0 N--CA 1.452 -0.333 0 C-N-CA 124.146 0.978 . . . . 0.0 108.6 170.081 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -165.51 132.91 2.92 Favored 'General case' 0 N--CA 1.446 -0.625 0 N-CA-C 105.522 -2.029 . . . . 0.0 105.522 175.312 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 10.6 m-20 -77.74 7.99 5.06 Favored 'General case' 0 N--CA 1.457 -0.122 0 C-N-CA 120.291 -0.564 . . . . 0.0 112.115 -175.622 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 41.8 t0 -84.32 -19.7 33.29 Favored 'General case' 0 N--CA 1.45 -0.468 0 N-CA-C 107.873 -1.158 . . . . 0.0 107.873 172.302 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 7' ' ' PHE . . . . . 0.557 ' CD1' ' HD3' ' A' ' 45' ' ' LYS . 1.5 t80 -55.35 -35.3 65.08 Favored 'General case' 0 N--CA 1.451 -0.404 0 N-CA-C 108.525 -0.917 . . . . 0.0 108.525 175.996 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 51.8 tp60 -51.7 -34.0 36.79 Favored 'General case' 0 N--CA 1.452 -0.326 0 C-N-CA 124.937 1.295 . . . . 0.0 111.969 -178.778 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 79.9 m-20 -74.6 -36.14 62.98 Favored 'General case' 0 N--CA 1.453 -0.282 0 N-CA-C 109.906 -0.405 . . . . 0.0 109.906 -179.932 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 10' ' ' PHE . . . . . 0.486 ' CZ ' HG12 ' A' ' 46' ' ' ILE . 2.0 t80 -68.32 -36.43 79.28 Favored 'General case' 0 N--CA 1.449 -0.503 0 C-N-CA 123.086 0.554 . . . . 0.0 109.638 174.673 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 96.0 t -69.1 -52.79 30.24 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.234 0 N-CA-C 109.606 -0.516 . . . . 0.0 109.606 178.385 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -58.9 -28.47 66.21 Favored 'General case' 0 N--CA 1.454 -0.232 0 CA-C-N 117.747 0.248 . . . . 0.0 111.478 -179.154 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 86.7 m -72.64 -39.01 67.51 Favored 'General case' 0 N--CA 1.454 -0.242 0 N-CA-C 109.099 -0.704 . . . . 0.0 109.099 175.602 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -64.39 -43.26 95.02 Favored 'General case' 0 N--CA 1.451 -0.422 0 N-CA-C 109.018 -0.734 . . . . 0.0 109.018 177.773 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 67.6 mm-40 -65.42 -26.49 68.0 Favored 'General case' 0 N--CA 1.455 -0.22 0 C-N-CA 123.85 0.86 . . . . 0.0 110.011 178.425 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 68.1 m -70.53 -30.17 66.84 Favored 'General case' 0 N--CA 1.455 -0.183 0 N-CA-C 110.015 -0.365 . . . . 0.0 110.015 176.901 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 17' ' ' PHE . . . . . 0.536 ' CD1' HD11 ' A' ' 68' ' ' ILE . 35.9 m-85 -71.98 -32.8 67.6 Favored 'General case' 0 C--N 1.338 0.088 0 C-N-CA 119.943 -0.703 . . . . 0.0 110.76 172.41 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 72.9 mttt -66.76 -25.36 66.46 Favored 'General case' 0 CA--C 1.531 0.235 0 N-CA-C 110.037 -0.357 . . . . 0.0 110.037 174.541 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 42.6 t0 -76.56 -48.74 18.32 Favored 'General case' 0 CA--C 1.529 0.15 0 N-CA-C 110.306 -0.257 . . . . 0.0 110.306 175.439 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 16.2 mt -56.23 125.26 21.01 Favored 'General case' 0 N--CA 1.457 -0.098 0 CA-C-O 120.714 0.293 . . . . 0.0 110.467 -177.64 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 21' ' ' LYS . . . . . 0.487 ' HE2' ' H ' ' A' ' 21' ' ' LYS . 1.0 OUTLIER -70.74 -22.57 62.4 Favored 'General case' 0 N--CA 1.456 -0.138 0 N-CA-C 109.819 -0.437 . . . . 0.0 109.819 -179.84 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 61.8 m -90.69 -13.34 34.37 Favored 'General case' 0 N--CA 1.457 -0.09 0 C-N-CA 122.901 0.48 . . . . 0.0 111.059 176.299 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 70.55 -16.83 0.92 Allowed Glycine 0 CA--C 1.529 0.923 0 C-N-CA 124.135 0.874 . . . . 0.0 112.983 -179.677 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 93.6 mt -100.41 147.67 7.53 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.135 0 CA-C-N 117.773 0.786 . . . . 0.0 111.121 -179.961 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 24.3 t -161.12 104.68 1.31 Allowed 'General case' 0 CA--C 1.517 -0.294 0 N-CA-C 108.273 -1.01 . . . . 0.0 108.273 170.808 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -59.93 -28.47 66.12 Favored Glycine 0 CA--C 1.525 0.657 0 C-N-CA 119.914 -1.136 . . . . 0.0 110.829 -176.697 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 86.3 p -72.75 -49.34 31.53 Favored 'General case' 0 N--CA 1.453 -0.303 0 CA-C-N 117.854 0.827 . . . . 0.0 110.683 -179.634 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 40.5 mtt-85 -72.55 -37.35 68.27 Favored 'General case' 0 N--CA 1.453 -0.311 0 CA-C-N 117.577 0.171 . . . . 0.0 110.632 -178.534 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 63.0 mt -60.03 -46.24 94.47 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.668 0 N-CA-C 108.704 -0.85 . . . . 0.0 108.704 175.838 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 28.8 mtmm -64.89 -29.03 69.96 Favored 'General case' 0 C--N 1.338 0.091 0 CA-C-O 119.168 -0.444 . . . . 0.0 111.284 178.747 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 31' ' ' LYS . . . . . 0.472 ' CE ' ' HA ' ' A' ' 31' ' ' LYS . 3.5 mmpt? -66.2 -59.21 3.97 Favored 'General case' 0 N--CA 1.456 -0.155 0 CA-C-N 118.739 0.699 . . . . 0.0 111.454 -179.15 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.493 HD12 ' N ' ' A' ' 33' ' ' THR . 0.8 OUTLIER -75.33 -16.76 60.38 Favored 'General case' 0 CA--C 1.531 0.212 0 C-N-CA 118.747 -1.181 . . . . 0.0 111.568 -179.249 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 33' ' ' THR . . . . . 0.493 ' N ' HD12 ' A' ' 32' ' ' LEU . 40.5 m -71.04 -44.37 65.96 Favored 'General case' 0 N--CA 1.455 -0.194 0 N-CA-C 108.19 -1.041 . . . . 0.0 108.19 174.41 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 95.3 m -65.29 -42.74 92.79 Favored 'General case' 0 N--CA 1.453 -0.316 0 N-CA-C 109.601 -0.518 . . . . 0.0 109.601 -179.731 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 38.4 t80 -61.44 -34.31 75.2 Favored 'General case' 0 N--CA 1.453 -0.323 0 CA-C-O 120.731 0.3 . . . . 0.0 110.268 179.18 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -75.3 -25.51 57.96 Favored 'General case' 0 N--CA 1.45 -0.445 0 CA-C-O 119.378 -0.344 . . . . 0.0 111.767 177.977 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 2.2 mm? -82.93 -33.46 26.8 Favored 'General case' 0 N--CA 1.456 -0.149 0 N-CA-C 108.595 -0.891 . . . . 0.0 108.595 -178.127 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 82.7 m-20 -64.52 -28.42 69.64 Favored 'General case' 0 N--CA 1.444 -0.77 0 C-N-CA 123.595 0.758 . . . . 0.0 110.532 174.677 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 73.3 m80 -151.39 106.99 3.36 Favored 'General case' 0 N--CA 1.453 -0.286 0 C-N-CA 122.826 0.45 . . . . 0.0 111.902 -179.841 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 40' ' ' ILE . . . . . 0.62 ' H ' HD13 ' A' ' 40' ' ' ILE . 0.0 OUTLIER -78.61 -10.8 13.0 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.284 0 N-CA-C 109.593 -0.521 . . . . 0.0 109.593 172.699 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -54.85 -28.28 48.72 Favored 'General case' 0 N--CA 1.453 -0.301 0 C-N-CA 123.798 0.839 . . . . 0.0 111.75 -177.006 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -104.88 16.39 6.1 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.318 0 C-N-CA 123.47 0.708 . . . . 0.0 112.375 -179.94 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 3.1 pp20? -53.89 -31.44 49.93 Favored 'General case' 0 C--O 1.225 -0.235 0 O-C-N 121.51 -0.744 . . . . 0.0 110.375 179.66 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 37.6 t -59.42 -48.04 83.18 Favored 'General case' 0 CA--C 1.532 0.287 0 CA-C-O 119.703 -0.189 . . . . 0.0 111.32 -176.913 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 45' ' ' LYS . . . . . 0.557 ' HD3' ' CD1' ' A' ' 7' ' ' PHE . 18.7 ptpt -75.4 -25.48 57.62 Favored 'General case' 0 CA--C 1.531 0.23 0 CA-C-N 118.267 0.485 . . . . 0.0 110.49 179.541 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 46' ' ' ILE . . . . . 0.486 HG12 ' CZ ' ' A' ' 10' ' ' PHE . 94.5 mt -71.96 -46.45 59.88 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.254 0 N-CA-C 109.667 -0.494 . . . . 0.0 109.667 -179.339 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 39.6 mm -65.22 -34.0 67.52 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.531 0 N-CA-C 108.965 -0.754 . . . . 0.0 108.965 177.311 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 53.8 m -64.75 -35.1 79.96 Favored 'General case' 0 N--CA 1.453 -0.299 0 CA-C-O 119.649 -0.215 . . . . 0.0 111.117 178.068 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 16.1 mt -73.62 -40.58 63.7 Favored 'General case' 0 N--CA 1.452 -0.328 0 CA-C-O 118.753 -0.642 . . . . 0.0 112.528 179.516 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 9.0 pt -68.44 -40.25 81.94 Favored 'Isoleucine or valine' 0 C--N 1.339 0.124 0 CA-C-N 119.474 1.034 . . . . 0.0 111.051 -177.962 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 16.6 pt -68.99 -39.23 79.48 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.185 0 C-N-CA 120.136 -0.626 . . . . 0.0 110.709 179.333 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 50.7 t0 -64.81 -51.66 60.93 Favored 'General case' 0 N--CA 1.455 -0.194 0 N-CA-C 109.648 -0.501 . . . . 0.0 109.648 177.924 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 25.9 t80 -59.57 -53.29 59.81 Favored 'General case' 0 N--CA 1.45 -0.46 0 N-CA-C 109.543 -0.54 . . . . 0.0 109.543 -179.298 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 18.7 t -61.48 -29.53 70.03 Favored 'General case' 0 N--CA 1.452 -0.337 0 N-CA-C 111.974 0.361 . . . . 0.0 111.974 -174.344 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 5.1 tpm_? -75.5 -60.43 2.31 Favored 'General case' 0 CA--C 1.532 0.283 0 C-N-CA 122.5 0.32 . . . . 0.0 111.326 -179.5 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 56' ' ' LEU . . . . . 0.443 ' N ' HD12 ' A' ' 56' ' ' LEU . 9.1 mp -75.66 -28.66 58.82 Favored 'General case' 0 C--O 1.231 0.093 0 N-CA-C 114.14 1.163 . . . . 0.0 114.14 -174.966 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 57' ' ' CYS . . . . . 0.424 ' HB2' ' HD2' ' A' ' 58' ' ' PRO . 13.2 p -68.28 156.74 89.47 Favored Pre-proline 0 CA--C 1.536 0.428 0 N-CA-C 112.471 0.545 . . . . 0.0 112.471 -174.713 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 58' ' ' PRO . . . . . 0.424 ' HD2' ' HB2' ' A' ' 57' ' ' CYS . 94.0 Cg_endo -74.05 175.97 10.15 Favored 'Trans proline' 0 N--CA 1.454 -0.832 0 C-N-CA 125.046 3.83 . . . . 0.0 111.593 179.203 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 32.4 p-10 -52.66 -47.2 67.29 Favored 'General case' 0 CA--C 1.529 0.145 0 C-N-CA 124.533 1.133 . . . . 0.0 113.737 -170.847 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 40.2 t -65.23 -37.63 87.87 Favored 'General case' 0 N--CA 1.456 -0.145 0 CA-C-O 121.121 0.486 . . . . 0.0 110.462 -178.758 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 66.1 m170 -75.3 -26.36 58.64 Favored 'General case' 0 N--CA 1.452 -0.375 0 CA-C-N 116.521 -0.309 . . . . 0.0 110.232 179.836 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 62' ' ' LYS . . . . . 0.415 ' HE2' ' O ' ' A' ' 57' ' ' CYS . 68.7 mttm -65.93 -39.43 90.5 Favored 'General case' 0 C--N 1.342 0.249 0 N-CA-C 109.29 -0.633 . . . . 0.0 109.29 174.334 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -61.15 -48.38 81.86 Favored 'General case' 0 N--CA 1.454 -0.233 0 N-CA-C 108.313 -0.995 . . . . 0.0 108.313 176.541 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -63.99 -31.89 82.36 Favored Glycine 0 CA--C 1.524 0.642 0 N-CA-C 111.668 -0.573 . . . . 0.0 111.668 -179.21 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 37.4 p -65.85 -38.53 89.1 Favored 'General case' 0 N--CA 1.454 -0.271 0 CA-C-N 117.699 0.749 . . . . 0.0 109.887 179.011 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 82.3 mt -72.61 -25.54 61.35 Favored 'General case' 0 N--CA 1.451 -0.396 0 N-CA-C 110.026 -0.361 . . . . 0.0 110.026 178.914 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -72.45 -38.59 68.24 Favored 'General case' 0 N--CA 1.454 -0.268 0 N-CA-C 110.374 -0.232 . . . . 0.0 110.374 176.335 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 68' ' ' ILE . . . . . 0.536 HD11 ' CD1' ' A' ' 17' ' ' PHE . 18.2 mt -69.19 -46.82 77.06 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.237 0 N-CA-C 109.673 -0.491 . . . . 0.0 109.673 176.0 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 70.7 mt -56.55 -32.46 36.91 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.161 0 C-N-CA 123.031 0.532 . . . . 0.0 110.814 176.252 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 6.9 t70 -69.76 -50.08 46.83 Favored 'General case' 0 N--CA 1.452 -0.354 0 CA-C-O 119.383 -0.341 . . . . 0.0 111.132 179.38 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 99.2 p -67.5 -49.89 61.41 Favored 'General case' 0 N--CA 1.455 -0.219 0 C-N-CA 120.505 -0.478 . . . . 0.0 110.663 -175.757 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -74.89 -32.44 27.72 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.182 0 N-CA-C 109.931 -0.396 . . . . 0.0 109.931 -176.508 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -69.75 -58.53 6.27 Favored Glycine 0 C--N 1.336 0.566 0 N-CA-C 111.116 -0.794 . . . . 0.0 111.116 -176.975 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 28.7 mtp-105 -61.51 -40.95 96.46 Favored 'General case' 0 N--CA 1.45 -0.426 0 N-CA-C 109.808 -0.441 . . . . 0.0 109.808 -177.799 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -67.81 -28.23 67.41 Favored 'General case' 0 N--CA 1.451 -0.411 0 C-N-CA 120.771 -0.372 . . . . 0.0 111.331 179.993 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 1.3 m-30 -69.63 -46.23 66.68 Favored 'General case' 0 N--CA 1.455 -0.221 0 CA-C-N 118.648 0.658 . . . . 0.0 111.192 178.529 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 44.2 tp -73.51 -35.83 65.65 Favored 'General case' 0 N--CA 1.449 -0.477 0 C-N-CA 117.471 -1.691 . . . . 0.0 110.219 -179.995 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 89.0 m-20 -62.52 -46.22 89.39 Favored 'General case' 0 C--O 1.231 0.122 0 N-CA-C 112.393 0.516 . . . . 0.0 112.393 178.641 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 15.1 tm-20 -65.35 -47.75 75.39 Favored 'General case' 0 N--CA 1.444 -0.759 0 CA-C-N 118.017 0.371 . . . . 0.0 110.873 -179.026 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 76.7 p -68.23 -25.04 65.0 Favored 'General case' 0 N--CA 1.452 -0.328 0 CA-C-O 119.674 -0.203 . . . . 0.0 111.49 -179.172 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 35.4 ttp-105 -75.51 -34.05 60.79 Favored 'General case' 0 N--CA 1.457 -0.093 0 C-N-CA 122.711 0.404 . . . . 0.0 111.234 172.915 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 34.6 t -87.81 -7.6 57.06 Favored 'General case' 0 N--CA 1.456 -0.157 0 C-N-CA 123.839 0.856 . . . . 0.0 113.249 -177.876 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 40.5 t-20 -138.84 172.66 12.54 Favored 'General case' 0 N--CA 1.454 -0.253 0 C-N-CA 122.712 0.405 . . . . 0.0 110.989 -172.619 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 43.6 t -66.1 161.7 21.22 Favored 'General case' 0 N--CA 1.454 -0.263 0 C-N-CA 123.18 0.592 . . . . 0.0 110.393 179.082 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 44.1 m-20 -119.35 163.58 16.98 Favored 'General case' 0 N--CA 1.453 -0.276 0 N-CA-C 109.65 -0.5 . . . . 0.0 109.65 179.9 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 60.0 p -76.36 37.99 0.17 Allowed 'General case' 0 CA--C 1.528 0.119 0 C-N-CA 123.625 0.77 . . . . 0.0 112.312 -176.731 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 21.5 t 55.08 -157.48 0.22 Allowed 'General case' 0 CA--C 1.534 0.362 0 C-N-CA 123.121 0.568 . . . . 0.0 111.024 -177.559 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 80.8 p -64.67 101.35 0.46 Allowed 'General case' 0 N--CA 1.455 -0.186 0 C-N-CA 122.961 0.504 . . . . 0.0 109.794 -179.595 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 29.6 t30 -161.09 170.1 21.11 Favored 'General case' 0 N--CA 1.453 -0.293 0 C-N-CA 123.721 0.808 . . . . 0.0 108.917 -177.349 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 90' ' ' LYS . . . . . 0.427 ' H ' ' HD2' ' A' ' 91' ' ' PRO . 31.9 mmmt -129.09 -67.19 0.02 OUTLIER Pre-proline 0 CA--C 1.532 0.25 0 CA-C-O 118.141 -0.933 . . . . 0.0 111.062 177.848 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 91' ' ' PRO . . . . . 0.427 ' HD2' ' H ' ' A' ' 90' ' ' LYS . 71.6 Cg_endo -69.53 150.22 69.32 Favored 'Trans proline' 0 N--CA 1.455 -0.787 0 C-N-CA 121.949 1.766 . . . . 0.0 110.246 -178.861 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 84.9 19.13 60.02 Favored Glycine 0 CA--C 1.523 0.567 0 CA-C-O 119.483 -0.62 . . . . 0.0 112.344 179.303 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 25.1 p -153.76 172.82 16.71 Favored 'General case' 0 N--CA 1.455 -0.195 0 C-N-CA 123.533 0.733 . . . . 0.0 110.716 178.702 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 94' ' ' CYS . . . . . 0.426 ' HB2' HD13 ' A' ' 98' ' ' ILE . 30.6 p -59.93 -21.73 61.51 Favored 'General case' 0 N--CA 1.449 -0.522 0 CA-C-N 115.467 -0.788 . . . . 0.0 110.234 175.064 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -60.22 -56.8 17.14 Favored 'General case' 0 N--CA 1.447 -0.578 0 N-CA-C 109.722 -0.473 . . . . 0.0 109.722 -176.088 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 73.7 t60 -75.17 -37.12 61.4 Favored 'General case' 0 N--CA 1.45 -0.435 0 O-C-N 122.924 0.14 . . . . 0.0 111.014 179.191 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -62.58 -50.83 69.75 Favored 'General case' 0 N--CA 1.451 -0.379 0 N-CA-C 111.821 0.304 . . . . 0.0 111.821 -177.585 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 98' ' ' ILE . . . . . 0.426 HD13 ' HB2' ' A' ' 94' ' ' CYS . 1.8 mp -73.03 -33.14 41.98 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.165 0 CA-C-N 118.233 0.469 . . . . 0.0 110.068 -179.164 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 2.1 m120 -65.0 -40.65 95.26 Favored 'General case' 0 N--CA 1.452 -0.326 0 CA-C-N 118.547 0.612 . . . . 0.0 111.465 177.129 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 96.7 m -67.2 -42.7 83.71 Favored 'General case' 0 N--CA 1.452 -0.339 0 CA-C-O 120.514 0.197 . . . . 0.0 110.532 -178.011 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 75.7 mt -74.3 -28.49 61.2 Favored 'General case' 0 N--CA 1.45 -0.439 0 C-N-CA 120.805 -0.358 . . . . 0.0 110.871 179.997 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -59.19 -25.11 59.6 Favored Glycine 0 CA--C 1.527 0.803 0 N-CA-C 111.683 -0.567 . . . . 0.0 111.683 -177.868 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 17.4 mm-40 -84.49 -41.74 16.27 Favored 'General case' 0 N--CA 1.454 -0.272 0 CA-C-N 117.965 0.882 . . . . 0.0 112.309 179.588 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 16.5 m -104.5 -4.17 9.63 Favored 'Isoleucine or valine' 0 N--CA 1.461 0.095 0 N-CA-C 114.164 1.172 . . . . 0.0 114.164 -171.501 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 105' ' ' ILE . . . . . 0.414 HD12 ' HA ' ' A' ' 105' ' ' ILE . 11.1 tp -63.69 -33.42 61.63 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.244 0 CA-C-N 119.463 1.029 . . . . 0.0 110.913 -177.421 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 23.8 pt20 -67.15 -30.22 70.15 Favored 'General case' 0 CA--C 1.531 0.237 0 C-N-CA 122.948 0.499 . . . . 0.0 110.03 178.523 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 5.8 mm-40 -74.12 -46.67 41.22 Favored 'General case' 0 N--CA 1.454 -0.245 0 C-N-CA 123.135 0.574 . . . . 0.0 110.425 177.708 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 81.6 mt -68.66 -33.58 74.24 Favored 'General case' 0 N--CA 1.455 -0.217 0 N-CA-C 110.045 -0.354 . . . . 0.0 110.045 -178.77 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 36.4 mt -65.25 -62.13 1.72 Allowed 'General case' 0 N--CA 1.449 -0.49 0 N-CA-C 109.332 -0.618 . . . . 0.0 109.332 175.171 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 25.7 t -58.13 -35.55 71.65 Favored 'General case' 0 C--N 1.338 0.107 0 N-CA-C 112.005 0.372 . . . . 0.0 112.005 -173.463 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 62.1 t0 -61.85 -44.02 97.66 Favored 'General case' 0 N--CA 1.45 -0.47 0 N-CA-C 108.979 -0.748 . . . . 0.0 108.979 176.643 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -71.47 -37.67 71.3 Favored 'General case' 0 N--CA 1.446 -0.646 0 CA-C-N 116.434 -0.348 . . . . 0.0 110.802 -178.861 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 113' ' ' ILE . . . . . 0.474 ' O ' ' HE3' ' A' ' 121' ' ' LYS . 32.9 mm -61.25 -43.59 96.78 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.259 0 N-CA-C 109.356 -0.609 . . . . 0.0 109.356 -179.403 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -74.56 -38.83 62.6 Favored 'General case' 0 N--CA 1.451 -0.422 0 N-CA-C 112.039 0.385 . . . . 0.0 112.039 -176.701 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -77.42 -34.44 54.7 Favored 'General case' 0 C--N 1.338 0.099 0 N-CA-C 112.106 0.41 . . . . 0.0 112.106 -177.585 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 116' ' ' SER . . . . . 0.513 ' HB2' ' CB ' ' A' ' 120' ' ' HIS . 29.3 p -87.72 157.55 19.03 Favored 'General case' 0 N--CA 1.454 -0.257 0 N-CA-C 113.084 0.772 . . . . 0.0 113.084 -169.43 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 53.2 t30 -75.48 167.8 21.22 Favored 'General case' 0 C--O 1.224 -0.268 0 C-N-CA 123.874 0.869 . . . . 0.0 111.052 -178.293 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 118' ' ' GLN . . . . . . . . . . . . . 19.6 mm100 -57.6 -32.51 67.26 Favored 'General case' 0 CA--C 1.527 0.085 0 C-N-CA 123.17 0.588 . . . . 0.0 111.405 -176.062 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 36.6 t0 -65.51 -45.37 83.81 Favored 'General case' 0 N--CA 1.454 -0.24 0 CA-C-O 121.701 0.762 . . . . 0.0 108.967 175.639 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 120' ' ' HIS . . . . . 0.513 ' CB ' ' HB2' ' A' ' 116' ' ' SER . 33.5 m170 -68.14 -37.31 80.92 Favored 'General case' 0 N--CA 1.449 -0.477 0 N-CA-C 109.731 -0.47 . . . . 0.0 109.731 179.852 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 121' ' ' LYS . . . . . 0.474 ' HE3' ' O ' ' A' ' 113' ' ' ILE . 61.6 mttp -60.21 -36.96 78.86 Favored 'General case' 0 CA--C 1.521 -0.17 0 N-CA-C 108.675 -0.861 . . . . 0.0 108.675 176.394 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 28.1 tt0 -65.43 -44.41 87.43 Favored 'General case' 0 N--CA 1.452 -0.359 0 C-N-CA 122.379 0.272 . . . . 0.0 110.791 -178.03 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 14.4 mptt -67.34 -36.4 81.33 Favored 'General case' 0 C--O 1.226 -0.149 0 C-N-CA 120.63 -0.428 . . . . 0.0 110.115 -179.209 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 124' ' ' ILE . . . . . . . . . . . . . 54.4 mt -68.67 -32.88 56.86 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.329 0 N-CA-C 109.07 -0.715 . . . . 0.0 109.07 176.474 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 125' ' ' ARG . . . . . 0.474 ' HD2' ' HA ' ' A' ' 125' ' ' ARG . 17.4 tpt85 -69.64 -35.49 75.26 Favored 'General case' 0 N--CA 1.447 -0.599 0 CA-C-O 119.214 -0.422 . . . . 0.0 111.889 -174.806 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 126' ' ' MET . . . . . . . . . . . . . 26.8 ptm -73.88 -38.69 64.32 Favored 'General case' 0 N--CA 1.453 -0.284 0 N-CA-C 109.19 -0.67 . . . . 0.0 109.19 175.656 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 6.4 mp -61.26 -36.33 79.7 Favored 'General case' 0 CA--C 1.53 0.175 0 N-CA-C 109.434 -0.58 . . . . 0.0 109.434 174.811 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 43.6 tp -65.73 -44.33 86.33 Favored 'General case' 0 N--CA 1.454 -0.273 0 O-C-N 122.108 -0.37 . . . . 0.0 110.941 -179.128 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 89.2 m-20 -68.0 -36.4 79.93 Favored 'General case' 0 N--CA 1.456 -0.158 0 N-CA-C 110.366 -0.235 . . . . 0.0 110.366 176.245 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 54.4 mt -63.13 -38.4 81.96 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.436 0 N-CA-C 109.316 -0.624 . . . . 0.0 109.316 177.733 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 131' ' ' TRP . . . . . . . . . . . . . 41.0 m0 -75.49 -30.77 59.97 Favored 'General case' 0 N--CA 1.454 -0.269 0 CA-C-O 119.481 -0.295 . . . . 0.0 111.481 179.403 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 51.5 t0 -65.12 -36.18 83.47 Favored 'General case' 0 N--CA 1.452 -0.351 0 N-CA-C 109.377 -0.601 . . . . 0.0 109.377 178.393 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 133' ' ' ARG . . . . . 0.472 HH21 ' C ' ' B' 2063 ' ' SER . 9.5 mtp180 -75.26 -34.62 61.4 Favored 'General case' 0 C--N 1.34 0.165 0 C-N-CA 124.028 0.931 . . . . 0.0 110.696 175.525 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 30.1 m -75.44 -25.89 57.86 Favored 'General case' 0 C--N 1.339 0.15 0 N-CA-C 111.702 0.26 . . . . 0.0 111.702 -178.044 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 135' ' ' GLY . . . . . . . . . . . . . . . 78.34 4.58 87.06 Favored Glycine 0 CA--C 1.53 1.029 0 CA-C-O 118.935 -0.925 . . . . 0.0 114.251 176.536 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 136' ' ' LEU . . . . . . . . . . . . . 7.7 mp -68.33 -20.78 64.76 Favored 'General case' 0 C--N 1.337 0.062 0 CA-C-N 119.059 1.429 . . . . 0.0 111.357 179.682 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 137' ' ' PHE . . . . . . . . . . . . . 34.3 m-85 -143.68 179.92 6.84 Favored 'General case' 0 N--CA 1.457 -0.11 0 CA-C-O 121.048 0.452 . . . . 0.0 111.291 -171.714 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 138' ' ' GLN . . . . . . . . . . . . . 28.1 mp0 -62.35 166.85 4.63 Favored 'General case' 0 N--CA 1.452 -0.343 0 C-N-CA 123.706 0.802 . . . . 0.0 111.392 -179.393 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 139' ' ' LYS . . . . . 0.537 ' HE2' ' HA ' ' A' ' 139' ' ' LYS . 10.6 mmpt? -66.25 154.73 39.11 Favored 'General case' 0 N--CA 1.455 -0.175 0 C-N-CA 123.233 0.613 . . . . 0.0 111.125 -177.263 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 140' ' ' SER . . . . . . . . . . . . . 63.9 p -70.38 20.55 0.04 OUTLIER 'General case' 0 CA--C 1.531 0.234 0 C-N-CA 125.135 1.374 . . . . 0.0 113.955 -174.826 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 141' ' ' TYR . . . . . . . . . . . . . 31.8 p90 -146.59 18.76 1.32 Allowed 'General case' 0 N--CA 1.455 -0.19 0 CA-C-N 118.708 0.685 . . . . 0.0 112.275 -177.137 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 142' ' ' LEU . . . . . 0.55 ' HG ' ' H ' ' A' ' 144' ' ' ALA . 61.4 tp -66.67 145.25 55.77 Favored 'General case' 0 N--CA 1.455 -0.22 0 CA-C-N 117.972 0.351 . . . . 0.0 110.465 -179.616 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 76.5 m-20 -63.83 -18.78 64.47 Favored 'General case' 0 N--CA 1.457 -0.098 0 N-CA-C 112.484 0.549 . . . . 0.0 112.484 -177.532 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 144' ' ' ALA . . . . . 0.55 ' H ' ' HG ' ' A' ' 142' ' ' LEU . . . -73.25 -23.16 60.3 Favored 'General case' 0 N--CA 1.45 -0.444 0 N-CA-C 112.184 0.438 . . . . 0.0 112.184 -177.759 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 145' ' ' ILE . . . . . . . . . . . . . 25.7 mm -75.1 -32.4 26.62 Favored 'Isoleucine or valine' 0 CA--C 1.524 -0.038 0 N-CA-C 109.917 -0.401 . . . . 0.0 109.917 -177.78 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 146' ' ' ARG . . . . . . . . . . . . . 14.4 ptt-85 -85.13 -61.44 1.77 Allowed 'General case' 0 N--CA 1.453 -0.279 0 N-CA-C 109.206 -0.665 . . . . 0.0 109.206 172.695 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 147' ' ' SER . . . . . . . . . . . . . 28.8 t 43.07 23.01 0.03 OUTLIER 'General case' 0 CA--C 1.533 0.301 0 C-N-CA 125.661 1.584 . . . . 0.0 114.895 176.078 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 37.5 mtmt 48.38 26.72 1.19 Allowed 'General case' 0 CA--C 1.535 0.401 0 CA-C-N 118.373 0.533 . . . . 0.0 112.063 -175.13 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 149' ' ' CYS . . . . . . . . . . . . . 42.6 t -59.12 -23.91 62.53 Favored 'General case' 0 N--CA 1.454 -0.238 0 O-C-N 122.039 -0.413 . . . . 0.0 111.578 -175.326 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 150' ' ' PHE . . . . . . . . . . . . . 91.4 t80 -67.17 -31.02 71.15 Favored 'General case' 0 N--CA 1.454 -0.258 0 O-C-N 121.867 -0.521 . . . . 0.0 110.304 177.244 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 151' ' ' ALA . . . . . . . . . . . . . . . -78.81 -26.32 44.28 Favored 'General case' 0 N--CA 1.452 -0.349 0 N-CA-C 109.988 -0.375 . . . . 0.0 109.988 175.56 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 152' ' ' MET . . . . . . . . . . . . . 86.6 mtp -75.41 -23.32 57.01 Favored 'General case' 0 CA--C 1.529 0.17 0 CA-C-O 119.61 -0.233 . . . . 0.0 111.591 176.466 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 153' ' ' ASP . . . . . . . . . . . . . 93.2 m-20 -74.81 -14.25 60.67 Favored 'General case' 0 N--CA 1.457 -0.119 0 N-CA-C 112.812 0.671 . . . . 0.0 112.812 179.53 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 154' ' ' LEU . . . . . . . . . . . . . 4.6 pp -119.42 156.25 30.51 Favored 'General case' 0 N--CA 1.451 -0.398 0 CA-C-O 121.224 0.535 . . . . 0.0 111.456 -178.67 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 155' ' ' GLU . . . . . . . . . . . . . 78.7 mm-40 -73.83 165.01 25.88 Favored 'General case' 0 CA--C 1.527 0.086 0 C-N-CA 123.461 0.704 . . . . 0.0 112.849 -174.965 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 156' ' ' HIS . . . . . . . . . . . . . 80.0 m-70 60.82 13.11 4.19 Favored 'General case' 0 CA--C 1.529 0.138 0 N-CA-C 114.641 1.349 . . . . 0.0 114.641 177.63 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 157' ' ' HIS . . . . . . . . . . . . . 96.8 m-70 -146.38 168.0 22.2 Favored 'General case' 0 N--CA 1.456 -0.16 0 C-N-CA 123.123 0.569 . . . . 0.0 110.46 178.541 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 158' ' ' HIS . . . . . . . . . . . . . 48.9 p-80 -157.97 177.18 11.62 Favored 'General case' 0 N--CA 1.453 -0.303 0 C-N-CA 123.505 0.722 . . . . 0.0 109.1 -178.314 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 159' ' ' HIS . . . . . . . . . . . . . 31.9 p-80 . . . . . 0 C--O 1.247 0.942 0 CA-C-O 117.78 -1.105 . . . . 0.0 110.873 179.441 . . . . . . . . 0 0 . 1 . 019 nuclear build full ' B' B 2052 ' ' ASP . . . . . . . . . . . . . 2.9 m-20 . . . . . 0 N--CA 1.471 0.598 0 N-CA-C 110.854 -0.054 . . . . 0.0 110.854 . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' B' B 2053 ' ' ASP . . . . . . . . . . . . . 9.1 m-20 -119.48 169.35 10.12 Favored 'General case' 0 N--CA 1.456 -0.155 0 C-N-CA 123.832 0.853 . . . . 0.0 109.852 -177.741 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B 2054 ' ' ASP . . . . . . . . . . . . . 19.8 p-10 -99.14 -20.28 16.73 Favored 'General case' 0 N--CA 1.454 -0.268 0 C-N-CA 122.484 0.314 . . . . 0.0 111.408 178.633 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B 2055 ' ' GLU . . . . . . . . . . . . . 83.4 tt0 -79.45 78.4 5.98 Favored 'General case' 0 N--CA 1.454 -0.246 0 N-CA-C 109.221 -0.659 . . . . 0.0 109.221 175.758 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B 2056 ' ' ASP . . . . . . . . . . . . . 49.2 p-10 -79.82 7.2 9.15 Favored 'General case' 0 CA--C 1.533 0.323 0 N-CA-C 112.942 0.719 . . . . 0.0 112.942 -174.92 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B 2057 ' ' ASP . . . . . . . . . . . . . 41.0 t0 -151.66 161.15 43.15 Favored 'General case' 0 N--CA 1.455 -0.218 0 C-N-CA 122.79 0.436 . . . . 0.0 109.828 178.645 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B 2058 ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -123.45 -5.67 8.21 Favored 'General case' 0 CA--C 1.531 0.237 0 N-CA-C 109.27 -0.641 . . . . 0.0 109.27 175.561 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B 2059 ' ' THR . . . . . . . . . . . . . 7.5 m 48.12 74.33 0.83 Allowed Pre-proline 0 C--N 1.341 0.23 0 C-N-CA 126.092 1.757 . . . . 0.0 112.982 171.928 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B 2060 ' ' PRO . . . . . . . . . . . . . 61.3 Cg_endo -67.99 158.08 58.97 Favored 'Trans proline' 0 N--CA 1.454 -0.823 0 C-N-CA 123.206 2.604 . . . . 0.0 110.289 177.34 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B 2061 ' ' SER . . . . . . . . . . . . . 46.5 t -151.34 157.48 42.53 Favored 'General case' 0 C--O 1.233 0.228 0 C-N-CA 123.054 0.542 . . . . 0.0 110.246 -179.349 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B 2062 ' ' ILE . . . . . 0.435 HD13 ' HB2' ' A' ' 133' ' ' ARG . 19.2 tt -167.07 157.56 1.07 Allowed 'Isoleucine or valine' 0 N--CA 1.454 -0.24 0 C-N-CA 123.173 0.589 . . . . 0.0 110.532 -177.757 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B 2063 ' ' SER . . . . . 0.472 ' C ' HH21 ' A' ' 133' ' ' ARG . 82.9 p . . . . . 0 C--O 1.249 1.059 0 CA-C-O 117.156 -1.402 . . . . 0.0 110.325 175.266 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 85.6 mtp . . . . . 0 N--CA 1.472 0.657 0 CA-C-O 119.374 -0.346 . . . . 0.0 111.526 . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 80.9 mt-30 -143.74 -3.76 0.88 Allowed 'General case' 0 CA--C 1.531 0.223 0 N-CA-C 112.546 0.573 . . . . 0.0 112.546 -177.816 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 17.8 pt20 -151.66 14.4 0.65 Allowed 'General case' 0 C--O 1.232 0.142 0 N-CA-C 107.928 -1.138 . . . . 0.0 107.928 178.134 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 1.3 p30 -161.58 172.57 16.13 Favored 'General case' 0 N--CA 1.446 -0.668 0 C-N-CA 125.368 1.467 . . . . 0.0 108.951 -167.511 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 4.2 m-20 57.33 18.05 4.1 Favored 'General case' 0 N--CA 1.456 -0.17 0 C-N-CA 124.254 1.022 . . . . 0.0 113.111 -177.518 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 24.9 p-10 -73.85 -34.1 64.37 Favored 'General case' 0 N--CA 1.455 -0.21 0 N-CA-C 109.429 -0.582 . . . . 0.0 109.429 -177.688 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 7' ' ' PHE . . . . . 0.513 ' CD1' ' HD3' ' A' ' 45' ' ' LYS . 1.5 t80 -58.07 -36.48 72.88 Favored 'General case' 0 N--CA 1.446 -0.672 0 C-N-CA 123.173 0.589 . . . . 0.0 111.403 -176.972 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 51.7 tp60 -57.92 -32.17 67.5 Favored 'General case' 0 N--CA 1.453 -0.312 0 C-N-CA 122.689 0.395 . . . . 0.0 111.473 -176.959 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 49.6 t30 -69.44 -33.97 73.74 Favored 'General case' 0 N--CA 1.454 -0.264 0 N-CA-C 109.663 -0.495 . . . . 0.0 109.663 177.826 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 10' ' ' PHE . . . . . 0.506 ' CE2' ' HB2' ' A' ' 32' ' ' LEU . 12.0 t80 -70.33 -40.89 73.87 Favored 'General case' 0 N--CA 1.45 -0.446 0 N-CA-C 109.479 -0.563 . . . . 0.0 109.479 177.427 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 91.3 t -63.0 -55.63 22.4 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.372 0 N-CA-C 108.394 -0.965 . . . . 0.0 108.394 179.544 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -57.79 -29.44 64.87 Favored 'General case' 0 N--CA 1.451 -0.384 0 C-N-CA 122.847 0.459 . . . . 0.0 112.072 179.737 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 95.2 m -72.33 -41.05 66.95 Favored 'General case' 0 CA--C 1.529 0.162 0 CA-C-N 118.864 0.756 . . . . 0.0 109.297 177.208 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.523 ' HA ' ' CD1' ' A' ' 17' ' ' PHE . 10.8 tp -65.84 -42.65 90.22 Favored 'General case' 0 N--CA 1.454 -0.244 0 CA-C-O 121.053 0.454 . . . . 0.0 109.847 178.743 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 77.3 mm-40 -63.65 -32.8 74.39 Favored 'General case' 0 N--CA 1.452 -0.364 0 C-N-CA 123.947 0.899 . . . . 0.0 109.488 177.02 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 70.7 m -69.36 -22.43 63.74 Favored 'General case' 0 N--CA 1.451 -0.421 0 CA-C-O 119.011 -0.518 . . . . 0.0 110.422 177.149 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 17' ' ' PHE . . . . . 0.523 ' CD1' ' HA ' ' A' ' 14' ' ' LEU . 17.0 m-85 -74.49 -38.14 62.95 Favored 'General case' 0 C--N 1.343 0.324 0 CA-C-N 118.572 0.624 . . . . 0.0 110.83 170.303 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 18' ' ' LYS . . . . . 0.436 ' HG2' ' CE1' ' A' ' 53' ' ' TYR . 61.5 mttt -63.72 -23.51 67.39 Favored 'General case' 0 C--N 1.34 0.194 0 CA-C-O 120.786 0.327 . . . . 0.0 110.443 178.924 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 32.0 t0 -75.74 -9.47 58.62 Favored 'General case' 0 CA--C 1.538 0.488 0 C-N-CA 123.397 0.679 . . . . 0.0 112.711 176.315 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 20' ' ' LEU . . . . . 0.486 ' CD1' ' HB2' ' A' ' 25' ' ' SER . 66.9 mt -88.87 171.65 9.76 Favored 'General case' 0 N--CA 1.455 -0.188 0 O-C-N 121.556 -0.715 . . . . 0.0 112.865 -176.443 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 2.1 mppt? -77.79 -25.77 49.21 Favored 'General case' 0 N--CA 1.453 -0.295 0 CA-C-N 115.661 -0.7 . . . . 0.0 110.694 178.725 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 9.4 t -147.58 9.51 0.92 Allowed 'General case' 0 CA--C 1.522 -0.105 0 N-CA-C 113.166 0.802 . . . . 0.0 113.166 -175.879 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 70.23 -13.94 1.37 Allowed Glycine 0 CA--C 1.528 0.856 0 C-N-CA 123.819 0.723 . . . . 0.0 113.234 176.374 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 83.8 mt -65.95 129.31 30.16 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.196 0 N-CA-C 107.282 -1.377 . . . . 0.0 107.282 175.546 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 25' ' ' SER . . . . . 0.486 ' HB2' ' CD1' ' A' ' 20' ' ' LEU . 3.0 t -159.61 73.56 0.57 Allowed 'General case' 0 CA--C 1.518 -0.261 0 N-CA-C 110.198 -0.297 . . . . 0.0 110.198 -171.357 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -44.6 -51.14 8.09 Favored Glycine 0 CA--C 1.527 0.789 0 CA-C-O 118.838 -0.979 . . . . 0.0 114.126 -170.305 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 27' ' ' SER . . . . . 0.432 ' HA ' ' HE3' ' A' ' 30' ' ' LYS . 37.1 p -70.34 -39.03 74.94 Favored 'General case' 0 N--CA 1.455 -0.184 0 CA-C-N 119.615 1.707 . . . . 0.0 111.072 -173.913 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 87.5 mtt180 -74.18 -39.83 62.94 Favored 'General case' 0 N--CA 1.454 -0.259 0 CA-C-N 117.812 0.278 . . . . 0.0 110.715 -179.36 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 61.7 mt -56.63 -46.09 82.67 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.634 0 N-CA-C 108.782 -0.822 . . . . 0.0 108.782 173.753 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 30' ' ' LYS . . . . . 0.432 ' HE3' ' HA ' ' A' ' 27' ' ' SER . 51.4 mtmt -66.75 -29.08 68.97 Favored 'General case' 0 C--N 1.34 0.168 0 CA-C-O 118.984 -0.532 . . . . 0.0 111.332 179.261 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 31' ' ' LYS . . . . . 0.468 ' CE ' ' HA ' ' A' ' 31' ' ' LYS . 3.3 mmpt? -66.13 -55.64 15.41 Favored 'General case' 0 N--CA 1.458 -0.073 0 CA-C-N 118.795 0.725 . . . . 0.0 111.014 -179.075 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.506 ' HB2' ' CE2' ' A' ' 10' ' ' PHE . 1.6 pp -76.12 -18.88 58.96 Favored 'General case' 0 CA--C 1.532 0.264 0 C-N-CA 119.427 -0.909 . . . . 0.0 111.702 -179.71 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 33' ' ' THR . . . . . 0.468 ' N ' HD12 ' A' ' 32' ' ' LEU . 33.2 m -71.13 -40.69 71.24 Favored 'General case' 0 N--CA 1.456 -0.156 0 N-CA-C 108.746 -0.835 . . . . 0.0 108.746 174.834 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 97.9 m -66.75 -41.2 88.17 Favored 'General case' 0 N--CA 1.45 -0.444 0 N-CA-C 109.776 -0.453 . . . . 0.0 109.776 179.388 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 22.1 t80 -60.62 -34.97 75.03 Favored 'General case' 0 C--O 1.226 -0.145 0 N-CA-C 109.938 -0.393 . . . . 0.0 109.938 177.337 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -73.46 -28.45 61.95 Favored 'General case' 0 N--CA 1.449 -0.49 0 CA-C-O 119.25 -0.405 . . . . 0.0 111.522 178.817 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 2.6 mm? -82.38 -34.26 28.43 Favored 'General case' 0 CA--C 1.52 -0.193 0 N-CA-C 109.259 -0.645 . . . . 0.0 109.259 -177.564 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 83.0 m-20 -64.93 -26.74 68.44 Favored 'General case' 0 N--CA 1.442 -0.85 0 C-N-CA 123.829 0.852 . . . . 0.0 110.675 174.463 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 75.7 m80 -151.59 105.64 3.17 Favored 'General case' 0 N--CA 1.452 -0.329 0 C-N-CA 122.985 0.514 . . . . 0.0 111.264 -177.959 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 40' ' ' ILE . . . . . 0.6 ' H ' HD13 ' A' ' 40' ' ' ILE . 0.0 OUTLIER -81.22 -14.59 12.59 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.378 0 C-N-CA 123.323 0.649 . . . . 0.0 110.7 175.481 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 94.5 m-20 -61.35 -11.65 10.89 Favored 'General case' 0 CA--C 1.528 0.103 0 N-CA-C 112.924 0.713 . . . . 0.0 112.924 -178.366 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -111.12 16.15 8.08 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.163 0 C-N-CA 123.23 0.612 . . . . 0.0 111.33 176.17 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 3.0 pp20? -52.77 -32.56 44.23 Favored 'General case' 0 CA--C 1.531 0.228 0 O-C-N 121.649 -0.657 . . . . 0.0 110.668 177.236 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 40.7 t -58.71 -48.35 81.43 Favored 'General case' 0 C--O 1.234 0.267 0 N-CA-C 112.519 0.562 . . . . 0.0 112.519 -179.362 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 45' ' ' LYS . . . . . 0.513 ' HD3' ' CD1' ' A' ' 7' ' ' PHE . 18.7 ptpt -72.33 -25.9 61.72 Favored 'General case' 0 CA--C 1.53 0.187 0 CA-C-N 118.35 0.523 . . . . 0.0 110.193 179.69 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 70.4 mt -72.39 -48.8 46.2 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.257 0 N-CA-C 109.969 -0.382 . . . . 0.0 109.969 -178.236 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 39.6 mm -64.34 -35.67 74.89 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.232 0 N-CA-C 109.296 -0.631 . . . . 0.0 109.296 178.766 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 49.0 m -63.73 -38.93 92.95 Favored 'General case' 0 N--CA 1.453 -0.289 0 CA-C-N 116.836 -0.166 . . . . 0.0 111.1 179.993 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 35.7 mt -76.25 -32.81 59.08 Favored 'General case' 0 N--CA 1.45 -0.467 0 N-CA-C 113.545 0.943 . . . . 0.0 113.545 -178.917 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 15.5 pt -69.81 -40.62 79.23 Favored 'Isoleucine or valine' 0 CA--C 1.523 -0.089 0 CA-C-N 119.647 1.112 . . . . 0.0 110.298 179.294 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 25.8 pt -69.05 -38.53 78.45 Favored 'Isoleucine or valine' 0 CA--C 1.527 0.095 0 C-N-CA 120.068 -0.653 . . . . 0.0 110.528 178.838 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 95.9 m-20 -70.26 -39.36 75.02 Favored 'General case' 0 N--CA 1.456 -0.172 0 CA-C-O 119.281 -0.39 . . . . 0.0 112.007 177.848 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 53' ' ' TYR . . . . . 0.436 ' CE1' ' HG2' ' A' ' 18' ' ' LYS . 13.9 t80 -65.55 -46.61 78.86 Favored 'General case' 0 N--CA 1.453 -0.3 0 N-CA-C 108.707 -0.849 . . . . 0.0 108.707 177.384 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 23.1 m -61.71 -31.9 72.08 Favored 'General case' 0 N--CA 1.455 -0.218 0 O-C-N 123.096 0.248 . . . . 0.0 110.869 -178.327 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 56.2 ttp85 -75.43 -53.34 8.85 Favored 'General case' 0 N--CA 1.451 -0.381 0 C-N-CA 123.494 0.718 . . . . 0.0 112.023 -177.181 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 38.0 mt -76.1 -41.53 50.05 Favored 'General case' 0 N--CA 1.456 -0.158 0 N-CA-C 113.025 0.75 . . . . 0.0 113.025 -173.666 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 8.5 p -64.76 157.1 76.32 Favored Pre-proline 0 CA--C 1.535 0.37 0 N-CA-C 112.842 0.682 . . . . 0.0 112.842 -172.717 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 93.7 Cg_endo -74.66 175.85 10.56 Favored 'Trans proline' 0 N--CA 1.457 -0.664 0 C-N-CA 124.777 3.652 . . . . 0.0 111.131 178.945 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 23.1 p-10 -51.65 -50.06 61.09 Favored 'General case' 0 N--CA 1.456 -0.159 0 C-N-CA 124.31 1.044 . . . . 0.0 113.606 -172.061 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 81.9 p -64.92 -35.71 82.04 Favored 'General case' 0 N--CA 1.452 -0.351 0 C-N-CA 120.066 -0.654 . . . . 0.0 110.148 -177.299 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 48.3 m170 -74.04 -24.77 59.59 Favored 'General case' 0 N--CA 1.455 -0.18 0 CA-C-O 119.033 -0.508 . . . . 0.0 110.263 178.499 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 64.8 mttm -65.96 -34.74 78.8 Favored 'General case' 0 C--N 1.339 0.144 0 CA-C-N 118.791 0.723 . . . . 0.0 109.484 173.984 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -63.65 -48.68 76.27 Favored 'General case' 0 CA--C 1.531 0.248 0 N-CA-C 108.339 -0.985 . . . . 0.0 108.339 174.385 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -66.45 -26.88 72.82 Favored Glycine 0 CA--C 1.525 0.717 0 N-CA-C 111.732 -0.547 . . . . 0.0 111.732 -178.979 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 48.9 m -68.3 -40.35 81.77 Favored 'General case' 0 N--CA 1.452 -0.369 0 CA-C-N 117.654 0.727 . . . . 0.0 109.226 177.297 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 78.0 mt -70.05 -23.84 63.16 Favored 'General case' 0 N--CA 1.449 -0.51 0 CA-C-N 116.633 -0.258 . . . . 0.0 110.502 178.417 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 2.3 m-85 -69.54 -40.77 76.66 Favored 'General case' 0 N--CA 1.456 -0.149 0 CA-C-N 117.703 0.229 . . . . 0.0 111.23 173.041 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 68' ' ' ILE . . . . . 0.519 HD11 ' CD1' ' A' ' 17' ' ' PHE . 8.3 mt -67.43 -43.96 87.2 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.236 0 N-CA-C 109.123 -0.695 . . . . 0.0 109.123 178.772 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 88.9 mt -60.22 -30.69 46.54 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.251 0 C-N-CA 122.717 0.407 . . . . 0.0 111.059 175.887 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 19.4 t70 -70.09 -45.03 67.84 Favored 'General case' 0 N--CA 1.454 -0.262 0 CA-C-N 118.276 0.489 . . . . 0.0 111.603 179.346 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 95.0 p -70.88 -50.08 39.03 Favored 'General case' 0 N--CA 1.45 -0.444 0 C-N-CA 120.857 -0.337 . . . . 0.0 110.381 -176.404 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -75.72 -35.25 30.49 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.218 0 N-CA-C 110.234 -0.284 . . . . 0.0 110.234 -178.108 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -65.32 -51.78 46.21 Favored Glycine 0 C--N 1.335 0.476 0 N-CA-C 111.461 -0.656 . . . . 0.0 111.461 -175.132 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 36.8 mtm105 -71.26 -42.97 68.1 Favored 'General case' 0 N--CA 1.452 -0.351 0 C-N-CA 120.218 -0.593 . . . . 0.0 110.253 179.674 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -60.54 -28.26 68.29 Favored 'General case' 0 N--CA 1.45 -0.443 0 C-N-CA 120.024 -0.67 . . . . 0.0 110.193 -178.692 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 1.8 m-30 -70.36 -55.31 9.43 Favored 'General case' 0 N--CA 1.453 -0.275 0 CA-C-N 118.242 0.473 . . . . 0.0 110.865 174.993 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 6.9 tt -65.94 -43.67 87.33 Favored 'General case' 0 N--CA 1.451 -0.423 0 C-N-CA 117.661 -1.616 . . . . 0.0 109.331 -175.955 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 56.5 m-20 -55.82 -51.45 67.45 Favored 'General case' 0 CA--C 1.528 0.116 0 C-N-CA 122.471 0.308 . . . . 0.0 111.438 -179.028 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 15.2 tm-20 -66.23 -46.1 78.35 Favored 'General case' 0 N--CA 1.446 -0.666 0 N-CA-C 111.618 0.229 . . . . 0.0 111.618 -178.246 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 80' ' ' THR . . . . . 0.418 ' HB ' ' HA ' ' A' ' 86' ' ' SER . 81.4 p -70.51 -21.51 62.74 Favored 'General case' 0 N--CA 1.451 -0.38 0 CA-C-O 119.711 -0.185 . . . . 0.0 111.341 -178.263 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -75.92 -33.21 59.86 Favored 'General case' 0 N--CA 1.453 -0.309 0 CA-C-N 117.858 0.299 . . . . 0.0 110.198 172.363 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 46.1 t -77.49 -23.47 50.31 Favored 'General case' 0 N--CA 1.457 -0.118 0 N-CA-C 112.68 0.622 . . . . 0.0 112.68 -178.945 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 72.4 m-20 -132.04 177.4 7.58 Favored 'General case' 0 CA--C 1.529 0.151 0 CA-C-O 120.986 0.422 . . . . 0.0 111.391 -172.35 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 25.0 m -68.71 -1.41 6.91 Favored 'General case' 0 CA--C 1.53 0.196 0 N-CA-C 112.718 0.636 . . . . 0.0 112.718 -179.19 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 77.0 m-20 -75.16 13.05 0.76 Allowed 'General case' 0 CA--C 1.534 0.361 0 C-N-CA 123.236 0.614 . . . . 0.0 112.123 -179.884 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 86' ' ' SER . . . . . 0.418 ' HA ' ' HB ' ' A' ' 80' ' ' THR . 98.8 p -62.62 -26.56 68.68 Favored 'General case' 0 CA--C 1.528 0.107 0 C-N-CA 123.427 0.691 . . . . 0.0 112.249 -177.496 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 47.1 t -163.47 161.82 24.39 Favored 'General case' 0 N--CA 1.454 -0.232 0 CA-C-N 118.339 0.518 . . . . 0.0 110.72 -179.787 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 87.7 p -157.84 159.49 36.72 Favored 'General case' 0 N--CA 1.449 -0.496 0 N-CA-C 109.062 -0.718 . . . . 0.0 109.062 177.515 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 5.6 m120 -74.77 21.66 0.11 Allowed 'General case' 0 CA--C 1.533 0.307 0 C-N-CA 123.416 0.686 . . . . 0.0 112.632 -178.186 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 22.3 pttm -155.83 164.87 19.86 Favored Pre-proline 0 N--CA 1.455 -0.225 0 CA-C-N 118.079 0.399 . . . . 0.0 110.417 -176.077 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 44.5 Cg_endo -63.56 118.37 5.3 Favored 'Trans proline' 0 N--CA 1.45 -1.031 0 N-CA-C 106.35 -2.212 . . . . 0.0 106.35 167.141 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 92' ' ' GLY . . . . . 0.408 ' HA2' ' O ' ' A' ' 40' ' ' ILE . . . 156.9 19.51 0.04 OUTLIER Glycine 0 CA--C 1.529 0.932 0 CA-C-O 118.896 -0.947 . . . . 0.0 114.019 -170.803 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 1.3 p -155.2 165.49 36.51 Favored 'General case' 0 C--O 1.231 0.129 0 CA-C-N 118.617 1.209 . . . . 0.0 109.607 179.46 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 94' ' ' CYS . . . . . 0.512 ' SG ' HD13 ' A' ' 98' ' ' ILE . 2.3 t -51.46 -28.91 14.48 Favored 'General case' 0 N--CA 1.454 -0.233 0 C-N-CA 123.462 0.705 . . . . 0.0 110.722 175.372 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -54.56 -62.54 1.59 Allowed 'General case' 0 N--CA 1.451 -0.403 0 CA-C-N 117.821 0.282 . . . . 0.0 110.357 -179.001 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 66.2 t60 -71.54 -32.6 68.33 Favored 'General case' 0 N--CA 1.451 -0.38 0 O-C-N 122.29 -0.256 . . . . 0.0 110.65 -177.585 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -68.39 -51.74 40.69 Favored 'General case' 0 N--CA 1.451 -0.398 0 N-CA-C 111.579 0.214 . . . . 0.0 111.579 -175.528 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 98' ' ' ILE . . . . . 0.512 HD13 ' SG ' ' A' ' 94' ' ' CYS . 1.7 mp -69.43 -34.86 64.2 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.234 0 CA-C-O 119.35 -0.357 . . . . 0.0 110.116 -178.231 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 29.5 m-80 -70.89 -40.0 72.49 Favored 'General case' 0 N--CA 1.456 -0.131 0 C-N-CA 119.995 -0.682 . . . . 0.0 112.018 178.896 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 85.3 m -74.2 -25.02 59.45 Favored 'General case' 0 N--CA 1.457 -0.104 0 CA-C-N 118.348 0.522 . . . . 0.0 111.178 -177.151 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 64.6 tp -87.57 -40.73 13.99 Favored 'General case' 0 N--CA 1.451 -0.409 0 O-C-N 122.256 -0.278 . . . . 0.0 110.506 177.582 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -69.86 -20.29 75.91 Favored Glycine 0 CA--C 1.527 0.84 0 CA-C-O 119.579 -0.567 . . . . 0.0 112.52 -175.592 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 22.9 pt-20 -79.35 -4.66 51.96 Favored 'General case' 0 N--CA 1.453 -0.295 0 CA-C-N 118.168 0.984 . . . . 0.0 111.595 179.285 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 21.9 m -139.89 3.93 0.57 Allowed 'Isoleucine or valine' 0 N--CA 1.464 0.259 0 N-CA-C 112.538 0.57 . . . . 0.0 112.538 176.834 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 105' ' ' ILE . . . . . . . . . . . . . 10.9 tp -64.43 -31.04 51.9 Favored 'Isoleucine or valine' 0 C--O 1.227 -0.104 0 CA-C-N 118.912 0.778 . . . . 0.0 111.118 -175.352 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 11.7 pt20 -67.8 -28.69 67.81 Favored 'General case' 0 N--CA 1.454 -0.23 0 O-C-N 122.017 -0.427 . . . . 0.0 110.107 179.453 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 61.6 mm-40 -75.68 -42.22 51.71 Favored 'General case' 0 N--CA 1.454 -0.243 0 N-CA-C 109.791 -0.448 . . . . 0.0 109.791 -179.35 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 88.7 mt -71.37 -34.59 70.58 Favored 'General case' 0 N--CA 1.454 -0.226 0 CA-C-N 116.67 -0.241 . . . . 0.0 110.793 -178.993 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 77.2 mt -67.04 -49.44 65.19 Favored 'General case' 0 N--CA 1.452 -0.329 0 N-CA-C 109.682 -0.488 . . . . 0.0 109.682 174.967 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 47.8 m -53.67 -39.8 65.41 Favored 'General case' 0 C--O 1.232 0.173 0 C-N-CA 122.528 0.331 . . . . 0.0 110.98 -179.575 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 29.4 t0 -67.18 -41.39 86.01 Favored 'General case' 0 N--CA 1.451 -0.421 0 CA-C-O 120.916 0.389 . . . . 0.0 110.199 177.715 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -70.87 -36.96 73.04 Favored 'General case' 0 N--CA 1.449 -0.51 0 CA-C-N 116.287 -0.415 . . . . 0.0 111.316 -176.324 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 113' ' ' ILE . . . . . 0.44 ' O ' ' HE3' ' A' ' 121' ' ' LYS . 18.3 mm -68.99 -40.98 81.59 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.185 0 N-CA-C 109.441 -0.577 . . . . 0.0 109.441 179.898 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -69.63 -27.64 65.23 Favored 'General case' 0 N--CA 1.453 -0.282 0 N-CA-C 112.048 0.388 . . . . 0.0 112.048 -179.903 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -90.09 -38.17 13.73 Favored 'General case' 0 CA--C 1.529 0.139 0 N-CA-C 112.434 0.531 . . . . 0.0 112.434 -179.472 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 116' ' ' SER . . . . . 0.446 ' HB3' ' CB ' ' A' ' 120' ' ' HIS . 2.7 m -86.51 154.33 21.18 Favored 'General case' 0 CA--C 1.528 0.125 0 N-CA-C 112.227 0.454 . . . . 0.0 112.227 -170.307 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 49.1 t30 -77.72 170.56 16.38 Favored 'General case' 0 CA--C 1.531 0.229 0 C-N-CA 123.117 0.567 . . . . 0.0 111.302 -175.954 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 118' ' ' GLN . . . . . . . . . . . . . 20.8 mm100 -57.84 -34.05 69.3 Favored 'General case' 0 N--CA 1.457 -0.079 0 C-N-CA 123.237 0.615 . . . . 0.0 112.239 -173.631 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 9.5 p30 -70.39 -40.7 73.78 Favored 'General case' 0 N--CA 1.453 -0.29 0 N-CA-C 109.377 -0.601 . . . . 0.0 109.377 176.935 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 120' ' ' HIS . . . . . 0.446 ' CB ' ' HB3' ' A' ' 116' ' ' SER . 29.0 m170 -64.41 -39.47 93.91 Favored 'General case' 0 N--CA 1.45 -0.445 0 N-CA-C 109.746 -0.464 . . . . 0.0 109.746 176.486 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 121' ' ' LYS . . . . . 0.44 ' HE3' ' O ' ' A' ' 113' ' ' ILE . 64.5 mttp -59.73 -36.39 76.5 Favored 'General case' 0 C--N 1.342 0.257 0 N-CA-C 109.725 -0.472 . . . . 0.0 109.725 176.841 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 26.8 tt0 -65.74 -43.74 88.07 Favored 'General case' 0 N--CA 1.452 -0.341 0 C-N-CA 122.625 0.37 . . . . 0.0 110.651 -178.765 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 14.3 mptt -68.28 -30.02 68.94 Favored 'General case' 0 N--CA 1.457 -0.118 0 C-N-CA 120.486 -0.486 . . . . 0.0 110.221 -179.481 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 124' ' ' ILE . . . . . . . . . . . . . 67.6 mt -73.13 -39.64 57.12 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.365 0 N-CA-C 109.385 -0.598 . . . . 0.0 109.385 177.862 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 125' ' ' ARG . . . . . 0.426 ' HD2' ' HA ' ' A' ' 125' ' ' ARG . 8.1 mmm180 -61.54 -43.72 98.34 Favored 'General case' 0 N--CA 1.451 -0.416 0 CA-C-O 118.544 -0.741 . . . . 0.0 111.593 179.051 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 126' ' ' MET . . . . . . . . . . . . . 28.2 ptm -64.68 -38.93 92.67 Favored 'General case' 0 N--CA 1.454 -0.274 0 C-N-CA 118.77 -1.172 . . . . 0.0 108.897 177.816 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 4.2 mp -61.81 -44.08 97.57 Favored 'General case' 0 N--CA 1.455 -0.223 0 CA-C-N 118.076 0.398 . . . . 0.0 111.09 178.216 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 83.9 mt -65.36 -32.66 74.42 Favored 'General case' 0 N--CA 1.456 -0.145 0 CA-C-N 118.506 0.593 . . . . 0.0 111.465 -177.832 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 45.5 m-20 -75.63 -35.51 60.45 Favored 'General case' 0 N--CA 1.453 -0.31 0 CA-C-N 118.329 0.513 . . . . 0.0 109.863 177.011 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 130' ' ' ILE . . . . . 0.441 ' HA ' ' HD3' ' A' ' 133' ' ' ARG . 66.9 mt -62.98 -33.3 59.84 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.25 0 N-CA-C 109.39 -0.596 . . . . 0.0 109.39 174.784 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 131' ' ' TRP . . . . . . . . . . . . . 43.0 m0 -71.31 -40.69 70.65 Favored 'General case' 0 N--CA 1.452 -0.339 0 N-CA-C 112.164 0.431 . . . . 0.0 112.164 179.129 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 25.5 m-20 -63.32 -31.83 73.08 Favored 'General case' 0 N--CA 1.455 -0.189 0 CA-C-N 118.516 0.598 . . . . 0.0 110.331 178.18 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 133' ' ' ARG . . . . . 0.498 ' HB2' HD13 ' B' 2062 ' ' ILE . 18.0 mtp180 -73.03 -29.17 62.8 Favored 'General case' 0 CA--C 1.529 0.137 0 C-N-CA 122.89 0.476 . . . . 0.0 111.126 178.232 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 15.2 t -74.17 -14.91 61.02 Favored 'General case' 0 CA--C 1.532 0.258 0 CA-C-N 117.855 0.298 . . . . 0.0 110.839 173.856 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 135' ' ' GLY . . . . . . . . . . . . . . . 93.37 8.63 61.06 Favored Glycine 0 CA--C 1.527 0.827 0 CA-C-O 119.554 -0.581 . . . . 0.0 112.257 179.768 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 136' ' ' LEU . . . . . . . . . . . . . 61.6 mt -64.95 162.3 16.8 Favored 'General case' 0 N--CA 1.454 -0.258 0 CA-C-N 117.74 0.77 . . . . 0.0 109.624 175.789 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 137' ' ' PHE . . . . . . . . . . . . . 12.1 m-30 -60.6 119.25 7.73 Favored 'General case' 0 N--CA 1.454 -0.237 0 N-CA-C 108.237 -1.023 . . . . 0.0 108.237 177.998 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 138' ' ' GLN . . . . . . . . . . . . . 27.9 mt-30 -70.47 152.01 44.49 Favored 'General case' 0 N--CA 1.451 -0.381 0 CA-C-O 120.935 0.398 . . . . 0.0 111.314 -174.865 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 139' ' ' LYS . . . . . 0.545 ' H ' ' CD ' ' A' ' 139' ' ' LYS . 0.0 OUTLIER -64.82 149.48 49.33 Favored 'General case' 0 N--CA 1.455 -0.224 0 N-CA-C 108.663 -0.865 . . . . 0.0 108.663 173.311 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 140' ' ' SER . . . . . 0.444 ' C ' ' H ' ' A' ' 142' ' ' LEU . 38.8 t -146.76 172.1 14.14 Favored 'General case' 0 N--CA 1.454 -0.26 0 C-N-CA 122.151 0.18 . . . . 0.0 111.076 -173.782 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 141' ' ' TYR . . . . . . . . . . . . . 44.0 m-85 62.68 -35.13 0.12 Allowed 'General case' 0 CA--C 1.53 0.184 0 C-N-CA 126.742 2.017 . . . . 0.0 113.33 -174.434 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 142' ' ' LEU . . . . . 0.444 ' H ' ' C ' ' A' ' 140' ' ' SER . 57.3 mt 59.41 -26.2 0.03 OUTLIER 'General case' 0 CA--C 1.533 0.299 0 C-N-CA 127.513 2.325 . . . . 0.0 114.709 177.627 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 21.4 t-20 -68.94 -35.76 77.15 Favored 'General case' 0 N--CA 1.454 -0.227 0 CA-C-N 119.149 0.886 . . . . 0.0 110.353 -179.718 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . -70.75 -51.25 28.38 Favored 'General case' 0 N--CA 1.45 -0.464 0 N-CA-C 109.199 -0.667 . . . . 0.0 109.199 177.258 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 145' ' ' ILE . . . . . . . . . . . . . 41.1 mm -57.16 -39.17 65.23 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.234 0 C-N-CA 122.917 0.487 . . . . 0.0 110.586 178.977 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 146' ' ' ARG . . . . . . . . . . . . . 52.1 tpt85 -73.43 -24.47 60.25 Favored 'General case' 0 N--CA 1.456 -0.152 0 O-C-N 122.171 -0.331 . . . . 0.0 110.462 177.92 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 147' ' ' SER . . . . . . . . . . . . . 32.4 t 48.98 63.55 2.08 Favored 'General case' 0 N--CA 1.455 -0.209 0 C-N-CA 123.557 0.743 . . . . 0.0 110.725 178.961 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -53.77 -14.67 0.99 Allowed 'General case' 0 CA--C 1.529 0.15 0 C-N-CA 123.643 0.777 . . . . 0.0 112.522 179.729 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 149' ' ' CYS . . . . . . . . . . . . . 48.7 t -62.87 -28.06 69.77 Favored 'General case' 0 N--CA 1.451 -0.41 0 N-CA-C 109.478 -0.564 . . . . 0.0 109.478 177.377 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 150' ' ' PHE . . . . . . . . . . . . . 53.4 t80 -62.67 -28.43 69.92 Favored 'General case' 0 N--CA 1.454 -0.257 0 N-CA-C 110.247 -0.279 . . . . 0.0 110.247 179.455 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 151' ' ' ALA . . . . . . . . . . . . . . . -83.08 -30.71 27.77 Favored 'General case' 0 N--CA 1.452 -0.33 0 C-N-CA 122.353 0.261 . . . . 0.0 110.311 175.449 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 152' ' ' MET . . . . . . . . . . . . . 90.3 mtp -74.21 -21.47 59.79 Favored 'General case' 0 C--N 1.337 0.059 0 C-N-CA 122.288 0.235 . . . . 0.0 111.246 177.765 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 153' ' ' ASP . . . . . . . . . . . . . 67.5 m-20 -74.47 -12.28 60.45 Favored 'General case' 0 CA--C 1.53 0.175 0 C-N-CA 123.532 0.733 . . . . 0.0 111.775 176.192 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 154' ' ' LEU . . . . . . . . . . . . . 78.9 mt -74.3 143.73 44.85 Favored 'General case' 0 N--CA 1.454 -0.237 0 O-C-N 122.196 -0.315 . . . . 0.0 110.899 -178.892 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 155' ' ' GLU . . . . . . . . . . . . . 23.0 pt-20 -156.01 169.62 24.04 Favored 'General case' 0 N--CA 1.454 -0.269 0 C-N-CA 123.277 0.631 . . . . 0.0 109.607 179.556 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 156' ' ' HIS . . . . . . . . . . . . . 86.2 t60 -70.06 154.18 42.26 Favored 'General case' 0 N--CA 1.456 -0.169 0 N-CA-C 110.167 -0.309 . . . . 0.0 110.167 178.428 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 157' ' ' HIS . . . . . . . . . . . . . 48.5 m170 -68.37 144.5 54.74 Favored 'General case' 0 N--CA 1.456 -0.153 0 CA-C-O 120.921 0.391 . . . . 0.0 110.986 -177.341 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 158' ' ' HIS . . . . . . . . . . . . . 26.0 p80 -153.28 2.7 0.29 Allowed 'General case' 0 CA--C 1.529 0.167 0 C-N-CA 123.159 0.584 . . . . 0.0 111.464 179.157 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 159' ' ' HIS . . . . . . . . . . . . . 21.9 t-160 . . . . . 0 C--O 1.249 1.058 0 CA-C-O 116.808 -1.568 . . . . 0.0 108.852 -178.036 . . . . . . . . 0 0 . 1 . 020 nuclear build full ' B' B 2052 ' ' ASP . . . . . . . . . . . . . 36.4 p-10 . . . . . 0 N--CA 1.473 0.677 0 N-CA-C 109.476 -0.565 . . . . 0.0 109.476 . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' B' B 2053 ' ' ASP . . . . . . . . . . . . . 45.5 m-20 -124.22 156.74 36.29 Favored 'General case' 0 CA--C 1.53 0.202 0 C-N-CA 123.622 0.769 . . . . 0.0 111.056 -178.412 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B 2054 ' ' ASP . . . . . 0.408 ' CG ' ' H ' ' B' 2055 ' ' GLU . 53.8 t0 -157.65 -164.03 1.47 Allowed 'General case' 0 CA--C 1.536 0.429 0 C-N-CA 125.05 1.34 . . . . 0.0 107.539 178.632 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B 2055 ' ' GLU . . . . . 0.411 ' C ' ' H ' ' B' 2057 ' ' ASP . 92.2 mt-10 -67.81 63.28 0.08 Allowed 'General case' 0 CA--C 1.533 0.315 0 C-N-CA 123.767 0.827 . . . . 0.0 109.61 169.592 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B 2056 ' ' ASP . . . . . . . . . . . . . 12.4 m-20 -67.69 25.65 0.02 OUTLIER 'General case' 0 CA--C 1.532 0.283 0 C-N-CA 124.854 1.261 . . . . 0.0 112.881 -178.617 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B 2057 ' ' ASP . . . . . 0.411 ' H ' ' C ' ' B' 2055 ' ' GLU . 38.2 t0 -136.74 29.72 2.87 Favored 'General case' 0 CA--C 1.531 0.237 0 C-N-CA 123.534 0.733 . . . . 0.0 110.776 -176.609 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B 2058 ' ' TYR . . . . . . . . . . . . . 8.4 t80 -50.31 132.51 24.43 Favored 'General case' 0 N--CA 1.456 -0.141 0 N-CA-C 109.524 -0.547 . . . . 0.0 109.524 177.415 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B 2059 ' ' THR . . . . . . . . . . . . . 58.5 m -140.93 109.39 6.47 Favored Pre-proline 0 N--CA 1.454 -0.256 0 N-CA-C 109.163 -0.68 . . . . 0.0 109.163 -177.272 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B 2060 ' ' PRO . . . . . . . . . . . . . 93.0 Cg_endo -76.96 167.69 24.73 Favored 'Trans proline' 0 N--CA 1.451 -0.999 0 C-N-CA 123.563 2.842 . . . . 0.0 111.194 179.982 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B 2061 ' ' SER . . . . . . . . . . . . . 91.2 p -151.62 149.61 29.34 Favored 'General case' 0 N--CA 1.453 -0.309 0 N-CA-C 108.875 -0.787 . . . . 0.0 108.875 176.807 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B 2062 ' ' ILE . . . . . 0.498 HD13 ' HB2' ' A' ' 133' ' ' ARG . 19.3 tt -165.79 160.96 0.88 Allowed 'Isoleucine or valine' 0 N--CA 1.454 -0.226 0 N-CA-C 109.922 -0.399 . . . . 0.0 109.922 -175.87 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B 2063 ' ' SER . . . . . 0.406 ' C ' HH21 ' A' ' 133' ' ' ARG . 87.9 p . . . . . 0 C--O 1.248 0.978 0 CA-C-O 116.892 -1.528 . . . . 0.0 109.95 175.317 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 30.6 p-10 . . . . . 0 N--CA 1.453 -0.289 0 N-CA-C 108.762 -0.829 . . . . 0.0 108.762 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 7' ' ' PHE . . . . . 0.515 ' CD1' ' HD3' ' A' ' 45' ' ' LYS . 1.2 t80 -53.0 -36.37 60.38 Favored 'General case' 0 N--CA 1.447 -0.594 0 C-N-CA 124.982 1.313 . . . . 0.0 110.833 -178.263 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 51.5 tp60 -51.89 -35.27 44.67 Favored 'General case' 0 N--CA 1.454 -0.246 0 C-N-CA 123.978 0.911 . . . . 0.0 112.063 -176.947 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 31.1 m-80 -73.74 -33.48 64.34 Favored 'General case' 0 N--CA 1.453 -0.308 0 N-CA-C 110.076 -0.342 . . . . 0.0 110.076 -179.106 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 10' ' ' PHE . . . . . 0.426 ' CZ ' HG12 ' A' ' 46' ' ' ILE . 2.2 t80 -72.24 -36.45 69.1 Favored 'General case' 0 N--CA 1.452 -0.362 0 N-CA-C 108.896 -0.779 . . . . 0.0 108.896 177.298 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 95.7 t -68.0 -54.64 20.96 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.251 0 N-CA-C 108.81 -0.811 . . . . 0.0 108.81 178.157 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -58.67 -28.87 66.14 Favored 'General case' 0 N--CA 1.452 -0.329 0 N-CA-C 112.196 0.443 . . . . 0.0 112.196 -178.961 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 96.1 m -72.29 -41.99 66.02 Favored 'General case' 0 CA--C 1.532 0.268 0 N-CA-C 109.445 -0.576 . . . . 0.0 109.445 176.188 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.487 ' HA ' ' CD1' ' A' ' 17' ' ' PHE . 12.6 tp -62.98 -44.82 94.99 Favored 'General case' 0 N--CA 1.452 -0.329 0 N-CA-C 109.811 -0.44 . . . . 0.0 109.811 178.035 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 76.0 mm-40 -62.37 -32.1 72.84 Favored 'General case' 0 N--CA 1.45 -0.431 0 C-N-CA 124.588 1.155 . . . . 0.0 109.969 178.446 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 70.2 m -67.03 -29.58 69.43 Favored 'General case' 0 N--CA 1.453 -0.276 0 N-CA-C 109.726 -0.472 . . . . 0.0 109.726 177.473 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 17' ' ' PHE . . . . . 0.487 ' CD1' ' HA ' ' A' ' 14' ' ' LEU . 14.0 m-85 -69.11 -42.31 76.25 Favored 'General case' 0 N--CA 1.457 -0.109 0 C-N-CA 120.126 -0.629 . . . . 0.0 110.492 172.31 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 71.3 mttt -61.16 -27.6 68.52 Favored 'General case' 0 C--N 1.339 0.146 0 CA-C-O 120.583 0.23 . . . . 0.0 110.654 -177.389 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 42.3 t0 -73.56 -23.69 60.0 Favored 'General case' 0 CA--C 1.531 0.23 0 CA-C-N 115.866 -0.606 . . . . 0.0 112.245 -178.722 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . 0.404 ' C ' ' HE3' ' A' ' 21' ' ' LYS . 94.8 mt -79.16 159.86 27.23 Favored 'General case' 0 CA--C 1.528 0.126 0 O-C-N 121.836 -0.54 . . . . 0.0 110.858 -178.789 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . 0.45 ' HE3' ' CA ' ' A' ' 21' ' ' LYS . 0.0 OUTLIER -84.47 -34.95 23.3 Favored 'General case' 0 C--N 1.34 0.163 0 N-CA-C 109.415 -0.587 . . . . 0.0 109.415 176.027 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 83.9 p -82.02 -22.17 36.62 Favored 'General case' 0 C--N 1.34 0.187 0 C-N-CA 122.788 0.435 . . . . 0.0 111.017 177.937 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 71.59 -8.54 5.54 Favored Glycine 0 CA--C 1.529 0.921 0 C-N-CA 123.804 0.716 . . . . 0.0 112.889 179.282 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 44.9 mt -93.22 148.42 4.78 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.177 0 CA-C-N 117.751 0.776 . . . . 0.0 110.36 176.641 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 8.6 t -162.22 83.03 0.56 Allowed 'General case' 0 C--N 1.339 0.131 0 N-CA-C 109.543 -0.54 . . . . 0.0 109.543 -179.004 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -50.79 -44.9 49.13 Favored Glycine 0 CA--C 1.524 0.645 0 CA-C-O 118.725 -1.041 . . . . 0.0 115.067 -169.466 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 31.7 t -71.35 -42.05 68.98 Favored 'General case' 0 N--CA 1.455 -0.211 0 CA-C-N 119.945 1.872 . . . . 0.0 110.529 -177.469 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 80.4 mtt85 -66.68 -39.87 88.33 Favored 'General case' 0 N--CA 1.455 -0.208 0 N-CA-C 110.203 -0.295 . . . . 0.0 110.203 179.496 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 40.8 mt -55.98 -47.13 80.54 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.505 0 N-CA-C 108.254 -1.017 . . . . 0.0 108.254 174.815 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 78.8 mttt -65.7 -24.86 67.09 Favored 'General case' 0 C--N 1.34 0.172 0 CA-C-O 118.474 -0.774 . . . . 0.0 112.584 177.055 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . 0.528 ' HE3' ' HA ' ' A' ' 31' ' ' LYS . 0.0 OUTLIER -67.7 -56.1 10.61 Favored 'General case' 0 C--N 1.343 0.298 0 CA-C-N 119.704 1.138 . . . . 0.0 110.015 -179.915 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.454 HD12 ' N ' ' A' ' 33' ' ' THR . 2.4 pp -74.69 -19.18 60.36 Favored 'General case' 0 N--CA 1.455 -0.208 0 C-N-CA 119.201 -0.999 . . . . 0.0 111.101 -178.233 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . 0.454 ' N ' HD12 ' A' ' 32' ' ' LEU . 46.2 m -72.74 -37.38 67.74 Favored 'General case' 0 N--CA 1.456 -0.163 0 N-CA-C 109.239 -0.652 . . . . 0.0 109.239 176.404 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 96.0 m -74.69 -37.8 62.55 Favored 'General case' 0 N--CA 1.452 -0.344 0 CA-C-N 116.784 -0.189 . . . . 0.0 110.53 -178.398 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 57.7 t80 -69.93 -30.93 68.44 Favored 'General case' 0 N--CA 1.456 -0.162 0 C-N-CA 120.458 -0.497 . . . . 0.0 109.886 177.927 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -69.67 -33.26 72.32 Favored 'General case' 0 N--CA 1.45 -0.434 0 N-CA-C 110.097 -0.334 . . . . 0.0 110.097 176.293 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 20.6 mt -73.55 -40.77 63.7 Favored 'General case' 0 CA--C 1.52 -0.19 0 C-N-CA 122.743 0.417 . . . . 0.0 110.657 177.685 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 42.4 t0 -63.08 -24.54 67.95 Favored 'General case' 0 N--CA 1.455 -0.202 0 C-N-CA 122.814 0.446 . . . . 0.0 110.64 176.825 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 39' ' ' HIS . . . . . 0.408 ' HB2' HD11 ' A' ' 42' ' ' ILE . 94.8 m-70 -149.75 95.63 2.35 Favored 'General case' 0 N--CA 1.454 -0.239 0 C-N-CA 122.896 0.479 . . . . 0.0 111.622 -177.52 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 40' ' ' ILE . . . . . 0.63 ' H ' HD13 ' A' ' 40' ' ' ILE . 0.0 OUTLIER -72.21 -13.44 16.62 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.345 0 N-CA-C 109.958 -0.386 . . . . 0.0 109.958 174.25 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 18.6 m-20 -58.45 -19.94 40.93 Favored 'General case' 0 CA--C 1.529 0.172 0 C-N-CA 123.24 0.616 . . . . 0.0 112.409 -176.316 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . 0.408 HD11 ' HB2' ' A' ' 39' ' ' HIS . 0.0 OUTLIER -107.57 15.07 7.8 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.186 0 N-CA-C 112.109 0.411 . . . . 0.0 112.109 176.78 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 3.0 pp20? -51.46 -33.38 30.79 Favored 'General case' 0 C--O 1.224 -0.241 0 CA-C-N 118.864 0.757 . . . . 0.0 110.69 178.479 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 29.8 t -58.11 -50.28 74.02 Favored 'General case' 0 CA--C 1.534 0.357 0 O-C-N 122.366 -0.209 . . . . 0.0 111.257 -177.245 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . 0.515 ' HD3' ' CD1' ' A' ' 7' ' ' PHE . 18.6 ptpt -73.81 -27.87 61.34 Favored 'General case' 0 C--N 1.34 0.161 0 O-C-N 122.034 -0.416 . . . . 0.0 110.658 -179.906 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 46' ' ' ILE . . . . . 0.426 HG12 ' CZ ' ' A' ' 10' ' ' PHE . 86.5 mt -69.55 -48.13 67.82 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.377 0 C-N-CA 122.48 0.312 . . . . 0.0 110.181 -178.85 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 40.6 mm -64.14 -34.69 70.41 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.385 0 N-CA-C 108.95 -0.759 . . . . 0.0 108.95 179.18 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 28.4 t -63.73 -36.65 84.56 Favored 'General case' 0 N--CA 1.451 -0.401 0 C-N-CA 120.397 -0.521 . . . . 0.0 111.085 177.98 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 16.0 mt -73.4 -36.1 65.98 Favored 'General case' 0 N--CA 1.451 -0.387 0 N-CA-C 113.11 0.781 . . . . 0.0 113.11 -179.416 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . 0.432 HD12 HG12 ' A' ' 69' ' ' ILE . 7.7 pt -71.0 -41.25 76.87 Favored 'Isoleucine or valine' 0 C--O 1.226 -0.152 0 CA-C-N 119.311 0.96 . . . . 0.0 110.68 -178.244 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 20.0 pt -68.71 -38.67 79.21 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.191 0 C-N-CA 120.155 -0.618 . . . . 0.0 110.374 179.403 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 92.0 m-20 -72.26 -39.14 68.63 Favored 'General case' 0 N--CA 1.454 -0.245 0 O-C-N 121.944 -0.472 . . . . 0.0 111.586 178.893 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 29.0 t80 -65.32 -51.18 62.34 Favored 'General case' 0 N--CA 1.454 -0.253 0 N-CA-C 108.844 -0.798 . . . . 0.0 108.844 176.533 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 24.0 t -62.29 -31.92 72.57 Favored 'General case' 0 N--CA 1.455 -0.214 0 C-N-CA 122.427 0.291 . . . . 0.0 111.731 -173.988 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 74.3 mtm180 -79.93 -43.56 21.92 Favored 'General case' 0 N--CA 1.453 -0.297 0 O-C-N 121.92 -0.488 . . . . 0.0 112.197 -178.703 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 56.4 mt -81.93 -42.77 19.01 Favored 'General case' 0 N--CA 1.461 0.08 0 N-CA-C 113.163 0.801 . . . . 0.0 113.163 -175.159 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 57' ' ' CYS . . . . . 0.459 ' O ' ' HE2' ' A' ' 62' ' ' LYS . 14.0 p -60.48 159.19 25.32 Favored Pre-proline 0 CA--C 1.534 0.358 0 N-CA-C 114.064 1.135 . . . . 0.0 114.064 -172.529 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 31.3 Cg_exo -59.7 172.77 1.94 Allowed 'Trans proline' 0 N--CA 1.456 -0.709 1 C-N-CA 125.56 4.174 . . . . 0.0 113.198 175.751 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 27.6 p-10 -60.85 -42.37 97.67 Favored 'General case' 0 C--N 1.329 -0.305 0 C-N-CA 124.068 0.947 . . . . 0.0 112.535 -173.039 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 95.1 p -70.06 -36.44 74.99 Favored 'General case' 0 N--CA 1.455 -0.22 0 N-CA-C 109.541 -0.54 . . . . 0.0 109.541 179.345 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 71.4 m80 -69.98 -28.03 65.2 Favored 'General case' 0 N--CA 1.451 -0.413 0 N-CA-C 110.114 -0.328 . . . . 0.0 110.114 177.707 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . 0.459 ' HE2' ' O ' ' A' ' 57' ' ' CYS . 64.6 mttm -64.39 -41.51 96.62 Favored 'General case' 0 C--N 1.339 0.142 0 N-CA-C 109.151 -0.685 . . . . 0.0 109.151 173.069 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -59.68 -45.41 92.15 Favored 'General case' 0 CA--C 1.533 0.319 0 N-CA-C 108.693 -0.854 . . . . 0.0 108.693 176.423 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -69.09 -28.29 73.03 Favored Glycine 0 C--N 1.337 0.635 0 N-CA-C 111.755 -0.538 . . . . 0.0 111.755 -179.425 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 38.0 p -67.15 -36.27 81.46 Favored 'General case' 0 N--CA 1.453 -0.324 0 CA-C-N 117.837 0.819 . . . . 0.0 109.151 177.672 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 81.6 mt -75.42 -26.54 58.43 Favored 'General case' 0 N--CA 1.45 -0.464 0 CA-C-O 119.398 -0.334 . . . . 0.0 110.756 -179.242 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 6.9 m-30 -67.39 -39.14 85.59 Favored 'General case' 0 C--O 1.233 0.189 0 CA-C-N 118.055 0.389 . . . . 0.0 110.686 172.098 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 68' ' ' ILE . . . . . 0.434 HD11 ' CE1' ' A' ' 17' ' ' PHE . 19.7 mt -68.32 -50.85 53.51 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.643 0 N-CA-C 108.761 -0.829 . . . . 0.0 108.761 179.474 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 69' ' ' ILE . . . . . 0.432 HG12 HD12 ' A' ' 50' ' ' ILE . 88.5 mt -56.93 -34.87 45.37 Favored 'Isoleucine or valine' 0 C--N 1.34 0.156 0 C-N-CA 124.103 0.961 . . . . 0.0 111.328 178.223 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 11.9 t70 -69.44 -41.5 76.21 Favored 'General case' 0 N--CA 1.451 -0.407 0 CA-C-N 118.146 0.43 . . . . 0.0 110.588 177.377 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 19.4 m -71.65 -52.88 15.67 Favored 'General case' 0 N--CA 1.452 -0.356 0 CA-C-N 116.603 -0.271 . . . . 0.0 110.423 -175.893 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -75.17 -31.61 24.87 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.244 0 N-CA-C 110.165 -0.309 . . . . 0.0 110.165 -178.136 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -68.74 -56.01 10.34 Favored Glycine 0 C--N 1.336 0.565 0 N-CA-C 110.811 -0.916 . . . . 0.0 110.811 -176.379 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 39.6 mtm105 -65.62 -42.87 91.06 Favored 'General case' 0 N--CA 1.449 -0.511 0 C-N-CA 120.345 -0.542 . . . . 0.0 110.154 -179.475 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -64.17 -28.8 70.0 Favored 'General case' 0 N--CA 1.449 -0.484 0 C-N-CA 119.969 -0.692 . . . . 0.0 110.614 -177.139 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 2.0 m-30 -68.89 -47.31 66.18 Favored 'General case' 0 CA--C 1.518 -0.253 0 CA-C-N 118.738 0.699 . . . . 0.0 110.523 175.527 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 7.3 tt -67.29 -44.61 78.86 Favored 'General case' 0 N--CA 1.449 -0.491 0 C-N-CA 118.041 -1.464 . . . . 0.0 108.726 -179.336 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 72.3 m-20 -57.86 -48.51 79.59 Favored 'General case' 0 CA--C 1.53 0.177 0 N-CA-C 112.353 0.501 . . . . 0.0 112.353 178.922 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 15.4 tm-20 -62.98 -47.02 84.96 Favored 'General case' 0 N--CA 1.452 -0.353 0 CA-C-N 118.343 0.52 . . . . 0.0 110.886 -178.368 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 80' ' ' THR . . . . . 0.493 HG21 ' HB3' ' A' ' 94' ' ' CYS . 69.7 p -67.72 -32.78 73.65 Favored 'General case' 0 N--CA 1.454 -0.23 0 N-CA-C 110.152 -0.314 . . . . 0.0 110.152 179.523 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 33.9 ttp180 -66.56 -24.0 66.29 Favored 'General case' 0 N--CA 1.45 -0.447 0 C-N-CA 123.434 0.694 . . . . 0.0 110.939 174.891 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 35.1 t . . . . . 0 CA--C 1.53 0.179 0 C-N-CA 123.63 0.772 . . . . 0.0 113.015 179.089 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 73.1 Cg_endo . . . . . 0 N--CA 1.449 -1.143 0 N-CA-C 107.716 -1.686 . . . . 0.0 107.716 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 90.46 21.39 37.82 Favored Glycine 0 CA--C 1.523 0.563 0 CA-C-O 119.57 -0.572 . . . . 0.0 111.795 -179.091 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 41.5 p -151.62 173.84 14.18 Favored 'General case' 0 N--CA 1.454 -0.259 0 C-N-CA 123.884 0.873 . . . . 0.0 110.112 176.632 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 94' ' ' CYS . . . . . 0.493 ' HB3' HG21 ' A' ' 80' ' ' THR . 17.4 p -62.81 -21.65 66.06 Favored 'General case' 0 N--CA 1.448 -0.559 0 CA-C-N 115.741 -0.663 . . . . 0.0 109.526 175.737 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -59.92 -58.59 7.87 Favored 'General case' 0 N--CA 1.447 -0.596 0 N-CA-C 109.373 -0.603 . . . . 0.0 109.373 -176.916 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 75.0 t60 -74.58 -28.05 60.75 Favored 'General case' 0 N--CA 1.45 -0.451 0 N-CA-C 111.583 0.216 . . . . 0.0 111.583 -179.405 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -68.45 -52.52 31.63 Favored 'General case' 0 N--CA 1.452 -0.339 0 CA-C-N 116.662 -0.245 . . . . 0.0 110.785 -178.154 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 98' ' ' ILE . . . . . 0.454 HD13 ' HB2' ' A' ' 94' ' ' CYS . 2.3 mp -69.49 -27.64 34.89 Favored 'Isoleucine or valine' 0 C--N 1.339 0.141 0 C-N-CA 120.266 -0.573 . . . . 0.0 109.889 177.749 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 99' ' ' ASN . . . . . 0.409 HD22 ' C ' ' A' ' 99' ' ' ASN . 0.3 OUTLIER -65.99 -42.81 89.32 Favored 'General case' 0 N--CA 1.452 -0.347 0 CA-C-N 118.03 0.377 . . . . 0.0 110.822 176.554 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 86.5 m -66.53 -43.72 84.42 Favored 'General case' 0 CA--C 1.518 -0.272 0 N-CA-C 110.16 -0.311 . . . . 0.0 110.16 -176.818 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 90.6 mt -69.24 -30.6 68.77 Favored 'General case' 0 N--CA 1.45 -0.431 0 C-N-CA 120.903 -0.319 . . . . 0.0 110.408 179.293 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -61.46 -14.82 43.59 Favored Glycine 0 CA--C 1.528 0.852 0 CA-C-O 119.132 -0.816 . . . . 0.0 112.749 -177.31 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 22.8 mt-10 -107.65 -12.78 15.18 Favored 'General case' 0 C--N 1.339 0.145 0 CA-C-N 118.359 1.079 . . . . 0.0 112.701 -177.981 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 13.2 m -130.03 -4.0 2.72 Favored 'Isoleucine or valine' 0 N--CA 1.461 0.118 0 N-CA-C 113.203 0.816 . . . . 0.0 113.203 -175.311 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 105' ' ' ILE . . . . . . . . . . . . . 10.5 tp -59.14 -23.44 24.59 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.173 0 CA-C-N 119.159 0.89 . . . . 0.0 109.991 178.828 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 25.4 pt20 -65.96 -30.74 71.36 Favored 'General case' 0 N--CA 1.453 -0.3 0 C-N-CA 123.059 0.543 . . . . 0.0 110.27 177.088 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 69.7 mt-10 -75.03 -44.65 46.69 Favored 'General case' 0 N--CA 1.451 -0.403 0 N-CA-C 109.638 -0.505 . . . . 0.0 109.638 -179.563 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 8.3 mp -66.36 -49.53 66.58 Favored 'General case' 0 N--CA 1.452 -0.353 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.624 -176.438 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 8.8 mp -70.13 -54.23 13.85 Favored 'General case' 0 N--CA 1.45 -0.459 0 CA-C-O 119.22 -0.419 . . . . 0.0 110.595 -176.741 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 32.3 t -55.9 -41.84 75.1 Favored 'General case' 0 N--CA 1.455 -0.192 0 CA-C-N 118.461 0.573 . . . . 0.0 111.464 -175.626 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 45.8 t0 -68.58 -41.02 80.27 Favored 'General case' 0 N--CA 1.451 -0.396 0 N-CA-C 109.495 -0.557 . . . . 0.0 109.495 178.013 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -65.33 -35.02 79.71 Favored 'General case' 0 N--CA 1.446 -0.634 0 CA-C-O 119.345 -0.36 . . . . 0.0 110.849 -177.298 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 113' ' ' ILE . . . . . 0.451 ' O ' ' HE3' ' A' ' 121' ' ' LYS . 21.1 mm -68.4 -43.13 84.34 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.32 0 CA-C-N 118.714 0.688 . . . . 0.0 109.17 177.81 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -69.07 -32.76 72.45 Favored 'General case' 0 N--CA 1.451 -0.388 0 N-CA-C 112.178 0.436 . . . . 0.0 112.178 -179.845 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 115' ' ' LYS . . . . . 0.495 ' HZ2' ' N ' ' A' ' 115' ' ' LYS . 0.0 OUTLIER -85.12 -39.6 17.72 Favored 'General case' 0 C--N 1.34 0.153 0 N-CA-C 112.619 0.6 . . . . 0.0 112.619 -178.258 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 116' ' ' SER . . . . . 0.452 ' HB2' ' CB ' ' A' ' 120' ' ' HIS . 49.5 p -85.31 157.16 20.63 Favored 'General case' 0 N--CA 1.455 -0.221 0 N-CA-C 112.257 0.466 . . . . 0.0 112.257 -171.556 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 50.8 t30 -79.97 170.69 16.11 Favored 'General case' 0 N--CA 1.454 -0.237 0 C-N-CA 123.243 0.617 . . . . 0.0 111.102 -178.226 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 118' ' ' GLN . . . . . . . . . . . . . 16.0 mm100 -56.92 -35.98 69.66 Favored 'General case' 0 CA--C 1.527 0.064 0 C-N-CA 123.199 0.6 . . . . 0.0 112.542 -173.634 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 10.0 p-10 -68.93 -40.1 79.22 Favored 'General case' 0 N--CA 1.454 -0.242 0 N-CA-C 109.358 -0.608 . . . . 0.0 109.358 178.299 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 120' ' ' HIS . . . . . 0.452 ' CB ' ' HB2' ' A' ' 116' ' ' SER . 27.8 m170 -66.47 -39.38 88.76 Favored 'General case' 0 N--CA 1.452 -0.352 0 CA-C-N 116.376 -0.375 . . . . 0.0 110.091 176.819 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 121' ' ' LYS . . . . . 0.451 ' HE3' ' O ' ' A' ' 113' ' ' ILE . 64.6 mttp -57.88 -36.18 72.03 Favored 'General case' 0 C--N 1.34 0.158 0 N-CA-C 109.537 -0.542 . . . . 0.0 109.537 176.795 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 40.3 tp10 -72.63 -36.56 68.05 Favored 'General case' 0 N--CA 1.452 -0.349 0 CA-C-O 119.746 -0.168 . . . . 0.0 111.448 -179.902 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 35.6 mmtp -63.43 -39.42 94.43 Favored 'General case' 0 N--CA 1.457 -0.103 0 N-CA-C 109.23 -0.656 . . . . 0.0 109.23 177.738 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 124' ' ' ILE . . . . . . . . . . . . . 65.7 mt -66.9 -34.93 73.18 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.37 0 N-CA-C 108.62 -0.881 . . . . 0.0 108.62 178.211 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 125' ' ' ARG . . . . . 0.462 ' HD2' ' HA ' ' A' ' 125' ' ' ARG . 20.5 tpt85 -68.18 -41.76 80.95 Favored 'General case' 0 N--CA 1.441 -0.877 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.988 -174.993 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 126' ' ' MET . . . . . . . . . . . . . 26.8 ptm -66.7 -32.4 73.68 Favored 'General case' 0 N--CA 1.453 -0.291 0 N-CA-C 108.811 -0.811 . . . . 0.0 108.811 174.809 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 4.7 mp -63.13 -33.83 76.32 Favored 'General case' 0 CA--C 1.531 0.239 0 CA-C-O 118.75 -0.643 . . . . 0.0 110.683 174.852 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 39.5 mt -68.77 -40.94 79.44 Favored 'General case' 0 C--N 1.34 0.162 0 CA-C-N 119.507 1.048 . . . . 0.0 110.148 179.007 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 51.9 m-20 -63.7 -39.2 93.73 Favored 'General case' 0 CA--C 1.522 -0.116 0 C-N-CA 120.353 -0.539 . . . . 0.0 109.911 176.322 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 58.3 mt -64.24 -33.31 61.72 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.256 0 C-N-CA 123.029 0.531 . . . . 0.0 109.959 178.178 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 131' ' ' TRP . . . . . . . . . . . . . 45.9 m0 . . . . . 0 N--CA 1.455 -0.188 0 N-CA-C 112.055 0.391 . . . . 0.0 112.055 176.379 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 16.0 p-10 . . . . . 0 N--CA 1.456 -0.141 0 N-CA-C 106.692 -1.596 . . . . 0.0 106.692 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 7' ' ' PHE . . . . . 0.503 ' CD1' ' HD3' ' A' ' 45' ' ' LYS . 1.1 t80 -63.01 -32.45 73.82 Favored 'General case' 0 N--CA 1.444 -0.764 0 C-N-CA 125.063 1.345 . . . . 0.0 110.141 -179.662 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 58.2 tp60 -48.38 -39.49 22.52 Favored 'General case' 0 N--CA 1.454 -0.229 0 C-N-CA 124.322 1.049 . . . . 0.0 111.765 -177.948 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 16.2 m-80 -71.75 -35.17 70.02 Favored 'General case' 0 N--CA 1.455 -0.177 0 N-CA-C 110.145 -0.317 . . . . 0.0 110.145 -178.261 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 1.7 t80 -72.29 -38.97 68.64 Favored 'General case' 0 N--CA 1.449 -0.483 0 C-N-CA 123.731 0.812 . . . . 0.0 109.514 178.148 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 93.0 t -66.24 -52.1 51.52 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.271 0 N-CA-C 108.608 -0.886 . . . . 0.0 108.608 178.601 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -60.36 -29.27 68.8 Favored 'General case' 0 N--CA 1.452 -0.367 0 C-N-CA 122.665 0.386 . . . . 0.0 111.848 179.902 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 59.8 m -73.96 -36.62 64.61 Favored 'General case' 0 CA--C 1.53 0.207 0 N-CA-C 109.055 -0.72 . . . . 0.0 109.055 176.484 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.529 ' HA ' ' CD1' ' A' ' 17' ' ' PHE . 4.8 tp -66.57 -46.53 75.71 Favored 'General case' 0 N--CA 1.453 -0.287 0 CA-C-O 121.284 0.564 . . . . 0.0 109.776 177.899 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 67.8 mm-40 -62.01 -28.09 69.33 Favored 'General case' 0 N--CA 1.447 -0.579 0 C-N-CA 124.167 0.987 . . . . 0.0 109.189 178.485 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 48.2 t -70.99 -28.5 64.48 Favored 'General case' 0 N--CA 1.449 -0.517 0 CA-C-N 116.109 -0.496 . . . . 0.0 109.856 177.31 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 17' ' ' PHE . . . . . 0.529 ' CD1' ' HA ' ' A' ' 14' ' ' LEU . 19.4 m-85 -72.42 -35.55 68.39 Favored 'General case' 0 N--CA 1.455 -0.19 0 CA-C-N 118.584 0.629 . . . . 0.0 110.951 171.161 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . 0.464 ' HA ' ' CE1' ' A' ' 61' ' ' HIS . 84.7 mttt -62.93 -26.47 68.83 Favored 'General case' 0 C--N 1.339 0.132 0 N-CA-C 109.643 -0.503 . . . . 0.0 109.643 177.521 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 43.6 t0 -76.71 -15.28 59.82 Favored 'General case' 0 CA--C 1.537 0.478 0 CA-C-N 115.17 -0.923 . . . . 0.0 111.837 176.348 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 87.8 mt -86.06 144.68 27.43 Favored 'General case' 0 N--CA 1.45 -0.432 0 O-C-N 121.243 -0.91 . . . . 0.0 111.276 -179.143 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . 0.582 ' H ' ' HE2' ' A' ' 21' ' ' LYS . 1.6 mppt? -83.51 15.04 3.29 Favored 'General case' 0 CA--C 1.531 0.219 0 CA-C-N 115.116 -0.947 . . . . 0.0 108.849 177.316 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 86.0 p -141.73 -26.05 0.68 Allowed 'General case' 0 N--CA 1.454 -0.263 0 C-N-CA 124.735 1.214 . . . . 0.0 111.796 -175.416 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 75.83 -15.46 4.98 Favored Glycine 0 CA--C 1.526 0.731 0 C-N-CA 123.804 0.716 . . . . 0.0 113.141 175.965 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 81.5 mt -97.07 147.07 6.63 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.383 0 C-N-CA 123.395 0.678 . . . . 0.0 109.904 176.948 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 41.4 t -166.03 99.1 0.64 Allowed 'General case' 0 N--CA 1.455 -0.213 0 N-CA-C 109.055 -0.721 . . . . 0.0 109.055 171.296 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -55.2 -48.71 66.93 Favored Glycine 0 CA--C 1.523 0.544 0 CA-C-O 119.428 -0.651 . . . . 0.0 112.591 -172.65 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . 0.434 ' HA ' ' HE3' ' A' ' 30' ' ' LYS . 16.5 m -63.05 -43.17 99.37 Favored 'General case' 0 N--CA 1.454 -0.251 0 CA-C-N 118.546 1.173 . . . . 0.0 111.08 -177.346 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 81.2 mtt180 -69.55 -42.31 74.77 Favored 'General case' 0 N--CA 1.457 -0.11 0 C-N-CA 122.509 0.324 . . . . 0.0 110.507 -179.888 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 62.6 mt -58.11 -41.78 81.47 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.616 0 N-CA-C 108.467 -0.938 . . . . 0.0 108.467 175.29 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . 0.434 ' HE3' ' HA ' ' A' ' 27' ' ' SER . 46.9 mtmt -69.37 -22.11 63.75 Favored 'General case' 0 N--CA 1.456 -0.171 0 CA-C-O 118.427 -0.797 . . . . 0.0 111.979 177.853 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . 0.574 ' HA ' ' HE2' ' A' ' 31' ' ' LYS . 8.3 mmpt? -67.1 -56.6 9.34 Favored 'General case' 0 C--N 1.34 0.172 0 CA-C-N 119.621 1.1 . . . . 0.0 109.295 175.352 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 4.6 pp -70.88 -25.73 62.92 Favored 'General case' 0 CA--C 1.528 0.107 0 C-N-CA 120.121 -0.632 . . . . 0.0 110.914 -177.603 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 60.4 m -71.72 -35.61 70.24 Favored 'General case' 0 N--CA 1.457 -0.103 0 N-CA-C 109.94 -0.392 . . . . 0.0 109.94 178.855 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 76.2 m -73.41 -37.33 65.97 Favored 'General case' 0 N--CA 1.454 -0.236 0 N-CA-C 110.414 -0.217 . . . . 0.0 110.414 -178.251 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 42.8 t80 -68.43 -33.22 73.81 Favored 'General case' 0 N--CA 1.457 -0.089 0 C-N-CA 119.852 -0.739 . . . . 0.0 110.087 176.619 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -69.4 -33.6 73.25 Favored 'General case' 0 N--CA 1.448 -0.567 0 CA-C-O 119.775 -0.155 . . . . 0.0 110.617 177.951 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 16.7 mt -73.14 -39.48 65.66 Favored 'General case' 0 N--CA 1.455 -0.209 0 C-N-CA 122.513 0.325 . . . . 0.0 110.684 177.919 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 44.3 t0 -63.61 -26.24 68.59 Favored 'General case' 0 N--CA 1.452 -0.356 0 C-N-CA 122.267 0.227 . . . . 0.0 110.78 176.39 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 39' ' ' HIS . . . . . 0.424 ' HB2' HD11 ' A' ' 42' ' ' ILE . 97.1 m-70 -149.38 99.84 2.95 Favored 'General case' 0 N--CA 1.454 -0.261 0 C-N-CA 122.658 0.383 . . . . 0.0 111.476 -177.028 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 40' ' ' ILE . . . . . 0.6 ' H ' HD13 ' A' ' 40' ' ' ILE . 0.0 OUTLIER -75.39 -19.26 15.97 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.485 0 CA-C-O 118.844 -0.598 . . . . 0.0 110.79 178.0 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 71.1 m-20 -62.21 -9.16 6.97 Favored 'General case' 0 CA--C 1.531 0.212 0 N-CA-C 113.455 0.909 . . . . 0.0 113.455 -175.567 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . 0.424 HD11 ' HB2' ' A' ' 39' ' ' HIS . 0.0 OUTLIER -110.4 13.9 8.52 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.168 0 CA-C-N 118.187 0.449 . . . . 0.0 111.655 173.447 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 3.1 pp20? -52.89 -33.4 49.95 Favored 'General case' 0 CA--C 1.529 0.143 0 O-C-N 121.507 -0.746 . . . . 0.0 111.306 177.61 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 3.3 m -64.9 -40.69 95.47 Favored 'General case' 0 CA--C 1.533 0.304 0 CA-C-O 119.053 -0.499 . . . . 0.0 111.911 -176.369 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . 0.503 ' HD3' ' CD1' ' A' ' 7' ' ' PHE . 15.3 ptpt -73.17 -27.06 61.43 Favored 'General case' 0 C--N 1.341 0.236 0 CA-C-N 119.346 0.975 . . . . 0.0 109.51 176.803 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 78.7 mt -72.34 -47.15 54.03 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.396 0 C-N-CA 122.715 0.406 . . . . 0.0 110.036 -177.427 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 42.2 mm -65.24 -38.16 81.93 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.203 0 N-CA-C 109.658 -0.497 . . . . 0.0 109.658 179.41 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 37.6 t -65.7 -32.49 74.07 Favored 'General case' 0 N--CA 1.455 -0.192 0 C-N-CA 120.38 -0.528 . . . . 0.0 110.478 177.513 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . 0.497 HD22 ' CE1' ' A' ' 7' ' ' PHE . 29.4 tp -75.87 -32.71 59.84 Favored 'General case' 0 N--CA 1.452 -0.364 0 N-CA-C 112.691 0.626 . . . . 0.0 112.691 -177.061 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . 0.405 HD12 HG12 ' A' ' 69' ' ' ILE . 11.6 pt -73.97 -38.5 49.74 Favored 'Isoleucine or valine' 0 C--N 1.338 0.098 0 CA-C-N 118.995 0.816 . . . . 0.0 110.956 177.819 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 46.9 pt -66.31 -37.06 78.86 Favored 'Isoleucine or valine' 0 C--O 1.227 -0.084 0 C-N-CA 119.484 -0.886 . . . . 0.0 109.991 178.351 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 95.1 m-20 -67.39 -36.91 82.27 Favored 'General case' 0 N--CA 1.454 -0.263 0 CA-C-N 117.559 0.163 . . . . 0.0 111.113 176.415 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 53' ' ' TYR . . . . . 0.411 ' CE1' ' HB3' ' A' ' 61' ' ' HIS . 18.5 t80 -67.67 -36.55 80.91 Favored 'General case' 0 C--O 1.226 -0.154 0 N-CA-C 109.908 -0.404 . . . . 0.0 109.908 176.172 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 15.2 m -75.59 -22.3 57.06 Favored 'General case' 0 N--CA 1.452 -0.352 0 C-N-CA 122.503 0.321 . . . . 0.0 111.532 -178.464 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 28.9 ttp-105 -86.69 -47.01 9.51 Favored 'General case' 0 N--CA 1.455 -0.199 0 N-CA-C 112.666 0.617 . . . . 0.0 112.666 -177.354 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 46.7 mt -84.95 -47.19 10.52 Favored 'General case' 0 N--CA 1.455 -0.196 0 N-CA-C 112.728 0.64 . . . . 0.0 112.728 -174.242 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 57' ' ' CYS . . . . . 0.542 ' HB3' ' HD2' ' A' ' 58' ' ' PRO . 59.5 m -74.62 160.01 81.99 Favored Pre-proline 0 CA--C 1.534 0.338 0 C-N-CA 122.97 0.508 . . . . 0.0 112.176 -173.573 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 58' ' ' PRO . . . . . 0.542 ' HD2' ' HB3' ' A' ' 57' ' ' CYS . 68.0 Cg_endo -79.01 -176.17 3.14 Favored 'Trans proline' 0 N--CA 1.455 -0.775 0 C-N-CA 125.174 3.916 . . . . 0.0 112.252 -170.073 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 59' ' ' ASP . . . . . 0.458 ' HB2' ' HA ' ' A' ' 116' ' ' SER . 26.0 p-10 -51.15 -50.13 59.5 Favored 'General case' 0 N--CA 1.457 -0.083 0 C-N-CA 124.605 1.162 . . . . 0.0 113.439 -172.837 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 24.5 m -66.18 -33.75 76.48 Favored 'General case' 0 N--CA 1.453 -0.309 0 N-CA-C 109.881 -0.415 . . . . 0.0 109.881 -175.405 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 61' ' ' HIS . . . . . 0.464 ' CE1' ' HA ' ' A' ' 18' ' ' LYS . 33.6 m170 -75.92 -27.44 57.64 Favored 'General case' 0 N--CA 1.451 -0.42 0 N-CA-C 110.051 -0.351 . . . . 0.0 110.051 179.283 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . 0.408 ' HB3' ' HE3' ' A' ' 62' ' ' LYS . 29.4 mtpp -73.58 -34.83 65.29 Favored 'General case' 0 C--N 1.339 0.115 0 N-CA-C 110.008 -0.367 . . . . 0.0 110.008 174.48 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -62.85 -43.77 97.91 Favored 'General case' 0 CA--C 1.535 0.402 0 N-CA-C 107.733 -1.21 . . . . 0.0 107.733 175.894 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -70.01 -24.74 76.31 Favored Glycine 0 C--N 1.34 0.751 0 CA-C-N 116.032 -0.531 . . . . 0.0 111.78 179.071 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 42.9 t -69.29 -37.44 77.83 Favored 'General case' 0 N--CA 1.452 -0.348 0 CA-C-N 117.972 0.886 . . . . 0.0 109.707 175.546 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 77.0 mt -72.96 -25.05 60.88 Favored 'General case' 0 N--CA 1.451 -0.412 0 CA-C-O 119.41 -0.329 . . . . 0.0 110.341 178.789 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 3.1 m-30 -70.23 -37.43 74.98 Favored 'General case' 0 CA--C 1.52 -0.204 0 CA-C-N 118.078 0.399 . . . . 0.0 110.5 171.016 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 68' ' ' ILE . . . . . 0.501 HD11 ' CE1' ' A' ' 17' ' ' PHE . 32.2 mt -67.4 -52.94 36.73 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.6 0 N-CA-C 108.389 -0.967 . . . . 0.0 108.389 178.189 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 69' ' ' ILE . . . . . 0.405 HG12 HD12 ' A' ' 50' ' ' ILE . 71.6 mt -52.86 -35.42 21.78 Favored 'Isoleucine or valine' 0 C--N 1.339 0.145 0 C-N-CA 123.6 0.76 . . . . 0.0 111.6 175.88 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 18.4 t70 -69.61 -41.2 76.0 Favored 'General case' 0 C--N 1.333 -0.113 0 CA-C-N 118.538 0.608 . . . . 0.0 110.73 177.907 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 20.2 m -70.66 -56.5 6.29 Favored 'General case' 0 N--CA 1.45 -0.439 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.251 -176.509 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 72' ' ' ILE . . . . . 0.462 HD11 ' CZ ' ' A' ' 76' ' ' TYR . 0.0 OUTLIER -75.01 -29.89 22.73 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.247 0 N-CA-C 110.077 -0.342 . . . . 0.0 110.077 -176.85 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -69.72 -56.72 7.97 Favored Glycine 0 C--N 1.336 0.562 0 N-CA-C 111.533 -0.627 . . . . 0.0 111.533 -176.421 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 39.7 mtm105 -68.94 -38.46 79.5 Favored 'General case' 0 N--CA 1.453 -0.288 0 CA-C-N 117.48 0.64 . . . . 0.0 110.309 -179.395 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -64.36 -29.47 70.54 Favored 'General case' 0 N--CA 1.45 -0.449 0 C-N-CA 119.6 -0.84 . . . . 0.0 110.468 -179.219 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 76' ' ' TYR . . . . . 0.462 ' CZ ' HD11 ' A' ' 72' ' ' ILE . 2.1 m-30 -71.78 -46.36 58.57 Favored 'General case' 0 N--CA 1.455 -0.203 0 CA-C-N 118.427 0.558 . . . . 0.0 110.847 176.65 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -65.07 -41.21 95.3 Favored 'General case' 0 N--CA 1.45 -0.432 0 C-N-CA 118.427 -1.309 . . . . 0.0 107.896 -178.357 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 94.3 m-20 -65.55 -42.54 91.76 Favored 'General case' 0 C--O 1.23 0.064 0 N-CA-C 113.377 0.88 . . . . 0.0 113.377 178.161 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 15.5 tm-20 -64.29 -41.86 96.68 Favored 'General case' 0 N--CA 1.448 -0.541 0 CA-C-N 118.45 0.568 . . . . 0.0 110.746 178.322 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 80' ' ' THR . . . . . 0.45 HG21 ' HB3' ' A' ' 94' ' ' CYS . 71.5 p -74.36 -21.34 59.72 Favored 'General case' 0 N--CA 1.456 -0.146 0 CA-C-O 119.783 -0.151 . . . . 0.0 111.057 -179.737 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 64.6 mtt180 -68.35 -36.81 79.8 Favored 'General case' 0 CA--C 1.526 0.054 0 N-CA-C 109.835 -0.432 . . . . 0.0 109.835 169.124 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 35.4 t . . . . . 0 N--CA 1.457 -0.105 0 C-N-CA 123.958 0.903 . . . . 0.0 113.226 -176.19 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 71.9 Cg_endo . . . . . 0 N--CA 1.451 -1.012 0 N-CA-C 106.435 -2.179 . . . . 0.0 106.435 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 92' ' ' GLY . . . . . 0.449 ' HA2' ' O ' ' A' ' 40' ' ' ILE . . . 105.98 24.98 6.66 Favored Glycine 0 CA--C 1.527 0.81 0 C-N-CA 120.386 -0.911 . . . . 0.0 112.436 -172.902 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 37.9 p -153.94 171.93 18.22 Favored 'General case' 0 CA--C 1.522 -0.121 0 CA-C-N 117.908 0.854 . . . . 0.0 109.951 177.09 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 94' ' ' CYS . . . . . 0.454 ' HB2' HD13 ' A' ' 98' ' ' ILE . 19.6 p -62.24 -22.46 65.99 Favored 'General case' 0 N--CA 1.448 -0.541 0 N-CA-C 109.183 -0.673 . . . . 0.0 109.183 176.381 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -63.16 -58.03 8.59 Favored 'General case' 0 N--CA 1.445 -0.691 0 N-CA-C 109.352 -0.61 . . . . 0.0 109.352 -175.609 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 65.2 t60 -71.51 -33.38 69.16 Favored 'General case' 0 N--CA 1.45 -0.459 0 N-CA-C 110.228 -0.286 . . . . 0.0 110.228 -179.973 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -65.88 -53.95 32.96 Favored 'General case' 0 N--CA 1.448 -0.537 0 CA-C-O 119.831 -0.128 . . . . 0.0 111.104 -176.741 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 98' ' ' ILE . . . . . 0.454 HD13 ' HB2' ' A' ' 94' ' ' CYS . 2.5 mp -70.29 -29.57 39.78 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.336 0 C-N-CA 120.474 -0.49 . . . . 0.0 110.926 -178.375 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 13.4 m-80 -70.45 -38.15 74.44 Favored 'General case' 0 N--CA 1.456 -0.165 0 CA-C-N 118.737 0.698 . . . . 0.0 111.522 176.53 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 89.2 m -67.18 -31.93 72.66 Favored 'General case' 0 CA--C 1.519 -0.221 0 N-CA-C 109.577 -0.527 . . . . 0.0 109.577 179.528 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 83.5 mt -72.22 -42.15 66.05 Favored 'General case' 0 N--CA 1.446 -0.656 0 N-CA-C 109.124 -0.695 . . . . 0.0 109.124 174.874 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -59.38 -14.66 28.0 Favored Glycine 0 CA--C 1.526 0.76 0 CA-C-O 119.155 -0.803 . . . . 0.0 112.849 -177.392 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 21.6 pt-20 -104.28 -2.93 24.91 Favored 'General case' 0 CA--C 1.533 0.289 0 CA-C-N 118.557 1.178 . . . . 0.0 113.502 -177.56 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 34.9 m -143.58 -7.6 0.27 Allowed 'Isoleucine or valine' 0 N--CA 1.466 0.325 0 CA-C-N 118.977 0.808 . . . . 0.0 113.133 176.557 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 105' ' ' ILE . . . . . . . . . . . . . 10.8 tp -64.39 -24.87 36.64 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.169 0 CA-C-N 118.741 0.7 . . . . 0.0 111.018 -176.339 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 23.0 pt20 -69.72 -40.36 76.28 Favored 'General case' 0 N--CA 1.452 -0.33 0 CA-C-O 119.557 -0.258 . . . . 0.0 111.299 -175.591 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 76.4 mm-40 -80.1 -24.97 40.2 Favored 'General case' 0 N--CA 1.453 -0.313 0 CA-C-N 118.401 0.546 . . . . 0.0 110.8 175.958 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 9.1 tt -68.2 -41.62 81.1 Favored 'General case' 0 N--CA 1.452 -0.337 0 N-CA-C 108.908 -0.775 . . . . 0.0 108.908 177.195 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 55.6 mt -68.91 -52.25 31.42 Favored 'General case' 0 N--CA 1.453 -0.298 0 N-CA-C 109.016 -0.735 . . . . 0.0 109.016 174.893 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 34.5 t -42.28 -48.67 5.02 Favored 'General case' 0 C--O 1.234 0.24 0 C-N-CA 123.455 0.702 . . . . 0.0 112.527 175.333 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 35.6 t0 -67.8 -41.25 83.46 Favored 'General case' 0 N--CA 1.455 -0.224 0 N-CA-C 109.937 -0.394 . . . . 0.0 109.937 179.26 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -67.69 -32.94 73.95 Favored 'General case' 0 N--CA 1.446 -0.674 0 C-N-CA 120.848 -0.341 . . . . 0.0 110.794 -176.981 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 113' ' ' ILE . . . . . . . . . . . . . 40.9 mm -70.21 -38.82 75.8 Favored 'Isoleucine or valine' 0 C--N 1.339 0.144 0 CA-C-N 118.474 0.579 . . . . 0.0 109.941 178.766 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -74.27 -47.73 33.09 Favored 'General case' 0 N--CA 1.453 -0.322 0 N-CA-C 111.469 0.174 . . . . 0.0 111.469 179.792 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 115' ' ' LYS . . . . . 0.408 ' HE3' ' HB2' ' A' ' 115' ' ' LYS . 30.4 ttmt -76.98 -30.83 56.14 Favored 'General case' 0 N--CA 1.452 -0.331 0 C-N-CA 124.262 1.025 . . . . 0.0 113.619 -172.492 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 116' ' ' SER . . . . . 0.458 ' HA ' ' HB2' ' A' ' 59' ' ' ASP . 1.5 m -90.05 150.57 22.04 Favored 'General case' 0 CA--C 1.528 0.134 0 CA-C-N 118.177 0.444 . . . . 0.0 111.383 -174.185 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 19.1 t30 -71.21 169.31 15.42 Favored 'General case' 0 C--O 1.225 -0.213 0 C-N-CA 122.802 0.441 . . . . 0.0 110.685 -174.2 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 118' ' ' GLN . . . . . . . . . . . . . 17.1 mt-30 -55.39 -36.23 66.17 Favored 'General case' 0 CA--C 1.528 0.103 0 N-CA-C 111.947 0.351 . . . . 0.0 111.947 -173.616 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -66.59 -34.29 77.56 Favored 'General case' 0 N--CA 1.456 -0.14 0 N-CA-C 109.64 -0.504 . . . . 0.0 109.64 178.331 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 120' ' ' HIS . . . . . 0.455 ' CB ' ' HB3' ' A' ' 116' ' ' SER . 19.4 m170 -75.48 -41.3 55.86 Favored 'General case' 0 N--CA 1.448 -0.549 0 N-CA-C 109.178 -0.675 . . . . 0.0 109.178 179.07 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 49.4 mttm -54.75 -43.6 72.86 Favored 'General case' 0 N--CA 1.456 -0.165 0 N-CA-C 108.824 -0.806 . . . . 0.0 108.824 177.2 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 39.1 tp10 -66.17 -41.81 89.82 Favored 'General case' 0 N--CA 1.454 -0.266 0 CA-C-O 119.62 -0.228 . . . . 0.0 110.633 -179.269 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 88.9 mttt -66.6 -28.64 68.66 Favored 'General case' 0 N--CA 1.452 -0.342 0 C-N-CA 119.721 -0.792 . . . . 0.0 111.112 178.801 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 124' ' ' ILE . . . . . . . . . . . . . 58.1 mt -72.27 -38.22 61.1 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.198 0 CA-C-N 118.52 0.6 . . . . 0.0 109.897 177.906 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 27.9 mmt180 -64.62 -40.37 95.36 Favored 'General case' 0 N--CA 1.455 -0.216 0 O-C-N 121.887 -0.508 . . . . 0.0 110.819 -179.744 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 126' ' ' MET . . . . . . . . . . . . . 28.3 ptm -71.8 -30.69 65.79 Favored 'General case' 0 CA--C 1.528 0.117 0 C-N-CA 120.181 -0.608 . . . . 0.0 110.827 -179.648 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 66.7 mt -64.74 -35.85 82.4 Favored 'General case' 0 N--CA 1.456 -0.128 0 CA-C-N 118.392 0.542 . . . . 0.0 110.103 175.347 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 95.4 mt -69.4 -35.74 76.07 Favored 'General case' 0 CA--C 1.529 0.159 0 CA-C-N 118.193 0.451 . . . . 0.0 110.64 178.12 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 14.9 t0 -63.29 -44.52 94.8 Favored 'General case' 0 N--CA 1.456 -0.172 0 N-CA-C 109.367 -0.605 . . . . 0.0 109.367 176.368 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 65.4 mt -60.93 -34.27 58.95 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.251 0 N-CA-C 109.993 -0.373 . . . . 0.0 109.993 -179.981 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 131' ' ' TRP . . . . . . . . . . . . . 43.4 m0 . . . . . 0 N--CA 1.452 -0.334 0 C-N-CA 120.057 -0.657 . . . . 0.0 112.617 -179.271 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 20.7 p-10 . . . . . 0 N--CA 1.449 -0.488 0 N-CA-C 108.928 -0.767 . . . . 0.0 108.928 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 7' ' ' PHE . . . . . 0.474 ' CD1' ' HD3' ' A' ' 45' ' ' LYS . 1.5 t80 -49.73 -39.6 37.87 Favored 'General case' 0 N--CA 1.456 -0.145 0 C-N-CA 124.028 0.931 . . . . 0.0 110.089 177.416 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 50.8 tp60 -51.79 -34.63 40.67 Favored 'General case' 0 N--CA 1.455 -0.189 0 C-N-CA 124.061 0.944 . . . . 0.0 111.919 -177.183 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 30.7 m-80 -74.2 -30.7 62.33 Favored 'General case' 0 N--CA 1.451 -0.394 0 N-CA-C 109.916 -0.401 . . . . 0.0 109.916 -179.175 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 10' ' ' PHE . . . . . 0.42 ' CE2' ' HB2' ' A' ' 32' ' ' LEU . 3.2 t80 -71.04 -38.99 72.53 Favored 'General case' 0 N--CA 1.451 -0.414 0 N-CA-C 109.125 -0.695 . . . . 0.0 109.125 176.221 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 65.2 t -64.69 -56.47 15.85 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.307 0 N-CA-C 108.948 -0.76 . . . . 0.0 108.948 178.409 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -59.49 -27.17 65.89 Favored 'General case' 0 N--CA 1.451 -0.393 0 C-N-CA 123.109 0.564 . . . . 0.0 112.247 -179.933 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 81.8 m -73.38 -41.4 63.42 Favored 'General case' 0 N--CA 1.456 -0.162 0 CA-C-N 118.785 0.721 . . . . 0.0 109.262 177.163 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.498 ' HA ' ' CD1' ' A' ' 17' ' ' PHE . 11.8 tp -64.06 -48.0 77.94 Favored 'General case' 0 N--CA 1.452 -0.345 0 CA-C-O 121.357 0.599 . . . . 0.0 109.643 177.728 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 61.7 mm-40 -62.33 -30.48 71.19 Favored 'General case' 0 N--CA 1.452 -0.359 0 C-N-CA 124.209 1.003 . . . . 0.0 109.886 179.303 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 31.4 t -67.84 -31.42 71.24 Favored 'General case' 0 N--CA 1.45 -0.458 0 CA-C-O 119.011 -0.519 . . . . 0.0 110.033 177.476 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 17' ' ' PHE . . . . . 0.498 ' CD1' ' HA ' ' A' ' 14' ' ' LEU . 13.8 m-85 -67.85 -39.91 83.74 Favored 'General case' 0 C--N 1.339 0.132 0 CA-C-N 118.495 0.589 . . . . 0.0 110.439 172.999 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . 0.442 ' HG2' ' CE1' ' A' ' 53' ' ' TYR . 65.8 mttt -64.8 -27.88 69.19 Favored 'General case' 0 C--N 1.338 0.106 0 CA-C-O 120.468 0.175 . . . . 0.0 110.864 -178.008 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 36.3 t0 -75.29 -14.72 60.52 Favored 'General case' 0 CA--C 1.533 0.293 0 C-N-CA 123.634 0.774 . . . . 0.0 112.186 179.865 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 48.7 mt -77.12 168.84 19.39 Favored 'General case' 0 N--CA 1.457 -0.124 0 O-C-N 121.714 -0.616 . . . . 0.0 111.758 -178.992 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 8.3 mtmp? -99.41 -27.19 13.86 Favored 'General case' 0 N--CA 1.455 -0.215 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.049 174.698 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 80.7 p -90.56 -25.33 20.27 Favored 'General case' 0 CA--C 1.529 0.167 0 C-N-CA 122.913 0.485 . . . . 0.0 110.597 176.03 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 77.47 -22.28 2.7 Favored Glycine 0 CA--C 1.529 0.93 0 C-N-CA 123.631 0.634 . . . . 0.0 113.793 176.155 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 66.6 mt -84.72 151.86 3.76 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.215 0 CA-C-N 118.086 0.943 . . . . 0.0 108.912 172.927 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 5.1 t -159.09 79.84 0.76 Allowed 'General case' 0 N--CA 1.453 -0.312 0 CA-C-N 118.46 0.573 . . . . 0.0 110.895 -179.52 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . 0.442 ' O ' ' HE2' ' A' ' 30' ' ' LYS . . . -47.11 -51.22 14.56 Favored Glycine 0 CA--C 1.524 0.606 0 CA-C-O 118.932 -0.927 . . . . 0.0 114.059 -171.954 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 14.6 m -63.98 -49.04 74.04 Favored 'General case' 0 CA--C 1.52 -0.19 0 CA-C-N 119.044 1.422 . . . . 0.0 110.647 -175.511 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 15.2 mtm180 -70.38 -34.04 72.11 Favored 'General case' 0 C--O 1.234 0.26 0 CA-C-O 119.704 -0.189 . . . . 0.0 111.128 -176.737 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 29' ' ' ILE . . . . . 0.41 HG12 ' CG1' ' A' ' 68' ' ' ILE . 54.4 mt -58.73 -45.84 90.89 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.592 0 N-CA-C 108.006 -1.109 . . . . 0.0 108.006 173.133 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . 0.442 ' HE2' ' O ' ' A' ' 26' ' ' GLY . 53.1 mtmt -67.25 -23.6 65.72 Favored 'General case' 0 CA--C 1.529 0.166 0 CA-C-O 118.776 -0.63 . . . . 0.0 111.592 178.579 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . 0.593 ' HE2' ' HA ' ' A' ' 31' ' ' LYS . 8.4 mmpt? -67.85 -58.39 4.66 Favored 'General case' 0 C--N 1.342 0.25 0 CA-C-N 119.218 0.917 . . . . 0.0 110.595 178.047 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.467 HD12 ' N ' ' A' ' 33' ' ' THR . 1.8 pp -74.94 -17.32 60.58 Favored 'General case' 0 CA--C 1.531 0.247 0 C-N-CA 119.286 -0.966 . . . . 0.0 111.552 -177.329 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . 0.467 ' N ' HD12 ' A' ' 32' ' ' LEU . 54.2 m -74.44 -38.13 63.1 Favored 'General case' 0 N--CA 1.455 -0.225 0 N-CA-C 109.509 -0.552 . . . . 0.0 109.509 177.211 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 98.4 m -73.15 -38.07 66.37 Favored 'General case' 0 N--CA 1.45 -0.46 0 N-CA-C 110.153 -0.314 . . . . 0.0 110.153 -178.555 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 27.3 t80 -64.23 -37.08 86.21 Favored 'General case' 0 N--CA 1.456 -0.149 0 N-CA-C 109.942 -0.392 . . . . 0.0 109.942 175.997 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -72.03 -38.63 69.51 Favored 'General case' 0 N--CA 1.448 -0.529 0 CA-C-O 119.462 -0.304 . . . . 0.0 111.429 178.081 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 9.9 mt -67.71 -36.1 80.0 Favored 'General case' 0 C--O 1.231 0.1 0 CA-C-N 118.217 0.462 . . . . 0.0 110.796 -179.757 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 42.6 t0 -71.0 -20.03 62.46 Favored 'General case' 0 N--CA 1.453 -0.291 0 C-N-CA 122.451 0.3 . . . . 0.0 111.358 177.199 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 39' ' ' HIS . . . . . 0.403 ' HB2' HD11 ' A' ' 42' ' ' ILE . 97.9 m-70 -148.69 97.74 2.77 Favored 'General case' 0 C--N 1.339 0.125 0 C-N-CA 122.852 0.461 . . . . 0.0 111.34 -175.036 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 40' ' ' ILE . . . . . 0.61 ' H ' HD13 ' A' ' 40' ' ' ILE . 0.0 OUTLIER -76.02 -12.29 14.42 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.454 0 C-N-CA 123.205 0.602 . . . . 0.0 110.866 176.551 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 19.7 m-20 -58.56 -21.11 51.73 Favored 'General case' 0 C--N 1.339 0.111 0 C-N-CA 122.925 0.49 . . . . 0.0 112.295 -176.793 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . 0.403 HD11 ' HB2' ' A' ' 39' ' ' HIS . 0.0 OUTLIER -104.1 12.93 7.61 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.208 0 C-N-CA 123.104 0.562 . . . . 0.0 112.211 178.353 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 2.9 pp20? -50.37 -33.32 20.09 Favored 'General case' 0 CA--C 1.53 0.21 0 CA-C-N 118.587 0.631 . . . . 0.0 111.766 -179.764 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 39.5 t -62.05 -49.93 74.01 Favored 'General case' 0 C--O 1.233 0.184 0 N-CA-C 111.912 0.338 . . . . 0.0 111.912 -178.047 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . 0.474 ' HD3' ' CD1' ' A' ' 7' ' ' PHE . 18.8 ptpt -70.98 -28.18 64.26 Favored 'General case' 0 C--N 1.339 0.128 0 O-C-N 121.85 -0.531 . . . . 0.0 109.778 -179.531 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 46' ' ' ILE . . . . . 0.414 HG12 ' CZ ' ' A' ' 10' ' ' PHE . 88.1 mt -68.7 -45.03 81.92 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.205 0 N-CA-C 110.049 -0.352 . . . . 0.0 110.049 -178.559 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 30.5 mm -62.72 -36.58 75.97 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.257 0 N-CA-C 109.024 -0.732 . . . . 0.0 109.024 177.309 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 39.4 t -64.63 -31.74 73.1 Favored 'General case' 0 CA--C 1.531 0.224 0 C-N-CA 120.984 -0.286 . . . . 0.0 111.729 179.023 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 6.7 mp -80.04 -31.97 39.5 Favored 'General case' 0 N--CA 1.451 -0.409 0 N-CA-C 113.265 0.839 . . . . 0.0 113.265 -179.698 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 12.5 pt -72.32 -38.46 61.45 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.207 0 CA-C-N 119.874 1.215 . . . . 0.0 110.708 177.558 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 24.4 pt -68.62 -35.22 69.13 Favored 'Isoleucine or valine' 0 CA--C 1.528 0.115 0 C-N-CA 120.336 -0.545 . . . . 0.0 110.032 176.981 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 21.0 t70 -59.3 -53.25 60.39 Favored 'General case' 0 C--N 1.339 0.134 0 CA-C-N 118.417 0.553 . . . . 0.0 110.053 174.858 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 53' ' ' TYR . . . . . 0.442 ' CE1' ' HG2' ' A' ' 18' ' ' LYS . 8.5 t80 -61.63 -44.53 96.81 Favored 'General case' 0 N--CA 1.451 -0.422 0 N-CA-C 109.836 -0.431 . . . . 0.0 109.836 -177.323 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 15.5 m -71.14 -23.03 62.0 Favored 'General case' 0 N--CA 1.453 -0.305 0 N-CA-C 112.196 0.443 . . . . 0.0 112.196 -175.264 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 18.4 tpp180 -84.11 -38.33 20.88 Favored 'General case' 0 N--CA 1.455 -0.216 0 CA-C-N 118.219 0.463 . . . . 0.0 110.642 179.359 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 95.9 mt -85.01 -50.01 7.82 Favored 'General case' 0 N--CA 1.452 -0.333 0 N-CA-C 113.188 0.81 . . . . 0.0 113.188 -175.884 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 5.8 p -66.33 153.87 91.71 Favored Pre-proline 0 CA--C 1.534 0.358 0 N-CA-C 113.647 0.981 . . . . 0.0 113.647 -170.39 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 67.8 Cg_endo -76.87 -170.72 0.96 Allowed 'Trans proline' 0 N--CA 1.455 -0.741 0 C-N-CA 124.837 3.691 . . . . 0.0 111.474 178.866 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 23.6 p-10 -53.82 -60.0 3.89 Favored 'General case' 0 CA--C 1.53 0.189 0 N-CA-C 114.55 1.315 . . . . 0.0 114.55 -170.732 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 22.6 t -67.64 -32.48 73.21 Favored 'General case' 0 N--CA 1.456 -0.134 0 CA-C-N 118.038 0.381 . . . . 0.0 110.947 -173.679 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 39.4 m80 -72.46 -26.55 61.86 Favored 'General case' 0 N--CA 1.453 -0.279 0 N-CA-C 110.035 -0.357 . . . . 0.0 110.035 177.131 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 17.1 ttmt -75.59 -28.52 58.96 Favored 'General case' 0 N--CA 1.451 -0.391 0 N-CA-C 110.113 -0.328 . . . . 0.0 110.113 177.041 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -65.05 -44.36 89.3 Favored 'General case' 0 N--CA 1.454 -0.227 0 N-CA-C 107.479 -1.304 . . . . 0.0 107.479 172.312 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -68.93 -25.3 75.42 Favored Glycine 0 C--N 1.34 0.758 0 N-CA-C 111.398 -0.681 . . . . 0.0 111.398 178.532 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 22.8 t -72.97 -40.32 65.42 Favored 'General case' 0 N--CA 1.452 -0.352 0 CA-C-N 117.782 0.791 . . . . 0.0 109.977 175.843 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 60.0 mt -68.57 -27.39 66.03 Favored 'General case' 0 N--CA 1.452 -0.342 0 N-CA-C 109.813 -0.44 . . . . 0.0 109.813 177.892 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 3.0 m-30 -66.01 -41.39 91.05 Favored 'General case' 0 CA--C 1.518 -0.269 0 N-CA-C 109.918 -0.401 . . . . 0.0 109.918 171.839 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 68' ' ' ILE . . . . . 0.41 ' CG1' HG12 ' A' ' 29' ' ' ILE . 21.0 mt -67.24 -45.32 86.49 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.585 0 N-CA-C 109.261 -0.644 . . . . 0.0 109.261 178.539 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 86.9 mt -58.87 -36.01 59.2 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.321 0 C-N-CA 123.273 0.629 . . . . 0.0 111.62 178.595 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 28.2 t70 -72.58 -40.82 66.29 Favored 'General case' 0 CA--C 1.517 -0.302 0 CA-C-N 119.015 0.825 . . . . 0.0 109.309 174.007 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 42.3 m -59.58 -66.63 0.48 Allowed 'General case' 0 N--CA 1.448 -0.547 0 N-CA-C 108.926 -0.768 . . . . 0.0 108.926 -178.36 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 72' ' ' ILE . . . . . 0.461 HD11 ' CZ ' ' A' ' 76' ' ' TYR . 0.0 OUTLIER -73.98 -44.4 50.86 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.363 0 CA-C-N 117.845 0.293 . . . . 0.0 111.014 -176.372 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -72.22 -49.8 19.55 Favored Glycine 0 CA--C 1.521 0.446 0 N-CA-C 112.418 -0.273 . . . . 0.0 112.418 -171.207 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 7.8 tmm_? -79.38 -30.26 42.46 Favored 'General case' 0 N--CA 1.445 -0.711 0 C-N-CA 119.814 -0.754 . . . . 0.0 110.256 -176.95 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -70.36 -25.54 63.32 Favored 'General case' 0 C--N 1.342 0.268 0 C-N-CA 118.646 -1.222 . . . . 0.0 109.795 173.458 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 76' ' ' TYR . . . . . 0.461 ' CZ ' HD11 ' A' ' 72' ' ' ILE . 1.4 m-30 -64.84 -49.3 71.15 Favored 'General case' 0 CA--C 1.515 -0.373 0 CA-C-N 118.75 0.704 . . . . 0.0 109.811 175.023 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . 0.462 HD13 ' O ' ' A' ' 77' ' ' LEU . 2.2 tm? -66.2 -43.95 85.33 Favored 'General case' 0 N--CA 1.447 -0.587 0 C-N-CA 118.219 -1.393 . . . . 0.0 108.711 -178.892 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 88.2 m-20 -59.3 -46.27 89.02 Favored 'General case' 0 CA--C 1.529 0.171 0 N-CA-C 112.318 0.488 . . . . 0.0 112.318 178.895 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 15.1 tm-20 -67.44 -48.89 65.91 Favored 'General case' 0 N--CA 1.45 -0.428 0 CA-C-N 118.34 0.518 . . . . 0.0 112.034 -178.081 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 64.4 p -64.57 -26.98 68.65 Favored 'General case' 0 N--CA 1.456 -0.147 0 CA-C-N 117.709 0.232 . . . . 0.0 111.312 179.965 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 11.9 ttm105 -75.5 -30.73 59.94 Favored 'General case' 0 N--CA 1.451 -0.392 0 CA-C-N 117.757 0.253 . . . . 0.0 110.341 175.383 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 35.3 t . . . . . 0 N--CA 1.455 -0.207 0 N-CA-C 112.408 0.521 . . . . 0.0 112.408 179.702 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 73.5 Cg_endo . . . . . 0 N--CA 1.455 -0.775 0 N-CA-C 110.237 -0.716 . . . . 0.0 110.237 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 89.7 19.48 47.98 Favored Glycine 0 CA--C 1.527 0.79 0 CA-C-O 119.362 -0.688 . . . . 0.0 112.242 179.925 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 20.3 p -153.16 168.87 24.49 Favored 'General case' 0 CA--C 1.521 -0.162 0 CA-C-N 117.89 0.845 . . . . 0.0 110.75 178.052 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 94' ' ' CYS . . . . . 0.417 ' HB2' HD13 ' A' ' 98' ' ' ILE . 29.5 p -57.94 -23.67 54.56 Favored 'General case' 0 N--CA 1.449 -0.515 0 CA-C-N 115.698 -0.683 . . . . 0.0 110.176 174.402 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -58.95 -57.85 11.23 Favored 'General case' 0 N--CA 1.451 -0.42 0 N-CA-C 109.361 -0.607 . . . . 0.0 109.361 -177.339 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 62.2 t60 -75.74 -32.01 59.81 Favored 'General case' 0 N--CA 1.451 -0.376 0 C-N-CA 121.094 -0.242 . . . . 0.0 111.639 -179.506 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -65.36 -48.88 71.42 Favored 'General case' 0 N--CA 1.45 -0.457 0 O-C-N 122.959 0.162 . . . . 0.0 111.053 -178.895 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 98' ' ' ILE . . . . . 0.417 HD13 ' HB2' ' A' ' 94' ' ' CYS . 1.8 mp -74.44 -27.71 21.63 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.162 0 CA-C-O 119.507 -0.282 . . . . 0.0 110.583 -179.886 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 3.9 m120 -64.23 -48.9 74.05 Favored 'General case' 0 N--CA 1.452 -0.339 0 CA-C-N 118.605 0.639 . . . . 0.0 110.163 173.902 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 26.4 m -74.64 -27.52 60.48 Favored 'General case' 0 N--CA 1.456 -0.164 0 N-CA-C 110.553 -0.166 . . . . 0.0 110.553 -175.947 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 57.0 tp -75.46 -47.97 24.79 Favored 'General case' 0 N--CA 1.448 -0.534 0 N-CA-C 110.272 -0.27 . . . . 0.0 110.272 177.027 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -65.81 -14.48 60.84 Favored Glycine 0 CA--C 1.528 0.846 0 CA-C-O 119.521 -0.6 . . . . 0.0 113.063 -173.33 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 24.2 pt-20 -95.98 -7.51 36.25 Favored 'General case' 0 CA--C 1.531 0.229 0 CA-C-N 118.297 1.049 . . . . 0.0 112.5 -178.482 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 27.3 m -129.97 -14.3 2.12 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.147 0 CA-C-N 118.542 0.61 . . . . 0.0 112.264 176.911 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 105' ' ' ILE . . . . . . . . . . . . . 9.7 tp -61.24 -22.62 27.86 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.137 0 CA-C-N 118.473 0.579 . . . . 0.0 110.7 -179.938 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 22.9 pt20 -64.79 -33.06 75.08 Favored 'General case' 0 N--CA 1.452 -0.359 0 C-N-CA 122.912 0.485 . . . . 0.0 110.445 177.145 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 82.9 mt-10 -75.61 -36.04 60.37 Favored 'General case' 0 N--CA 1.455 -0.218 0 CA-C-O 120.769 0.319 . . . . 0.0 110.171 177.991 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 50.2 mt -75.37 -37.42 60.61 Favored 'General case' 0 N--CA 1.448 -0.549 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.925 -177.359 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 67.0 mt -69.55 -57.13 5.59 Favored 'General case' 0 N--CA 1.452 -0.361 0 N-CA-C 109.909 -0.404 . . . . 0.0 109.909 177.377 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 6.4 p -46.07 -53.35 10.39 Favored 'General case' 0 CA--C 1.522 -0.121 0 C-N-CA 122.606 0.362 . . . . 0.0 111.434 179.294 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 34.4 t0 -61.66 -43.74 98.29 Favored 'General case' 0 N--CA 1.443 -0.784 0 N-CA-C 109.987 -0.375 . . . . 0.0 109.987 -179.954 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -65.6 -32.92 74.76 Favored 'General case' 0 N--CA 1.446 -0.636 0 C-N-CA 120.038 -0.665 . . . . 0.0 110.895 -176.984 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 113' ' ' ILE . . . . . . . . . . . . . 27.8 mm -68.28 -41.55 83.83 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.115 0 CA-C-N 118.984 0.811 . . . . 0.0 109.944 179.931 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -75.95 -39.39 56.15 Favored 'General case' 0 N--CA 1.454 -0.268 0 N-CA-C 112.033 0.383 . . . . 0.0 112.033 -179.711 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 1.3 tppp? -77.13 -33.03 56.8 Favored 'General case' 0 N--CA 1.449 -0.477 0 C-N-CA 123.966 0.906 . . . . 0.0 113.148 -175.086 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 116' ' ' SER . . . . . 0.467 ' HB2' ' CB ' ' A' ' 120' ' ' HIS . 51.7 p -84.89 160.68 20.1 Favored 'General case' 0 CA--C 1.53 0.2 0 N-CA-C 111.952 0.353 . . . . 0.0 111.952 -174.082 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 48.9 t30 -80.03 167.71 20.09 Favored 'General case' 0 CA--C 1.534 0.349 0 C-N-CA 122.901 0.48 . . . . 0.0 110.445 -179.618 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 118' ' ' GLN . . . . . . . . . . . . . 24.6 mm100 -52.64 -42.83 65.01 Favored 'General case' 0 CA--C 1.529 0.144 0 N-CA-C 112.954 0.724 . . . . 0.0 112.954 -173.047 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 11.1 p-10 -66.39 -35.71 81.01 Favored 'General case' 0 N--CA 1.456 -0.165 0 N-CA-C 110.223 -0.288 . . . . 0.0 110.223 179.296 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 120' ' ' HIS . . . . . 0.467 ' CB ' ' HB2' ' A' ' 116' ' ' SER . 25.6 m170 -68.98 -41.65 77.6 Favored 'General case' 0 N--CA 1.451 -0.423 0 CA-C-N 116.416 -0.357 . . . . 0.0 110.092 177.351 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 45.9 mttm -58.57 -39.24 79.74 Favored 'General case' 0 C--N 1.34 0.184 0 N-CA-C 109.371 -0.603 . . . . 0.0 109.371 178.813 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 1.8 tm-20 -65.51 -46.0 81.34 Favored 'General case' 0 N--CA 1.452 -0.331 0 C-N-CA 122.885 0.474 . . . . 0.0 110.756 -179.115 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 62.8 mttp -66.3 -31.45 72.25 Favored 'General case' 0 N--CA 1.455 -0.215 0 CA-C-N 117.741 0.246 . . . . 0.0 111.31 -179.782 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 124' ' ' ILE . . . . . . . . . . . . . 61.7 mt -74.59 -32.94 30.77 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.239 0 O-C-N 121.952 -0.468 . . . . 0.0 109.9 176.473 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -71.7 -36.86 70.68 Favored 'General case' 0 N--CA 1.455 -0.209 0 CA-C-O 119.163 -0.446 . . . . 0.0 111.492 179.032 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 126' ' ' MET . . . . . . . . . . . . . 28.2 ptm -68.14 -32.68 73.12 Favored 'General case' 0 CA--C 1.53 0.184 0 C-N-CA 119.148 -1.021 . . . . 0.0 109.243 174.648 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 4.0 mp -65.24 -32.73 74.55 Favored 'General case' 0 C--N 1.342 0.247 0 CA-C-O 119.474 -0.298 . . . . 0.0 110.321 171.926 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 44.2 tp -68.24 -43.09 78.68 Favored 'General case' 0 N--CA 1.455 -0.208 0 CA-C-N 118.165 0.439 . . . . 0.0 109.83 179.098 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 35.6 m-20 -60.06 -41.54 92.57 Favored 'General case' 0 N--CA 1.455 -0.208 0 N-CA-C 109.889 -0.411 . . . . 0.0 109.889 176.511 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 65.0 mt -63.26 -36.7 77.12 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.273 0 N-CA-C 109.989 -0.374 . . . . 0.0 109.989 179.116 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 131' ' ' TRP . . . . . . . . . . . . . 42.2 m0 . . . . . 0 N--CA 1.451 -0.406 0 N-CA-C 112.589 0.589 . . . . 0.0 112.589 -179.382 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 3.8 p30 . . . . . 0 N--CA 1.447 -0.607 0 N-CA-C 107.13 -1.433 . . . . 0.0 107.13 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 7' ' ' PHE . . . . . 0.482 ' CD1' ' HD3' ' A' ' 45' ' ' LYS . 1.3 t80 -62.55 -34.21 76.49 Favored 'General case' 0 N--CA 1.45 -0.475 0 C-N-CA 124.482 1.113 . . . . 0.0 108.998 172.657 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 51.5 tp60 -49.64 -36.37 24.33 Favored 'General case' 0 N--CA 1.453 -0.281 0 C-N-CA 124.953 1.301 . . . . 0.0 112.167 -177.481 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 22.9 m-80 -71.8 -34.48 69.41 Favored 'General case' 0 N--CA 1.454 -0.264 0 CA-C-O 120.801 0.334 . . . . 0.0 110.176 -179.524 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 10' ' ' PHE . . . . . 0.439 ' CZ ' HG12 ' A' ' 46' ' ' ILE . 1.6 t80 -70.98 -39.57 72.43 Favored 'General case' 0 N--CA 1.45 -0.45 0 C-N-CA 123.787 0.835 . . . . 0.0 109.107 177.451 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 95.2 t -66.42 -52.21 49.3 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.353 0 N-CA-C 109.164 -0.68 . . . . 0.0 109.164 178.666 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -59.12 -31.16 68.68 Favored 'General case' 0 N--CA 1.451 -0.389 0 C-N-CA 122.428 0.291 . . . . 0.0 111.486 -178.86 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 78.6 m -69.88 -37.45 76.05 Favored 'General case' 0 CA--C 1.531 0.214 0 N-CA-C 108.753 -0.832 . . . . 0.0 108.753 176.061 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.495 HD21 ' HB2' ' A' ' 53' ' ' TYR . 6.2 tp -66.73 -41.43 87.89 Favored 'General case' 0 N--CA 1.455 -0.203 0 CA-C-O 121.485 0.66 . . . . 0.0 110.488 178.742 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 63.3 mm-40 -64.82 -27.79 69.12 Favored 'General case' 0 N--CA 1.451 -0.417 0 C-N-CA 123.698 0.799 . . . . 0.0 109.08 178.027 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 5.3 p -71.75 -29.3 64.35 Favored 'General case' 0 N--CA 1.452 -0.346 0 N-CA-C 109.966 -0.383 . . . . 0.0 109.966 177.596 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 17' ' ' PHE . . . . . 0.502 ' CE1' HD11 ' A' ' 68' ' ' ILE . 24.3 m-85 -68.85 -34.32 75.27 Favored 'General case' 0 N--CA 1.457 -0.124 0 C-N-CA 119.718 -0.793 . . . . 0.0 110.395 171.536 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . 0.422 ' HA ' ' CE1' ' A' ' 61' ' ' HIS . 55.1 mttt -65.76 -26.3 67.66 Favored 'General case' 0 C--N 1.338 0.103 0 C-N-CA 120.395 -0.522 . . . . 0.0 110.153 176.112 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 40.3 t0 -73.48 -43.73 59.54 Favored 'General case' 0 CA--C 1.532 0.26 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.637 177.137 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 87.6 mt -65.12 146.66 54.69 Favored 'General case' 0 N--CA 1.456 -0.148 0 O-C-N 121.862 -0.524 . . . . 0.0 110.001 179.546 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -81.54 -32.5 32.25 Favored 'General case' 0 C--N 1.334 -0.076 0 N-CA-C 109.737 -0.468 . . . . 0.0 109.737 -179.916 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 14.1 m -79.22 -21.55 46.1 Favored 'General case' 0 N--CA 1.453 -0.289 0 C-N-CA 123.166 0.586 . . . . 0.0 110.738 175.487 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 72.74 -26.93 0.75 Allowed Glycine 0 CA--C 1.527 0.826 0 C-N-CA 124.578 1.085 . . . . 0.0 112.328 -178.792 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 74.3 mt -81.61 147.37 6.23 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.441 0 C-N-CA 123.396 0.678 . . . . 0.0 110.413 178.916 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 37.8 t -165.67 97.4 0.66 Allowed 'General case' 0 CA--C 1.517 -0.305 0 N-CA-C 108.42 -0.956 . . . . 0.0 108.42 173.606 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . 0.467 ' O ' ' HE2' ' A' ' 30' ' ' LYS . . . -55.84 -36.83 67.35 Favored Glycine 0 CA--C 1.527 0.796 0 N-CA-C 110.313 -1.115 . . . . 0.0 110.313 -176.497 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 88.5 p -62.27 -51.76 66.41 Favored 'General case' 0 N--CA 1.454 -0.274 0 CA-C-N 117.502 0.651 . . . . 0.0 110.123 -177.817 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 83.7 mtt180 -70.86 -40.97 72.0 Favored 'General case' 0 N--CA 1.455 -0.188 0 C-N-CA 123.626 0.77 . . . . 0.0 110.737 -178.71 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 64.0 mt -56.43 -42.01 73.74 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.707 0 N-CA-C 109.101 -0.703 . . . . 0.0 109.101 174.861 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . 0.467 ' HE2' ' O ' ' A' ' 26' ' ' GLY . 48.8 mtmt -67.81 -26.88 66.29 Favored 'General case' 0 C--N 1.34 0.194 0 CA-C-O 118.79 -0.624 . . . . 0.0 111.385 177.554 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . 0.49 ' HE3' ' HA ' ' A' ' 31' ' ' LYS . 0.0 OUTLIER -63.93 -56.56 14.32 Favored 'General case' 0 C--N 1.339 0.112 0 CA-C-N 119.187 0.903 . . . . 0.0 110.146 176.568 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.439 HD12 ' N ' ' A' ' 33' ' ' THR . 3.3 pp -75.21 -20.63 59.17 Favored 'General case' 0 CA--C 1.531 0.222 0 C-N-CA 119.662 -0.815 . . . . 0.0 111.419 -177.532 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . 0.439 ' N ' HD12 ' A' ' 32' ' ' LEU . 31.3 m -69.8 -41.68 74.71 Favored 'General case' 0 C--O 1.231 0.107 0 N-CA-C 108.28 -1.007 . . . . 0.0 108.28 175.96 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 97.5 m -68.44 -41.82 79.75 Favored 'General case' 0 N--CA 1.45 -0.46 0 N-CA-C 109.876 -0.416 . . . . 0.0 109.876 -178.751 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 52.7 t80 -62.89 -32.12 73.32 Favored 'General case' 0 C--N 1.337 0.046 0 N-CA-C 109.972 -0.381 . . . . 0.0 109.972 177.475 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -72.97 -28.72 62.57 Favored 'General case' 0 N--CA 1.447 -0.62 0 CA-C-O 119.491 -0.29 . . . . 0.0 111.061 178.999 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 2.2 mm? -79.78 -33.93 40.14 Favored 'General case' 0 CA--C 1.519 -0.224 0 N-CA-C 109.009 -0.737 . . . . 0.0 109.009 -178.371 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 81.2 m-20 -66.32 -17.25 64.65 Favored 'General case' 0 N--CA 1.443 -0.818 0 C-N-CA 123.892 0.877 . . . . 0.0 111.188 173.966 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 96.5 m-70 -152.52 90.78 1.52 Allowed 'General case' 0 N--CA 1.453 -0.286 0 C-N-CA 123.904 0.882 . . . . 0.0 110.681 -176.87 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 40' ' ' ILE . . . . . 0.567 ' H ' HD13 ' A' ' 40' ' ' ILE . 0.0 OUTLIER -71.23 -18.39 20.4 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.29 0 CA-C-N 119.235 0.925 . . . . 0.0 108.526 172.374 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 7.7 m-20 -44.84 -41.78 7.36 Favored 'General case' 0 N--CA 1.455 -0.212 0 C-N-CA 125.817 1.647 . . . . 0.0 112.806 -179.525 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . 0.402 HD13 HD11 ' A' ' 46' ' ' ILE . 1.4 pp -101.07 16.73 4.14 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.57 0 C-N-CA 124.151 0.98 . . . . 0.0 111.742 -173.283 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . 0.44 ' HA ' HD12 ' A' ' 46' ' ' ILE . 3.0 pp20? -52.97 -32.96 48.95 Favored 'General case' 0 CA--C 1.529 0.14 0 O-C-N 122.076 -0.39 . . . . 0.0 111.205 176.759 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 47.8 t -59.71 -46.14 90.0 Favored 'General case' 0 CA--C 1.53 0.211 0 O-C-N 122.273 -0.267 . . . . 0.0 111.654 -177.326 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . 0.482 ' HD3' ' CD1' ' A' ' 7' ' ' PHE . 18.4 ptpt -75.09 -23.03 57.91 Favored 'General case' 0 C--N 1.341 0.223 0 C-N-CA 121.006 -0.278 . . . . 0.0 110.547 179.434 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 46' ' ' ILE . . . . . 0.44 HD12 ' HA ' ' A' ' 43' ' ' GLU . 77.0 mt -73.88 -50.13 30.67 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.253 0 N-CA-C 110.18 -0.304 . . . . 0.0 110.18 -179.92 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 46.0 mm -67.32 -37.25 78.69 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.431 0 O-C-N 123.357 0.41 . . . . 0.0 110.364 -177.302 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 22.6 t -67.5 -39.7 85.19 Favored 'General case' 0 N--CA 1.452 -0.346 0 C-N-CA 119.351 -0.94 . . . . 0.0 109.818 176.939 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . 0.467 ' HG ' HD22 ' A' ' 14' ' ' LEU . 53.4 tp -69.33 -35.48 75.98 Favored 'General case' 0 N--CA 1.449 -0.507 0 CA-C-O 119.162 -0.447 . . . . 0.0 111.832 -174.444 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . 0.472 HD12 HG12 ' A' ' 69' ' ' ILE . 3.9 pt -72.07 -44.68 65.36 Favored 'Isoleucine or valine' 0 C--N 1.34 0.163 0 CA-C-N 118.834 0.743 . . . . 0.0 110.855 178.032 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 30.9 pt -66.16 -39.06 83.35 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.141 0 C-N-CA 119.559 -0.856 . . . . 0.0 111.064 179.628 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 88.9 m-20 -64.86 -45.21 87.01 Favored 'General case' 0 N--CA 1.452 -0.338 0 CA-C-N 117.958 0.344 . . . . 0.0 110.749 178.959 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 53' ' ' TYR . . . . . 0.495 ' HB2' HD21 ' A' ' 14' ' ' LEU . 3.2 t80 -65.04 -34.79 79.27 Favored 'General case' 0 N--CA 1.456 -0.16 0 N-CA-C 109.326 -0.62 . . . . 0.0 109.326 175.867 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 28.7 t -62.37 -34.72 77.24 Favored 'General case' 0 N--CA 1.454 -0.261 0 CA-C-N 117.878 0.308 . . . . 0.0 111.082 -178.692 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . 0.431 ' NE ' ' HA ' ' A' ' 55' ' ' ARG . 11.8 mmp_? -75.42 -46.41 32.94 Favored 'General case' 0 C--N 1.34 0.183 0 CA-C-N 118.489 0.586 . . . . 0.0 111.525 177.709 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 30.5 mt -75.23 -41.25 57.98 Favored 'General case' 0 C--O 1.227 -0.085 0 N-CA-C 112.92 0.711 . . . . 0.0 112.92 -173.253 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 13.2 p -63.66 155.53 75.93 Favored Pre-proline 0 CA--C 1.535 0.391 0 N-CA-C 112.607 0.595 . . . . 0.0 112.607 -174.857 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 87.2 Cg_endo -74.57 173.04 15.0 Favored 'Trans proline' 0 N--CA 1.453 -0.876 0 C-N-CA 124.746 3.631 . . . . 0.0 111.668 -179.433 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -46.57 -52.8 12.71 Favored 'General case' 0 N--CA 1.452 -0.328 0 C-N-CA 125.407 1.483 . . . . 0.0 113.952 -170.744 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 95.1 p -68.14 -31.86 71.74 Favored 'General case' 0 N--CA 1.457 -0.089 0 O-C-N 121.915 -0.491 . . . . 0.0 110.111 -177.154 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 61' ' ' HIS . . . . . 0.422 ' CE1' ' HA ' ' A' ' 18' ' ' LYS . 37.0 m170 -75.34 -24.93 57.43 Favored 'General case' 0 N--CA 1.45 -0.431 0 N-CA-C 109.923 -0.399 . . . . 0.0 109.923 179.395 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 67.7 mttm -67.05 -40.4 87.14 Favored 'General case' 0 C--N 1.34 0.184 0 N-CA-C 109.246 -0.65 . . . . 0.0 109.246 173.292 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -60.79 -40.8 93.97 Favored 'General case' 0 CA--C 1.533 0.29 0 N-CA-C 108.458 -0.941 . . . . 0.0 108.458 175.548 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -67.62 -30.58 74.94 Favored Glycine 0 CA--C 1.528 0.876 0 N-CA-C 111.727 -0.549 . . . . 0.0 111.727 178.442 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 35.6 p -66.94 -35.12 79.27 Favored 'General case' 0 N--CA 1.456 -0.153 0 CA-C-N 117.805 0.803 . . . . 0.0 109.637 178.217 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . 0.434 HD21 ' CD2' ' A' ' 108' ' ' LEU . 43.0 mt -73.94 -30.51 62.59 Favored 'General case' 0 N--CA 1.453 -0.277 0 C-N-CA 122.346 0.258 . . . . 0.0 110.579 177.424 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 2.6 m-85 -68.93 -36.44 77.97 Favored 'General case' 0 CA--C 1.518 -0.265 0 CA-C-N 117.75 0.25 . . . . 0.0 110.776 176.577 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 68' ' ' ILE . . . . . 0.502 HD11 ' CE1' ' A' ' 17' ' ' PHE . 16.3 mt -69.51 -51.52 41.15 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.484 0 C-N-CA 119.631 -0.827 . . . . 0.0 108.776 178.536 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 69' ' ' ILE . . . . . 0.472 HG12 HD12 ' A' ' 50' ' ' ILE . 77.2 mt -48.47 -37.45 7.98 Favored 'Isoleucine or valine' 0 C--N 1.341 0.224 0 O-C-N 123.574 0.546 . . . . 0.0 111.161 172.355 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 19.9 t70 -70.9 -48.16 55.23 Favored 'General case' 0 C--O 1.233 0.202 0 CA-C-N 118.863 0.756 . . . . 0.0 111.096 179.418 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 30.8 t -65.11 -51.45 61.25 Favored 'General case' 0 N--CA 1.451 -0.404 0 C-N-CA 122.447 0.299 . . . . 0.0 111.251 -176.4 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 72' ' ' ILE . . . . . 0.422 HD11 ' CZ ' ' A' ' 76' ' ' TYR . 0.0 OUTLIER -75.82 -32.62 24.25 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.234 0 N-CA-C 109.89 -0.411 . . . . 0.0 109.89 -178.557 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -69.19 -46.49 57.56 Favored Glycine 0 CA--C 1.523 0.558 0 N-CA-C 111.419 -0.672 . . . . 0.0 111.419 -176.531 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 37.5 mtm105 -69.47 -42.01 75.41 Favored 'General case' 0 CA--C 1.515 -0.395 0 CA-C-N 117.694 0.747 . . . . 0.0 110.09 177.641 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -62.83 -31.32 72.31 Favored 'General case' 0 N--CA 1.448 -0.528 0 C-N-CA 119.996 -0.682 . . . . 0.0 110.306 -179.194 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 76' ' ' TYR . . . . . 0.422 ' CZ ' HD11 ' A' ' 72' ' ' ILE . 2.3 m-30 -72.29 -56.38 5.6 Favored 'General case' 0 CA--C 1.518 -0.281 0 CA-C-N 118.149 0.431 . . . . 0.0 111.065 175.428 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 53.8 tp -63.87 -40.88 97.58 Favored 'General case' 0 N--CA 1.447 -0.577 0 C-N-CA 117.885 -1.526 . . . . 0.0 109.948 -175.265 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 95.8 m-20 -60.69 -50.97 71.35 Favored 'General case' 0 N--CA 1.454 -0.24 0 CA-C-O 118.693 -0.67 . . . . 0.0 112.389 -179.843 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 68.0 mm-40 -72.52 -35.73 68.16 Favored 'General case' 0 N--CA 1.455 -0.196 0 CA-C-N 119.385 0.993 . . . . 0.0 112.078 -177.357 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 80.5 p -72.11 -30.63 65.26 Favored 'General case' 0 N--CA 1.451 -0.404 0 C-N-CA 120.18 -0.608 . . . . 0.0 110.579 179.493 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 7.4 ttm105 -82.71 -29.6 29.74 Favored 'General case' 0 CA--C 1.531 0.224 0 C-N-CA 123.649 0.78 . . . . 0.0 112.159 177.76 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 44.2 m . . . . . 0 CA--C 1.528 0.111 0 N-CA-C 112.645 0.609 . . . . 0.0 112.645 -179.102 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 82.1 Cg_endo . . . . . 0 N--CA 1.454 -0.809 0 N-CA-C 110.522 -0.607 . . . . 0.0 110.522 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 83.59 20.63 59.66 Favored Glycine 0 CA--C 1.526 0.773 0 CA-C-O 119.775 -0.458 . . . . 0.0 112.448 177.442 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -158.28 167.16 30.51 Favored 'General case' 0 N--CA 1.451 -0.392 0 C-N-CA 124.281 1.033 . . . . 0.0 109.528 179.94 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 94' ' ' CYS . . . . . 0.569 ' SG ' HD13 ' A' ' 98' ' ' ILE . 2.0 t -52.37 -28.06 18.07 Favored 'General case' 0 N--CA 1.454 -0.241 0 C-N-CA 123.82 0.848 . . . . 0.0 110.816 175.176 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -52.94 -62.57 1.57 Allowed 'General case' 0 N--CA 1.448 -0.548 0 O-C-N 122.497 -0.127 . . . . 0.0 111.086 -178.239 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 76.4 t60 -73.56 -32.98 64.45 Favored 'General case' 0 N--CA 1.453 -0.323 0 O-C-N 122.27 -0.269 . . . . 0.0 110.954 -178.308 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -64.04 -53.58 47.66 Favored 'General case' 0 N--CA 1.451 -0.397 0 O-C-N 122.934 0.147 . . . . 0.0 111.183 -177.252 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 98' ' ' ILE . . . . . 0.569 HD13 ' SG ' ' A' ' 94' ' ' CYS . 1.7 mp -69.88 -34.55 60.77 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.166 0 N-CA-C 109.83 -0.433 . . . . 0.0 109.83 -179.81 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 59.6 m-20 -62.07 -42.39 99.15 Favored 'General case' 0 N--CA 1.456 -0.168 0 O-C-N 122.163 -0.336 . . . . 0.0 110.6 178.102 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 98.0 m -64.23 -41.28 97.08 Favored 'General case' 0 N--CA 1.454 -0.249 0 N-CA-C 109.9 -0.407 . . . . 0.0 109.9 -178.653 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 90.8 mt -68.98 -24.1 64.2 Favored 'General case' 0 N--CA 1.452 -0.329 0 CA-C-N 116.426 -0.352 . . . . 0.0 111.389 179.882 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -73.73 -25.59 71.63 Favored Glycine 0 CA--C 1.527 0.833 0 CA-C-O 119.551 -0.583 . . . . 0.0 113.518 -178.212 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 74.1 mm-40 -81.08 -45.55 16.32 Favored 'General case' 0 N--CA 1.453 -0.294 0 CA-C-N 118.3 1.05 . . . . 0.0 111.996 179.35 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 18.1 m -85.26 6.69 2.19 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.14 0 C-N-CA 123.641 0.777 . . . . 0.0 111.097 -175.79 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 105' ' ' ILE . . . . . . . . . . . . . 9.7 tp -62.0 -37.0 77.25 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.354 0 C-N-CA 122.125 0.17 . . . . 0.0 110.795 -174.464 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 16.5 pt20 -76.05 -35.67 59.35 Favored 'General case' 0 N--CA 1.451 -0.404 0 CA-C-O 119.14 -0.457 . . . . 0.0 111.153 -177.231 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 59.3 mp0 -74.7 -39.36 61.99 Favored 'General case' 0 N--CA 1.451 -0.382 0 CA-C-N 118.814 0.734 . . . . 0.0 110.449 -179.684 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 108' ' ' LEU . . . . . 0.434 ' CD2' HD21 ' A' ' 66' ' ' LEU . 7.6 tt -73.5 -41.38 63.17 Favored 'General case' 0 N--CA 1.45 -0.475 0 CA-C-O 119.672 -0.204 . . . . 0.0 111.326 -174.774 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 9.6 mp -73.43 -49.9 24.53 Favored 'General case' 0 C--O 1.225 -0.203 0 C-N-CA 120.534 -0.466 . . . . 0.0 110.012 179.148 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 23.3 t -55.32 -39.47 70.0 Favored 'General case' 0 N--CA 1.454 -0.231 0 CA-C-N 118.334 0.515 . . . . 0.0 111.109 -177.452 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 36.9 t0 -62.4 -49.33 75.94 Favored 'General case' 0 N--CA 1.454 -0.264 0 N-CA-C 109.067 -0.716 . . . . 0.0 109.067 175.423 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -66.69 -35.72 80.8 Favored 'General case' 0 N--CA 1.446 -0.657 0 CA-C-O 119.031 -0.509 . . . . 0.0 112.097 -175.457 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 113' ' ' ILE . . . . . . . . . . . . . 20.6 mm -70.26 -40.71 78.28 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.213 0 CA-C-N 119.315 0.961 . . . . 0.0 110.209 -178.936 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -74.35 -40.38 62.19 Favored 'General case' 0 N--CA 1.451 -0.377 0 C-N-CA 121.288 -0.165 . . . . 0.0 111.385 -179.421 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 115' ' ' LYS . . . . . 0.614 ' HE2' ' HA ' ' A' ' 115' ' ' LYS . 0.6 OUTLIER -75.58 -39.31 58.25 Favored 'General case' 0 N--CA 1.449 -0.485 0 N-CA-C 113.341 0.867 . . . . 0.0 113.341 -178.516 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 116' ' ' SER . . . . . 0.477 ' HB2' ' CB ' ' A' ' 120' ' ' HIS . 44.4 p -80.5 161.3 24.91 Favored 'General case' 0 N--CA 1.455 -0.198 0 N-CA-C 112.425 0.528 . . . . 0.0 112.425 -172.52 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 22.6 m120 -88.64 178.02 6.61 Favored 'General case' 0 C--O 1.227 -0.1 0 C-N-CA 123.435 0.694 . . . . 0.0 112.59 -177.367 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 118' ' ' GLN . . . . . . . . . . . . . 2.9 pt20 -49.21 -55.09 13.65 Favored 'General case' 0 N--CA 1.456 -0.128 0 C-N-CA 123.633 0.773 . . . . 0.0 112.937 -177.661 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 21.9 t70 -56.59 -33.98 66.75 Favored 'General case' 0 C--O 1.23 0.052 0 CA-C-N 118.451 0.569 . . . . 0.0 110.104 -179.993 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 120' ' ' HIS . . . . . 0.477 ' CB ' ' HB2' ' A' ' 116' ' ' SER . 15.9 m170 -75.05 -41.41 59.17 Favored 'General case' 0 N--CA 1.449 -0.489 0 N-CA-C 109.932 -0.395 . . . . 0.0 109.932 -177.571 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 62.1 mttp -58.08 -37.97 75.48 Favored 'General case' 0 N--CA 1.455 -0.202 0 N-CA-C 110.228 -0.286 . . . . 0.0 110.228 179.88 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 81.6 mm-40 -68.86 -46.24 69.0 Favored 'General case' 0 N--CA 1.449 -0.486 0 C-N-CA 122.72 0.408 . . . . 0.0 110.299 179.033 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 97.4 mttt -64.55 -31.33 72.5 Favored 'General case' 0 N--CA 1.453 -0.307 0 CA-C-N 115.75 -0.659 . . . . 0.0 111.07 -178.698 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 124' ' ' ILE . . . . . . . . . . . . . 58.4 mt -75.62 -38.47 38.4 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.242 0 O-C-N 121.791 -0.568 . . . . 0.0 110.132 176.761 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 22.9 mtp180 -67.49 -33.11 74.44 Favored 'General case' 0 N--CA 1.453 -0.277 0 N-CA-C 112.385 0.513 . . . . 0.0 112.385 178.14 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 126' ' ' MET . . . . . . . . . . . . . 28.1 ptm -72.5 -33.82 67.2 Favored 'General case' 0 N--CA 1.455 -0.207 0 C-N-CA 119.489 -0.884 . . . . 0.0 108.686 174.328 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 2.6 mp -63.33 -38.23 90.34 Favored 'General case' 0 C--N 1.34 0.163 0 N-CA-C 109.896 -0.409 . . . . 0.0 109.896 175.19 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 57.4 tp -64.24 -42.62 96.45 Favored 'General case' 0 N--CA 1.453 -0.285 0 CA-C-N 117.747 0.249 . . . . 0.0 110.335 179.614 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 18.9 t0 -63.82 -46.64 84.19 Favored 'General case' 0 N--CA 1.455 -0.178 0 N-CA-C 109.855 -0.424 . . . . 0.0 109.855 177.697 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 54.8 mt -56.37 -35.81 44.72 Favored 'Isoleucine or valine' 0 C--O 1.235 0.296 0 N-CA-C 110.257 -0.275 . . . . 0.0 110.257 179.931 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 131' ' ' TRP . . . . . . . . . . . . . 47.6 m0 . . . . . 0 N--CA 1.45 -0.462 0 N-CA-C 112.635 0.606 . . . . 0.0 112.635 -179.536 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 31.3 p-10 . . . . . 0 N--CA 1.454 -0.256 0 N-CA-C 110.283 -0.265 . . . . 0.0 110.283 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 7' ' ' PHE . . . . . 0.514 ' CD1' ' HD3' ' A' ' 45' ' ' LYS . 1.3 t80 -57.28 -41.84 80.53 Favored 'General case' 0 N--CA 1.451 -0.376 0 C-N-CA 123.496 0.718 . . . . 0.0 111.714 -179.658 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 46.1 tp60 -53.73 -33.94 57.27 Favored 'General case' 0 N--CA 1.456 -0.127 0 C-N-CA 122.777 0.431 . . . . 0.0 111.653 -176.537 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 18.8 m-80 -70.92 -31.12 67.63 Favored 'General case' 0 N--CA 1.451 -0.398 0 N-CA-C 109.944 -0.391 . . . . 0.0 109.944 -179.964 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 10' ' ' PHE . . . . . 0.467 ' CE2' ' HB2' ' A' ' 32' ' ' LEU . 10.9 t80 -71.54 -39.02 70.97 Favored 'General case' 0 N--CA 1.452 -0.343 0 N-CA-C 109.419 -0.586 . . . . 0.0 109.419 176.189 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 57.5 t -63.15 -55.83 21.01 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.359 0 N-CA-C 109.18 -0.674 . . . . 0.0 109.18 179.059 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -60.24 -29.22 68.62 Favored 'General case' 0 N--CA 1.453 -0.291 0 C-N-CA 123.277 0.631 . . . . 0.0 112.161 -179.922 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 99.9 m -72.62 -39.74 67.02 Favored 'General case' 0 CA--C 1.53 0.211 0 CA-C-N 118.904 0.775 . . . . 0.0 109.403 177.268 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.485 ' HA ' ' CD1' ' A' ' 17' ' ' PHE . 14.2 tp -65.23 -46.71 79.51 Favored 'General case' 0 N--CA 1.454 -0.233 0 CA-C-O 121.644 0.735 . . . . 0.0 109.467 178.192 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 69.0 mm-40 -63.4 -29.58 70.85 Favored 'General case' 0 N--CA 1.45 -0.443 0 C-N-CA 124.136 0.974 . . . . 0.0 110.048 178.898 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 42.3 t -69.46 -32.24 71.04 Favored 'General case' 0 N--CA 1.452 -0.336 0 N-CA-C 109.679 -0.489 . . . . 0.0 109.679 177.375 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 17' ' ' PHE . . . . . 0.485 ' CD1' ' HA ' ' A' ' 14' ' ' LEU . 19.7 m-85 -63.61 -42.05 98.25 Favored 'General case' 0 N--CA 1.454 -0.25 0 C-N-CA 119.388 -0.925 . . . . 0.0 109.604 172.559 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 67.1 mttt -61.82 -28.54 69.55 Favored 'General case' 0 C--N 1.341 0.2 0 O-C-N 122.985 0.178 . . . . 0.0 110.833 -178.776 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 54.5 t0 -73.95 -43.62 57.63 Favored 'General case' 0 N--CA 1.455 -0.177 0 O-C-N 123.48 0.488 . . . . 0.0 111.019 178.829 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . 0.442 HD12 ' HB2' ' A' ' 25' ' ' SER . 63.6 mt -57.82 144.13 39.75 Favored 'General case' 0 N--CA 1.454 -0.228 0 O-C-N 122.048 -0.408 . . . . 0.0 111.073 -177.157 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -83.7 -22.86 31.92 Favored 'General case' 0 N--CA 1.453 -0.323 0 N-CA-C 109.652 -0.499 . . . . 0.0 109.652 177.001 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 22' ' ' SER . . . . . 0.418 ' C ' ' H ' ' A' ' 24' ' ' ILE . 68.8 m -75.36 -24.09 57.26 Favored 'General case' 0 N--CA 1.456 -0.148 0 N-CA-C 109.832 -0.433 . . . . 0.0 109.832 170.335 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 70.64 -31.69 0.48 Allowed Glycine 0 CA--C 1.527 0.799 0 C-N-CA 124.883 1.23 . . . . 0.0 112.103 179.689 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . 0.418 ' H ' ' C ' ' A' ' 22' ' ' SER . 47.2 mt -87.23 154.95 3.28 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.523 0 C-N-CA 123.801 0.841 . . . . 0.0 109.143 173.881 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . 0.442 ' HB2' HD12 ' A' ' 20' ' ' LEU . 32.7 t -158.29 81.46 0.83 Allowed 'General case' 0 CA--C 1.517 -0.319 0 N-CA-C 109.886 -0.413 . . . . 0.0 109.886 177.82 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -50.58 -33.01 25.13 Favored Glycine 0 CA--C 1.529 0.927 0 CA-C-O 119.499 -0.612 . . . . 0.0 112.43 -175.442 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 40.3 t -73.13 -52.39 14.38 Favored 'General case' 0 N--CA 1.453 -0.298 0 CA-C-N 118.205 1.003 . . . . 0.0 110.771 -179.709 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 82.6 mtt85 -69.88 -31.74 69.71 Favored 'General case' 0 C--N 1.34 0.189 0 CA-C-N 117.544 0.156 . . . . 0.0 110.681 -177.491 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 53.0 mt -59.77 -45.81 94.28 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.724 0 N-CA-C 108.164 -1.05 . . . . 0.0 108.164 174.423 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 33.5 mtmm -68.22 -23.32 64.8 Favored 'General case' 0 N--CA 1.454 -0.234 0 CA-C-O 118.606 -0.711 . . . . 0.0 111.869 177.06 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . 0.413 ' HE3' ' HA ' ' A' ' 31' ' ' LYS . 0.0 OUTLIER -65.04 -59.4 4.19 Favored 'General case' 0 C--N 1.341 0.197 0 CA-C-N 119.341 0.973 . . . . 0.0 110.281 177.777 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.487 HD12 ' N ' ' A' ' 33' ' ' THR . 1.2 pp -75.29 -17.94 60.17 Favored 'General case' 0 CA--C 1.531 0.245 0 C-N-CA 119.47 -0.892 . . . . 0.0 112.068 -177.271 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . 0.487 ' N ' HD12 ' A' ' 32' ' ' LEU . 55.2 m -72.66 -38.75 67.55 Favored 'General case' 0 N--CA 1.457 -0.123 0 N-CA-C 108.898 -0.779 . . . . 0.0 108.898 175.684 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 98.8 m -70.4 -37.4 74.46 Favored 'General case' 0 N--CA 1.453 -0.321 0 N-CA-C 109.861 -0.422 . . . . 0.0 109.861 179.995 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 19.8 t80 -61.64 -38.26 87.05 Favored 'General case' 0 C--N 1.34 0.159 0 N-CA-C 109.962 -0.385 . . . . 0.0 109.962 175.359 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -68.07 -37.54 81.38 Favored 'General case' 0 N--CA 1.447 -0.621 0 CA-C-N 116.791 -0.186 . . . . 0.0 110.945 -179.331 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 3.2 mm? -71.05 -35.97 72.15 Favored 'General case' 0 CA--C 1.522 -0.114 0 C-N-CA 122.096 0.158 . . . . 0.0 110.948 -179.369 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 41.5 t0 -72.86 -14.62 61.53 Favored 'General case' 0 N--CA 1.452 -0.337 0 C-N-CA 122.472 0.309 . . . . 0.0 110.588 177.238 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 96.6 m-70 -151.52 88.99 1.45 Allowed 'General case' 0 CA--C 1.53 0.192 0 C-N-CA 122.935 0.494 . . . . 0.0 111.411 -173.897 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -75.42 -12.71 14.88 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.232 0 O-C-N 122.023 -0.423 . . . . 0.0 111.024 175.707 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -57.24 -24.38 54.33 Favored 'General case' 0 C--O 1.228 -0.045 0 C-N-CA 123.34 0.656 . . . . 0.0 111.762 -176.404 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -106.98 18.63 5.77 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.24 0 C-N-CA 123.291 0.637 . . . . 0.0 112.58 178.768 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 3.0 pp20? -54.0 -28.61 39.03 Favored 'General case' 0 CA--C 1.528 0.129 0 CA-C-N 118.723 0.692 . . . . 0.0 111.7 177.848 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 29.6 t -65.39 -46.14 81.27 Favored 'General case' 0 N--CA 1.452 -0.335 0 O-C-N 122.384 -0.198 . . . . 0.0 110.936 -176.199 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . 0.514 ' HD3' ' CD1' ' A' ' 7' ' ' PHE . 19.2 ptpt -74.69 -26.9 60.15 Favored 'General case' 0 C--N 1.339 0.13 0 N-CA-C 109.566 -0.531 . . . . 0.0 109.566 177.908 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 61.0 mt -68.63 -48.8 69.88 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.228 0 N-CA-C 109.823 -0.436 . . . . 0.0 109.823 -179.036 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 47' ' ' ILE . . . . . 0.435 HD13 HD11 ' A' ' 50' ' ' ILE . 35.4 mm -63.84 -38.25 81.86 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.249 0 N-CA-C 109.065 -0.717 . . . . 0.0 109.065 176.944 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 49.8 m -63.33 -42.64 98.99 Favored 'General case' 0 CA--C 1.531 0.23 0 C-N-CA 120.82 -0.352 . . . . 0.0 111.5 -178.345 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 6.9 mp -73.51 -36.35 65.72 Favored 'General case' 0 N--CA 1.453 -0.276 0 N-CA-C 112.652 0.612 . . . . 0.0 112.652 -176.332 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . 0.468 HD12 HG12 ' A' ' 69' ' ' ILE . 5.5 pt -71.63 -44.4 69.76 Favored 'Isoleucine or valine' 0 C--N 1.34 0.169 0 CA-C-N 119.352 0.978 . . . . 0.0 110.846 -178.55 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 51' ' ' ILE . . . . . 0.526 HG22 HD11 ' A' ' 108' ' ' LEU . 16.2 pt -66.12 -38.04 81.1 Favored 'Isoleucine or valine' 0 C--N 1.335 -0.055 0 C-N-CA 120.192 -0.603 . . . . 0.0 110.785 -179.783 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 90.7 m-20 -70.86 -41.07 71.9 Favored 'General case' 0 N--CA 1.454 -0.274 0 CA-C-N 118.107 0.412 . . . . 0.0 111.756 178.365 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 18.8 t80 -63.61 -41.3 98.32 Favored 'General case' 0 N--CA 1.455 -0.182 0 N-CA-C 109.081 -0.711 . . . . 0.0 109.081 175.93 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 23.3 t -62.25 -38.91 91.05 Favored 'General case' 0 N--CA 1.45 -0.462 0 C-N-CA 122.437 0.295 . . . . 0.0 111.435 -176.64 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 55.6 mtm180 -75.12 -40.88 59.47 Favored 'General case' 0 N--CA 1.456 -0.156 0 N-CA-C 111.913 0.338 . . . . 0.0 111.913 -177.239 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 48.7 mt -80.46 -44.52 19.1 Favored 'General case' 0 N--CA 1.455 -0.206 0 N-CA-C 113.221 0.823 . . . . 0.0 113.221 -176.023 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 14.5 p -62.68 159.45 43.58 Favored Pre-proline 0 CA--C 1.535 0.382 0 N-CA-C 114.241 1.2 . . . . 0.0 114.241 -170.701 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 35.9 Cg_exo -58.79 -179.51 0.15 Allowed 'Trans proline' 0 N--CA 1.454 -0.822 1 C-N-CA 125.758 4.306 . . . . 0.0 113.746 174.423 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 42.3 p-10 -66.4 -42.65 87.52 Favored 'General case' 0 CA--C 1.533 0.298 0 C-N-CA 124.534 1.134 . . . . 0.0 113.364 -175.013 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 39.8 m -72.75 -37.03 67.81 Favored 'General case' 0 N--CA 1.455 -0.189 0 O-C-N 121.773 -0.58 . . . . 0.0 109.762 179.74 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 55.4 m80 -69.02 -27.87 66.06 Favored 'General case' 0 N--CA 1.45 -0.425 0 CA-C-N 116.176 -0.465 . . . . 0.0 109.867 176.025 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . 0.487 ' HE3' ' HB2' ' A' ' 112' ' ' ALA . 56.4 tptt -65.88 -45.39 82.24 Favored 'General case' 0 C--N 1.338 0.108 0 C-N-CA 122.623 0.369 . . . . 0.0 110.025 177.877 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . 0.515 HD12 ' CD2' ' A' ' 120' ' ' HIS . 0.3 OUTLIER -61.29 -41.94 97.82 Favored 'General case' 0 N--CA 1.455 -0.213 0 N-CA-C 108.458 -0.941 . . . . 0.0 108.458 177.641 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -65.22 -29.26 74.87 Favored Glycine 0 CA--C 1.527 0.791 0 N-CA-C 111.964 -0.454 . . . . 0.0 111.964 178.554 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 37.0 p -68.7 -37.1 79.26 Favored 'General case' 0 N--CA 1.451 -0.375 0 CA-C-N 117.931 0.866 . . . . 0.0 110.062 178.462 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 95.1 mt -75.32 -24.81 57.47 Favored 'General case' 0 N--CA 1.452 -0.338 0 CA-C-N 116.596 -0.275 . . . . 0.0 110.726 178.98 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 9.6 m-30 -70.69 -36.01 73.08 Favored 'General case' 0 CA--C 1.515 -0.374 0 CA-C-N 118.338 0.517 . . . . 0.0 110.422 174.007 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 68' ' ' ILE . . . . . 0.472 HD11 ' CE1' ' A' ' 17' ' ' PHE . 22.0 mt -68.29 -54.3 22.76 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.621 0 N-CA-C 107.448 -1.315 . . . . 0.0 107.448 177.69 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 69' ' ' ILE . . . . . 0.468 HG12 HD12 ' A' ' 50' ' ' ILE . 65.5 mt -50.39 -37.14 14.28 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.174 0 C-N-CA 123.885 0.874 . . . . 0.0 111.802 175.021 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 8.8 t70 -71.06 -54.85 9.71 Favored 'General case' 0 CA--C 1.521 -0.147 0 CA-C-N 118.819 0.736 . . . . 0.0 111.487 -179.737 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 53.6 p -66.87 -44.26 81.4 Favored 'General case' 0 N--CA 1.452 -0.373 0 O-C-N 123.161 0.288 . . . . 0.0 110.499 -175.25 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -75.13 -36.65 38.22 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.246 0 N-CA-C 109.629 -0.508 . . . . 0.0 109.629 179.731 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -67.09 -46.15 75.32 Favored Glycine 0 C--N 1.337 0.622 0 N-CA-C 111.417 -0.673 . . . . 0.0 111.417 -175.351 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 39.0 mtm105 -69.81 -42.61 73.47 Favored 'General case' 0 CA--C 1.517 -0.309 0 CA-C-N 117.37 0.585 . . . . 0.0 109.906 177.913 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -64.83 -33.88 77.05 Favored 'General case' 0 N--CA 1.45 -0.432 0 CA-C-O 119.335 -0.364 . . . . 0.0 110.918 -178.191 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 1.0 OUTLIER -68.18 -45.45 73.4 Favored 'General case' 0 CA--C 1.519 -0.241 0 CA-C-N 118.571 0.623 . . . . 0.0 110.929 177.076 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . 0.436 ' HA ' ' SG ' ' A' ' 94' ' ' CYS . 6.5 tt -66.62 -48.17 70.33 Favored 'General case' 0 N--CA 1.447 -0.596 0 C-N-CA 118.249 -1.381 . . . . 0.0 108.24 -178.266 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 90.4 m-20 -54.19 -44.96 72.0 Favored 'General case' 0 C--O 1.228 -0.079 0 N-CA-C 112.864 0.69 . . . . 0.0 112.864 177.979 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 15.5 tm-20 -61.53 -50.2 73.64 Favored 'General case' 0 N--CA 1.448 -0.548 0 CA-C-N 117.878 0.308 . . . . 0.0 111.117 -177.752 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 80' ' ' THR . . . . . 0.625 HG21 ' HB3' ' A' ' 94' ' ' CYS . 31.6 p -72.82 -26.88 61.65 Favored 'General case' 0 N--CA 1.453 -0.276 0 C-N-CA 120.477 -0.489 . . . . 0.0 110.412 -178.12 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 33.2 ttp180 -70.4 -23.7 62.8 Favored 'General case' 0 N--CA 1.45 -0.448 0 C-N-CA 123.676 0.79 . . . . 0.0 111.061 175.022 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 34.0 t . . . . . 0 N--CA 1.454 -0.262 0 N-CA-C 113.14 0.793 . . . . 0.0 113.14 -179.13 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 31.5 Cg_exo . . . . . 0 N--CA 1.447 -1.211 0 N-CA-C 108.209 -1.496 . . . . 0.0 108.209 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 90.68 16.57 54.6 Favored Glycine 0 CA--C 1.526 0.766 0 CA-C-O 119.369 -0.684 . . . . 0.0 112.28 -176.756 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 78.0 p -151.2 172.17 16.25 Favored 'General case' 0 N--CA 1.455 -0.213 0 CA-C-N 118.05 0.925 . . . . 0.0 111.349 176.307 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 94' ' ' CYS . . . . . 0.625 ' HB3' HG21 ' A' ' 80' ' ' THR . 5.3 t -57.03 -27.21 61.44 Favored 'General case' 0 N--CA 1.451 -0.422 0 CA-C-N 115.196 -0.911 . . . . 0.0 109.91 173.376 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -56.11 -59.25 5.19 Favored 'General case' 0 N--CA 1.446 -0.653 0 N-CA-C 109.384 -0.599 . . . . 0.0 109.384 -176.189 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 73.6 t60 -74.59 -34.44 62.87 Favored 'General case' 0 N--CA 1.45 -0.472 0 CA-C-N 116.36 -0.382 . . . . 0.0 111.419 -179.152 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -64.93 -50.67 65.55 Favored 'General case' 0 N--CA 1.454 -0.261 0 O-C-N 122.969 0.168 . . . . 0.0 111.356 -177.145 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 98' ' ' ILE . . . . . 0.593 HD13 ' SG ' ' A' ' 94' ' ' CYS . 1.7 mp -73.61 -32.31 35.31 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.207 0 N-CA-C 110.033 -0.358 . . . . 0.0 110.033 -178.32 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 2.0 m120 -67.11 -45.24 77.79 Favored 'General case' 0 N--CA 1.453 -0.306 0 CA-C-N 118.062 0.392 . . . . 0.0 111.101 176.838 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 95.9 m -70.67 -33.64 71.16 Favored 'General case' 0 N--CA 1.457 -0.12 0 CA-C-N 117.947 0.339 . . . . 0.0 110.497 -177.109 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 68.4 tp -73.58 -30.39 62.99 Favored 'General case' 0 N--CA 1.451 -0.408 0 C-N-CA 122.661 0.385 . . . . 0.0 110.946 -179.104 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -70.09 -19.84 75.91 Favored Glycine 0 CA--C 1.529 0.922 0 CA-C-O 119.555 -0.581 . . . . 0.0 112.828 -176.998 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 14.6 mm-40 -80.23 -39.46 29.01 Favored 'General case' 0 C--O 1.231 0.125 0 CA-C-N 118.008 0.904 . . . . 0.0 111.381 179.998 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 30.3 m -97.87 -8.87 9.09 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.158 0 N-CA-C 113.177 0.806 . . . . 0.0 113.177 -173.868 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 105' ' ' ILE . . . . . . . . . . . . . 10.6 tp -57.15 -26.78 26.09 Favored 'Isoleucine or valine' 0 CA--C 1.528 0.124 0 CA-C-N 119.162 0.892 . . . . 0.0 111.655 -176.716 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 25.4 pt20 -67.48 -30.04 69.64 Favored 'General case' 0 N--CA 1.454 -0.267 0 O-C-N 122.182 -0.324 . . . . 0.0 110.523 178.852 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 66.5 mt-10 -73.98 -41.6 61.68 Favored 'General case' 0 N--CA 1.455 -0.201 0 N-CA-C 108.795 -0.817 . . . . 0.0 108.795 177.315 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 108' ' ' LEU . . . . . 0.526 HD11 HG22 ' A' ' 51' ' ' ILE . 41.1 mt -68.65 -42.73 77.53 Favored 'General case' 0 N--CA 1.449 -0.505 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.573 -174.348 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 95.9 mt -72.61 -47.1 50.58 Favored 'General case' 0 N--CA 1.451 -0.416 0 CA-C-O 119.01 -0.519 . . . . 0.0 111.319 -179.033 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 44.6 t -61.89 -41.19 97.58 Favored 'General case' 0 C--O 1.233 0.204 0 CA-C-N 118.849 0.75 . . . . 0.0 110.684 -179.295 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 22.6 t0 -59.25 -40.26 85.43 Favored 'General case' 0 N--CA 1.453 -0.289 0 N-CA-C 108.469 -0.937 . . . . 0.0 108.469 174.7 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 112' ' ' ALA . . . . . 0.487 ' HB2' ' HE3' ' A' ' 62' ' ' LYS . . . -69.33 -38.75 78.32 Favored 'General case' 0 N--CA 1.443 -0.779 0 C-N-CA 120.603 -0.439 . . . . 0.0 111.138 -175.768 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 113' ' ' ILE . . . . . 0.45 ' O ' ' HE2' ' A' ' 121' ' ' LYS . 36.6 mm -66.21 -42.37 90.92 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.473 0 C-N-CA 118.809 -1.156 . . . . 0.0 109.739 -178.276 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -71.96 -46.86 55.9 Favored 'General case' 0 N--CA 1.451 -0.422 0 N-CA-C 111.555 0.205 . . . . 0.0 111.555 -178.899 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 33.1 ttpt -76.77 -37.25 56.22 Favored 'General case' 0 N--CA 1.451 -0.384 0 N-CA-C 113.497 0.925 . . . . 0.0 113.497 -175.405 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 116' ' ' SER . . . . . 0.488 ' HB2' ' CB ' ' A' ' 120' ' ' HIS . 24.4 p -76.54 159.82 30.0 Favored 'General case' 0 CA--C 1.527 0.095 0 N-CA-C 112.605 0.595 . . . . 0.0 112.605 -170.678 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 11.6 m120 -76.68 168.4 20.15 Favored 'General case' 0 CA--C 1.519 -0.236 0 C-N-CA 123.227 0.611 . . . . 0.0 111.851 -179.719 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 118' ' ' GLN . . . . . . . . . . . . . 12.7 mm100 -53.75 -42.23 67.96 Favored 'General case' 0 C--O 1.233 0.216 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.559 -178.394 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 18.4 t0 -66.67 -32.73 74.23 Favored 'General case' 0 N--CA 1.456 -0.164 0 N-CA-C 109.303 -0.628 . . . . 0.0 109.303 -179.622 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 120' ' ' HIS . . . . . 0.515 ' CD2' HD12 ' A' ' 63' ' ' LEU . 20.8 m170 -76.05 -40.38 53.48 Favored 'General case' 0 N--CA 1.449 -0.491 0 CA-C-N 116.002 -0.544 . . . . 0.0 110.073 -178.859 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 121' ' ' LYS . . . . . 0.45 ' HE2' ' O ' ' A' ' 113' ' ' ILE . 96.0 mttt -54.98 -41.04 70.69 Favored 'General case' 0 C--N 1.339 0.118 0 N-CA-C 108.222 -1.029 . . . . 0.0 108.222 177.932 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 46.0 tp10 -70.63 -39.31 73.79 Favored 'General case' 0 CA--C 1.53 0.178 0 N-CA-C 111.467 0.173 . . . . 0.0 111.467 178.222 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 92.0 mttt -71.36 -26.43 62.8 Favored 'General case' 0 N--CA 1.452 -0.335 0 O-C-N 121.835 -0.541 . . . . 0.0 110.827 -179.266 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 124' ' ' ILE . . . . . . . . . . . . . 69.1 mt -69.99 -40.25 78.37 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.244 0 N-CA-C 108.653 -0.869 . . . . 0.0 108.653 174.233 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 125' ' ' ARG . . . . . 0.446 HH11 ' HA ' ' A' ' 125' ' ' ARG . 6.6 mmm180 -61.28 -48.41 81.53 Favored 'General case' 0 N--CA 1.45 -0.433 0 CA-C-O 118.899 -0.572 . . . . 0.0 111.518 179.269 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 126' ' ' MET . . . . . . . . . . . . . 28.7 ptm -62.96 -30.11 71.33 Favored 'General case' 0 N--CA 1.453 -0.284 0 C-N-CA 119.183 -1.007 . . . . 0.0 109.299 179.217 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 1.2 mp -62.44 -39.29 92.86 Favored 'General case' 0 C--N 1.339 0.146 0 CA-C-N 118.187 0.449 . . . . 0.0 111.037 175.957 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 80.8 mt -72.72 -36.76 67.87 Favored 'General case' 0 N--CA 1.455 -0.223 0 CA-C-N 118.488 0.586 . . . . 0.0 110.127 179.614 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 15.1 m-20 -65.71 -35.84 81.91 Favored 'General case' 0 N--CA 1.454 -0.274 0 N-CA-C 109.351 -0.611 . . . . 0.0 109.351 176.624 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 35.7 mt -63.62 -36.43 76.41 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.229 0 C-N-CA 122.487 0.315 . . . . 0.0 110.212 176.423 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 131' ' ' TRP . . . . . . . . . . . . . 46.4 m0 . . . . . 0 N--CA 1.449 -0.481 0 N-CA-C 112.899 0.703 . . . . 0.0 112.899 179.54 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 22.4 p-10 . . . . . 0 N--CA 1.457 -0.076 0 CA-C-O 121.275 0.559 . . . . 0.0 109.602 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 7' ' ' PHE . . . . . 0.499 ' CE1' ' HD3' ' A' ' 45' ' ' LYS . 1.4 t80 -55.28 -34.72 64.34 Favored 'General case' 0 N--CA 1.447 -0.59 0 C-N-CA 125.007 1.323 . . . . 0.0 111.022 -178.314 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 50.8 tp60 -53.68 -34.82 59.99 Favored 'General case' 0 N--CA 1.454 -0.262 0 C-N-CA 123.448 0.699 . . . . 0.0 112.059 -177.189 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 27.9 m-80 -72.3 -33.36 67.34 Favored 'General case' 0 N--CA 1.453 -0.311 0 N-CA-C 110.052 -0.351 . . . . 0.0 110.052 -179.529 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 10' ' ' PHE . . . . . 0.512 ' CZ ' HG12 ' A' ' 46' ' ' ILE . 6.4 t80 -70.19 -39.39 75.23 Favored 'General case' 0 N--CA 1.45 -0.439 0 N-CA-C 108.794 -0.817 . . . . 0.0 108.794 176.18 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 88.3 t -65.89 -53.38 38.62 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.271 0 N-CA-C 109.163 -0.68 . . . . 0.0 109.163 179.054 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -58.2 -30.62 66.61 Favored 'General case' 0 N--CA 1.455 -0.221 0 C-N-CA 122.716 0.406 . . . . 0.0 111.305 -179.312 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 91.4 m -71.13 -40.36 71.44 Favored 'General case' 0 N--CA 1.453 -0.325 0 N-CA-C 109.131 -0.692 . . . . 0.0 109.131 176.213 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.46 ' HA ' ' CD1' ' A' ' 17' ' ' PHE . 8.2 tp -65.9 -41.55 91.33 Favored 'General case' 0 N--CA 1.449 -0.476 0 CA-C-O 121.416 0.627 . . . . 0.0 109.869 179.473 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 73.2 mm-40 -63.81 -27.96 69.54 Favored 'General case' 0 N--CA 1.448 -0.545 0 C-N-CA 124.133 0.973 . . . . 0.0 109.949 177.931 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 51.0 m -69.78 -30.65 68.27 Favored 'General case' 0 N--CA 1.453 -0.29 0 N-CA-C 109.74 -0.467 . . . . 0.0 109.74 176.474 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 17' ' ' PHE . . . . . 0.557 ' CD1' HD11 ' A' ' 68' ' ' ILE . 33.6 m-85 -69.98 -33.16 71.69 Favored 'General case' 0 C--N 1.339 0.137 0 C-N-CA 119.469 -0.892 . . . . 0.0 111.065 171.982 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . 0.475 ' HG2' ' CE1' ' A' ' 53' ' ' TYR . 70.0 mttt -67.37 -24.18 65.67 Favored 'General case' 0 N--CA 1.462 0.152 0 CA-C-O 120.918 0.389 . . . . 0.0 110.496 174.739 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 31.2 t0 -79.37 -46.35 17.8 Favored 'General case' 0 C--N 1.334 -0.075 0 CA-C-N 116.521 -0.309 . . . . 0.0 110.653 175.469 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . 0.43 HD12 ' HA ' ' A' ' 17' ' ' PHE . 13.5 mt -54.63 126.67 24.77 Favored 'General case' 0 N--CA 1.457 -0.112 0 CA-C-O 120.894 0.378 . . . . 0.0 111.556 -176.666 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 1.2 mppt? -74.06 -23.28 59.35 Favored 'General case' 0 N--CA 1.456 -0.168 0 N-CA-C 108.988 -0.745 . . . . 0.0 108.988 175.194 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 34.6 m -82.67 -20.89 35.32 Favored 'General case' 0 N--CA 1.455 -0.184 0 C-N-CA 122.923 0.489 . . . . 0.0 110.637 174.916 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 72.21 -42.52 0.8 Allowed Glycine 0 CA--C 1.527 0.829 0 C-N-CA 124.982 1.277 . . . . 0.0 111.831 -177.168 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 84.1 mt -75.52 149.43 6.95 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.392 0 C-N-CA 123.995 0.918 . . . . 0.0 111.109 177.911 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 31.2 t -167.18 93.31 0.43 Allowed 'General case' 0 CA--C 1.518 -0.281 0 N-CA-C 108.847 -0.797 . . . . 0.0 108.847 169.791 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . 0.42 ' O ' ' HE2' ' A' ' 30' ' ' LYS . . . -55.23 -35.51 60.43 Favored Glycine 0 C--N 1.332 0.349 0 N-CA-C 110.709 -0.956 . . . . 0.0 110.709 -176.834 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 30.3 t -61.83 -53.15 59.85 Favored 'General case' 0 N--CA 1.449 -0.494 0 N-CA-C 109.752 -0.462 . . . . 0.0 109.752 -179.153 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 82.5 mmt-85 -68.87 -40.6 79.2 Favored 'General case' 0 C--O 1.231 0.123 0 C-N-CA 122.941 0.496 . . . . 0.0 110.417 -179.446 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 65.6 mt -57.37 -45.13 85.32 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.657 0 N-CA-C 108.559 -0.904 . . . . 0.0 108.559 177.931 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . 0.42 ' HE2' ' O ' ' A' ' 26' ' ' GLY . 51.0 mtmt -68.52 -27.27 65.96 Favored 'General case' 0 N--CA 1.456 -0.132 0 CA-C-O 118.65 -0.691 . . . . 0.0 111.51 179.531 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . 0.425 ' HE3' ' HA ' ' A' ' 31' ' ' LYS . 0.0 OUTLIER -63.59 -59.61 4.4 Favored 'General case' 0 C--N 1.341 0.232 0 CA-C-N 119.131 0.878 . . . . 0.0 110.163 177.299 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.503 HD12 ' N ' ' A' ' 33' ' ' THR . 1.6 pp -75.67 -19.22 59.29 Favored 'General case' 0 CA--C 1.532 0.28 0 C-N-CA 119.263 -0.975 . . . . 0.0 111.64 -176.924 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . 0.503 ' N ' HD12 ' A' ' 32' ' ' LEU . 21.4 m -69.61 -42.93 73.71 Favored 'General case' 0 CA--C 1.52 -0.174 0 N-CA-C 108.845 -0.798 . . . . 0.0 108.845 175.927 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 87.4 m -72.1 -41.54 67.18 Favored 'General case' 0 N--CA 1.448 -0.552 0 CA-C-N 116.482 -0.326 . . . . 0.0 110.374 -175.995 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 58.3 t80 -63.98 -31.34 72.49 Favored 'General case' 0 N--CA 1.456 -0.163 0 C-N-CA 119.946 -0.701 . . . . 0.0 109.842 178.436 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -72.02 -27.66 62.87 Favored 'General case' 0 N--CA 1.447 -0.589 0 CA-C-O 119.385 -0.34 . . . . 0.0 110.682 174.414 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . 0.484 HD22 ' HA ' ' A' ' 37' ' ' LEU . 0.6 OUTLIER -76.39 -39.14 54.51 Favored 'General case' 0 CA--C 1.519 -0.229 0 N-CA-C 107.79 -1.189 . . . . 0.0 107.79 -175.89 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 77.0 m-20 -67.4 -15.28 63.59 Favored 'General case' 0 N--CA 1.441 -0.883 0 C-N-CA 124.981 1.312 . . . . 0.0 111.331 176.927 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 97.0 m-70 -153.42 91.55 1.51 Allowed 'General case' 0 N--CA 1.451 -0.415 0 C-N-CA 123.265 0.626 . . . . 0.0 111.137 -175.569 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 40' ' ' ILE . . . . . 0.528 ' H ' HD13 ' A' ' 40' ' ' ILE . 0.0 OUTLIER -70.07 -14.83 18.64 Favored 'Isoleucine or valine' 0 C--O 1.226 -0.176 0 O-C-N 121.788 -0.57 . . . . 0.0 109.789 173.11 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 20.9 m-20 -57.91 -10.49 1.78 Allowed 'General case' 0 CA--C 1.532 0.255 0 C-N-CA 125.248 1.419 . . . . 0.0 113.897 -177.672 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -118.54 9.04 6.85 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.192 0 C-N-CA 124.114 0.966 . . . . 0.0 111.335 179.714 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 3.0 pp20? -47.76 -31.07 4.44 Favored 'General case' 0 C--N 1.331 -0.212 0 O-C-N 121.996 -0.44 . . . . 0.0 112.122 176.638 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 2.5 m -71.58 -39.03 70.83 Favored 'General case' 0 CA--C 1.53 0.211 0 O-C-N 121.794 -0.566 . . . . 0.0 111.234 -175.665 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . 0.499 ' HD3' ' CE1' ' A' ' 7' ' ' PHE . 19.1 ptpt -74.16 -24.5 59.41 Favored 'General case' 0 CA--C 1.531 0.24 0 O-C-N 121.637 -0.665 . . . . 0.0 109.719 176.357 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 46' ' ' ILE . . . . . 0.512 HG12 ' CZ ' ' A' ' 10' ' ' PHE . 97.7 mt -72.75 -47.37 50.2 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.237 0 C-N-CA 122.514 0.326 . . . . 0.0 110.206 -179.642 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 33.6 mm -62.79 -36.59 76.11 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.181 0 N-CA-C 109.183 -0.673 . . . . 0.0 109.183 177.454 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 47.1 m -62.84 -38.4 90.64 Favored 'General case' 0 N--CA 1.455 -0.202 0 C-N-CA 120.978 -0.289 . . . . 0.0 111.228 179.213 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 18.6 mt -74.68 -35.17 62.77 Favored 'General case' 0 N--CA 1.451 -0.413 0 N-CA-C 113.176 0.806 . . . . 0.0 113.176 -178.278 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 19.4 pt -69.59 -39.99 79.0 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.181 0 CA-C-N 118.925 0.784 . . . . 0.0 110.258 -178.893 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 36.0 pt -67.21 -42.79 88.38 Favored 'Isoleucine or valine' 0 C--N 1.338 0.092 0 C-N-CA 119.701 -0.799 . . . . 0.0 110.246 178.514 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 85.3 m-20 -63.96 -46.4 84.81 Favored 'General case' 0 N--CA 1.455 -0.208 0 CA-C-N 118.117 0.417 . . . . 0.0 110.886 -179.806 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 53' ' ' TYR . . . . . 0.475 ' CE1' ' HG2' ' A' ' 18' ' ' LYS . 12.1 t80 -63.59 -43.02 98.19 Favored 'General case' 0 N--CA 1.453 -0.314 0 N-CA-C 109.925 -0.398 . . . . 0.0 109.925 -179.819 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 24.2 m -66.0 -30.17 70.68 Favored 'General case' 0 N--CA 1.454 -0.24 0 CA-C-N 118.024 0.375 . . . . 0.0 111.757 -175.923 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 83.0 mtt-85 -76.62 -54.46 6.64 Favored 'General case' 0 N--CA 1.454 -0.251 0 CA-C-N 118.053 0.388 . . . . 0.0 111.523 -177.938 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . 0.424 ' N ' ' CD2' ' A' ' 56' ' ' LEU . 2.8 mm? -75.42 -20.16 59.05 Favored 'General case' 0 N--CA 1.455 -0.204 0 N-CA-C 113.863 1.06 . . . . 0.0 113.863 -174.084 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 57' ' ' CYS . . . . . 0.407 ' HB2' ' CB ' ' A' ' 61' ' ' HIS . 8.5 p -83.82 157.22 63.92 Favored Pre-proline 0 CA--C 1.537 0.465 0 N-CA-C 113.611 0.967 . . . . 0.0 113.611 -172.634 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 75.9 Cg_endo -75.4 -174.2 1.9 Allowed 'Trans proline' 0 N--CA 1.459 -0.507 1 C-N-CA 125.644 4.229 . . . . 0.0 111.82 174.358 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 59' ' ' ASP . . . . . 0.407 ' HB2' ' HA ' ' A' ' 116' ' ' SER . 38.5 p-10 -57.76 -50.22 73.97 Favored 'General case' 0 CA--C 1.529 0.155 0 C-N-CA 125.022 1.329 . . . . 0.0 114.407 -171.868 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 39.9 m -71.52 -32.21 67.92 Favored 'General case' 0 C--N 1.333 -0.134 0 O-C-N 122.074 -0.392 . . . . 0.0 110.428 -174.863 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 61' ' ' HIS . . . . . 0.407 ' CB ' ' HB2' ' A' ' 57' ' ' CYS . 61.5 m170 -75.39 -27.83 59.23 Favored 'General case' 0 N--CA 1.451 -0.414 0 C-N-CA 122.608 0.363 . . . . 0.0 110.207 176.464 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 45.6 tptt -68.97 -40.22 78.97 Favored 'General case' 0 N--CA 1.451 -0.425 0 N-CA-C 109.664 -0.495 . . . . 0.0 109.664 177.812 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . 0.472 HD23 HG13 ' A' ' 124' ' ' ILE . 1.8 tm? -73.21 -35.43 66.32 Favored 'General case' 0 N--CA 1.454 -0.241 0 N-CA-C 109.537 -0.542 . . . . 0.0 109.537 178.6 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -69.39 -29.35 71.79 Favored Glycine 0 CA--C 1.525 0.718 0 N-CA-C 110.646 -0.982 . . . . 0.0 110.646 175.765 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 43.9 t -71.11 -42.74 68.89 Favored 'General case' 0 N--CA 1.454 -0.241 0 CA-C-N 117.566 0.683 . . . . 0.0 110.133 176.797 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 72.3 mt -68.01 -24.46 65.12 Favored 'General case' 0 N--CA 1.452 -0.358 0 N-CA-C 110.151 -0.314 . . . . 0.0 110.151 179.104 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 2.0 m-85 -70.04 -39.62 75.63 Favored 'General case' 0 N--CA 1.454 -0.274 0 C-N-CA 122.288 0.235 . . . . 0.0 110.815 172.802 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 68' ' ' ILE . . . . . 0.557 HD11 ' CD1' ' A' ' 17' ' ' PHE . 20.3 mt -67.07 -46.6 84.16 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.381 0 N-CA-C 108.728 -0.841 . . . . 0.0 108.728 177.994 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 97.3 mt -57.24 -36.48 52.23 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.121 0 C-N-CA 123.366 0.666 . . . . 0.0 111.028 175.729 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 22.2 t70 -70.18 -43.59 70.49 Favored 'General case' 0 N--CA 1.455 -0.223 0 CA-C-N 117.883 0.31 . . . . 0.0 110.912 178.437 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 30.1 t -67.25 -53.39 30.5 Favored 'General case' 0 N--CA 1.452 -0.351 0 CA-C-N 116.553 -0.294 . . . . 0.0 110.759 -177.458 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -75.13 -33.34 28.53 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.304 0 N-CA-C 109.911 -0.403 . . . . 0.0 109.911 -177.532 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -68.62 -45.33 67.08 Favored Glycine 0 C--N 1.338 0.67 0 CA-C-O 119.703 -0.498 . . . . 0.0 112.074 -176.155 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 33.4 mtm105 -71.01 -40.9 71.54 Favored 'General case' 0 N--CA 1.452 -0.329 0 CA-C-N 117.651 0.726 . . . . 0.0 109.695 177.143 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -61.22 -37.15 81.98 Favored 'General case' 0 N--CA 1.453 -0.297 0 C-N-CA 120.871 -0.332 . . . . 0.0 110.442 -178.673 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 2.4 m-30 -70.19 -47.5 61.25 Favored 'General case' 0 N--CA 1.453 -0.299 0 CA-C-N 118.033 0.379 . . . . 0.0 111.112 178.235 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -65.86 -38.27 88.38 Favored 'General case' 0 N--CA 1.444 -0.761 0 C-N-CA 118.935 -1.106 . . . . 0.0 108.675 -176.98 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 95.5 m-20 -63.49 -45.04 92.57 Favored 'General case' 0 N--CA 1.455 -0.188 0 N-CA-C 111.792 0.293 . . . . 0.0 111.792 177.255 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 14.5 tm-20 -63.54 -46.86 84.03 Favored 'General case' 0 N--CA 1.447 -0.579 0 CA-C-N 117.679 0.218 . . . . 0.0 111.215 -177.698 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 80' ' ' THR . . . . . 0.577 HG21 ' HB3' ' A' ' 94' ' ' CYS . 52.7 p -73.79 -18.53 60.95 Favored 'General case' 0 N--CA 1.453 -0.301 0 N-CA-C 112.068 0.396 . . . . 0.0 112.068 179.611 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 20.3 ttm105 -75.77 -37.13 59.52 Favored 'General case' 0 N--CA 1.455 -0.182 0 CA-C-N 118.161 0.437 . . . . 0.0 109.881 171.425 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 30.9 t . . . . . 0 N--CA 1.456 -0.17 0 C-N-CA 122.997 0.519 . . . . 0.0 112.385 -179.331 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 91' ' ' PRO . . . . . 0.407 ' HA ' ' HB3' ' A' ' 96' ' ' HIS . 85.9 Cg_endo . . . . . 0 N--CA 1.453 -0.885 0 N-CA-C 109.746 -0.905 . . . . 0.0 109.746 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 80.61 17.89 72.09 Favored Glycine 0 CA--C 1.525 0.663 0 N-CA-C 111.489 -0.644 . . . . 0.0 111.489 179.306 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -156.78 166.68 32.68 Favored 'General case' 0 N--CA 1.455 -0.208 0 C-N-CA 124.811 1.244 . . . . 0.0 108.918 -178.809 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 94' ' ' CYS . . . . . 0.577 ' HB3' HG21 ' A' ' 80' ' ' THR . 30.5 p -59.47 -18.59 40.99 Favored 'General case' 0 N--CA 1.451 -0.424 0 C-N-CA 122.358 0.263 . . . . 0.0 110.535 178.382 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -56.55 -63.09 1.31 Allowed 'General case' 0 N--CA 1.449 -0.48 0 C-N-CA 122.333 0.253 . . . . 0.0 110.62 -177.658 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 96' ' ' HIS . . . . . 0.407 ' HB3' ' HA ' ' A' ' 91' ' ' PRO . 76.0 t60 -72.25 -33.54 67.58 Favored 'General case' 0 N--CA 1.449 -0.515 0 CA-C-N 116.949 -0.114 . . . . 0.0 110.739 -179.556 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -63.48 -54.1 41.63 Favored 'General case' 0 N--CA 1.452 -0.347 0 O-C-N 123.021 0.201 . . . . 0.0 111.375 -177.333 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 98' ' ' ILE . . . . . 0.444 HD13 ' HB2' ' A' ' 94' ' ' CYS . 1.7 mp -70.13 -36.7 69.24 Favored 'Isoleucine or valine' 0 C--N 1.337 0.05 0 CA-C-N 117.778 0.263 . . . . 0.0 110.428 -179.505 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 35.9 m-20 -67.69 -45.22 75.77 Favored 'General case' 0 N--CA 1.454 -0.27 0 CA-C-N 117.916 0.325 . . . . 0.0 111.316 -178.512 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 98.1 m -70.27 -31.7 69.19 Favored 'General case' 0 N--CA 1.453 -0.308 0 N-CA-C 110.125 -0.324 . . . . 0.0 110.125 -177.797 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 53.7 tp -74.06 -38.34 63.98 Favored 'General case' 0 N--CA 1.449 -0.476 0 CA-C-O 119.626 -0.226 . . . . 0.0 111.058 179.439 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -65.96 -22.64 70.59 Favored Glycine 0 CA--C 1.53 1.009 0 CA-C-O 119.811 -0.438 . . . . 0.0 113.216 -174.562 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 17.3 mm-40 -78.84 -36.4 42.55 Favored 'General case' 0 N--CA 1.456 -0.127 0 CA-C-N 117.877 0.839 . . . . 0.0 111.455 179.186 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 19.6 m -105.02 -8.4 9.84 Favored 'Isoleucine or valine' 0 CA--C 1.527 0.089 0 N-CA-C 112.895 0.702 . . . . 0.0 112.895 -174.492 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 105' ' ' ILE . . . . . . . . . . . . . 10.6 tp -59.59 -26.79 35.78 Favored 'Isoleucine or valine' 0 C--N 1.337 0.062 0 CA-C-N 119.484 1.038 . . . . 0.0 110.587 -179.32 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 27.7 pt20 -66.97 -29.05 68.79 Favored 'General case' 0 N--CA 1.45 -0.432 0 N-CA-C 110.325 -0.25 . . . . 0.0 110.325 177.434 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 60.7 mt-10 -75.96 -36.44 59.3 Favored 'General case' 0 CA--C 1.529 0.153 0 N-CA-C 109.94 -0.393 . . . . 0.0 109.94 177.137 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 10.7 mp -71.69 -41.3 68.83 Favored 'General case' 0 N--CA 1.448 -0.543 0 N-CA-C 109.892 -0.41 . . . . 0.0 109.892 179.847 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 91.5 mt -70.72 -53.14 16.75 Favored 'General case' 0 N--CA 1.455 -0.183 0 CA-C-O 119.526 -0.273 . . . . 0.0 111.176 -179.581 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 9.8 p -47.14 -55.79 7.79 Favored 'General case' 0 C--N 1.34 0.162 0 C-N-CA 122.664 0.386 . . . . 0.0 111.067 177.474 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 18.5 t0 -59.76 -37.71 79.76 Favored 'General case' 0 N--CA 1.446 -0.665 0 N-CA-C 109.475 -0.565 . . . . 0.0 109.475 -179.808 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -68.65 -37.61 79.8 Favored 'General case' 0 N--CA 1.444 -0.761 0 C-N-CA 119.862 -0.735 . . . . 0.0 110.814 -176.504 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 113' ' ' ILE . . . . . . . . . . . . . 27.5 mm -67.71 -39.38 81.98 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.288 0 C-N-CA 119.331 -0.948 . . . . 0.0 110.211 -178.16 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -75.2 -43.57 51.23 Favored 'General case' 0 CA--C 1.53 0.201 0 N-CA-C 112.073 0.397 . . . . 0.0 112.073 179.265 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 39.4 ttmt -75.73 -38.31 58.59 Favored 'General case' 0 C--N 1.338 0.079 0 C-N-CA 123.486 0.714 . . . . 0.0 112.538 -175.263 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 116' ' ' SER . . . . . 0.421 ' HB2' ' HB2' ' A' ' 120' ' ' HIS . 54.9 p -74.66 154.09 38.64 Favored 'General case' 0 N--CA 1.453 -0.294 0 N-CA-C 112.692 0.627 . . . . 0.0 112.692 -170.735 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 21.5 t-20 -75.76 163.81 26.89 Favored 'General case' 0 N--CA 1.454 -0.267 0 N-CA-C 108.84 -0.8 . . . . 0.0 108.84 178.131 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 118' ' ' GLN . . . . . . . . . . . . . 26.5 mm100 -49.59 -51.91 33.99 Favored 'General case' 0 N--CA 1.457 -0.079 0 C-N-CA 123.117 0.567 . . . . 0.0 111.726 -171.61 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 16.0 t0 -57.16 -41.59 79.46 Favored 'General case' 0 C--O 1.23 0.04 0 N-CA-C 109.859 -0.422 . . . . 0.0 109.859 -179.761 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 120' ' ' HIS . . . . . 0.421 ' HB2' ' HB2' ' A' ' 116' ' ' SER . 68.3 m-70 -68.84 -34.4 75.42 Favored 'General case' 0 N--CA 1.447 -0.597 0 CA-C-O 118.981 -0.533 . . . . 0.0 110.603 -179.709 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 60.5 mttm -57.64 -42.81 84.17 Favored 'General case' 0 N--CA 1.464 0.267 0 CA-C-N 118.958 0.799 . . . . 0.0 109.845 177.319 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 29.6 mm-40 -75.62 -32.83 60.42 Favored 'General case' 0 N--CA 1.449 -0.478 0 N-CA-C 112.282 0.475 . . . . 0.0 112.282 -178.002 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 46.4 mtmt -67.5 -28.98 68.3 Favored 'General case' 0 C--N 1.332 -0.193 0 C-N-CA 120.046 -0.662 . . . . 0.0 109.427 176.791 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 124' ' ' ILE . . . . . 0.472 HG13 HD23 ' A' ' 63' ' ' LEU . 62.2 mt -69.89 -38.79 76.57 Favored 'Isoleucine or valine' 0 C--O 1.226 -0.143 0 N-CA-C 109.463 -0.569 . . . . 0.0 109.463 171.812 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -56.39 -49.05 75.6 Favored 'General case' 0 C--N 1.341 0.219 0 O-C-N 122.185 -0.322 . . . . 0.0 110.468 179.818 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 126' ' ' MET . . . . . . . . . . . . . 27.8 ptm -69.41 -31.28 69.54 Favored 'General case' 0 N--CA 1.454 -0.243 0 C-N-CA 120.508 -0.477 . . . . 0.0 110.402 -179.582 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 2.1 mp -62.85 -32.77 74.07 Favored 'General case' 0 N--CA 1.456 -0.144 0 CA-C-N 118.568 0.622 . . . . 0.0 110.547 176.107 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 96.4 mt -72.43 -38.14 68.42 Favored 'General case' 0 N--CA 1.456 -0.162 0 CA-C-N 118.777 0.717 . . . . 0.0 109.927 177.291 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 50.9 m-20 -63.4 -36.34 83.39 Favored 'General case' 0 N--CA 1.456 -0.174 0 N-CA-C 109.796 -0.446 . . . . 0.0 109.796 175.375 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 55.0 mt -69.02 -31.97 52.51 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.278 0 C-N-CA 122.59 0.356 . . . . 0.0 110.615 179.404 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 131' ' ' TRP . . . . . . . . . . . . . 47.9 m0 . . . . . 0 N--CA 1.452 -0.361 0 C-N-CA 120.12 -0.632 . . . . 0.0 111.651 175.303 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 22.0 m-20 . . . . . 0 N--CA 1.456 -0.174 0 N-CA-C 108.85 -0.796 . . . . 0.0 108.85 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 7' ' ' PHE . . . . . 0.513 ' CD1' ' HD3' ' A' ' 45' ' ' LYS . 1.4 t80 -58.26 -34.51 70.56 Favored 'General case' 0 N--CA 1.449 -0.497 0 C-N-CA 123.29 0.636 . . . . 0.0 109.779 179.55 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 51.0 tp60 -51.69 -36.75 47.81 Favored 'General case' 0 N--CA 1.456 -0.145 0 C-N-CA 124.545 1.138 . . . . 0.0 111.829 -177.668 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 26.5 m-80 -71.43 -34.85 70.66 Favored 'General case' 0 N--CA 1.454 -0.272 0 N-CA-C 109.821 -0.437 . . . . 0.0 109.821 -179.379 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 10' ' ' PHE . . . . . 0.477 ' CZ ' HG12 ' A' ' 46' ' ' ILE . 2.1 t80 -71.45 -38.2 71.33 Favored 'General case' 0 N--CA 1.45 -0.439 0 N-CA-C 109.078 -0.712 . . . . 0.0 109.078 178.24 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 86.8 t -66.48 -55.36 18.82 Favored 'Isoleucine or valine' 0 CA--C 1.52 -0.181 0 N-CA-C 109.106 -0.702 . . . . 0.0 109.106 178.448 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -58.01 -29.75 65.54 Favored 'General case' 0 N--CA 1.456 -0.13 0 C-N-CA 122.704 0.402 . . . . 0.0 111.996 -179.107 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 92.3 m -71.93 -39.77 69.22 Favored 'General case' 0 CA--C 1.53 0.209 0 N-CA-C 109.214 -0.661 . . . . 0.0 109.214 176.18 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.422 ' HA ' ' CD1' ' A' ' 17' ' ' PHE . 0.1 OUTLIER -64.28 -45.45 87.97 Favored 'General case' 0 N--CA 1.45 -0.439 0 N-CA-C 109.076 -0.713 . . . . 0.0 109.076 177.145 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 72.5 mm-40 -64.91 -29.75 70.71 Favored 'General case' 0 N--CA 1.454 -0.267 0 C-N-CA 124.004 0.922 . . . . 0.0 110.264 179.798 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 70.5 m -67.18 -34.76 78.21 Favored 'General case' 0 N--CA 1.452 -0.348 0 N-CA-C 109.464 -0.569 . . . . 0.0 109.464 175.646 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 17' ' ' PHE . . . . . 0.469 ' CE1' HD11 ' A' ' 68' ' ' ILE . 15.4 m-85 -63.77 -39.98 95.59 Favored 'General case' 0 C--N 1.34 0.186 0 C-N-CA 120.176 -0.61 . . . . 0.0 109.821 174.657 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . 0.474 ' HG2' ' CE1' ' A' ' 53' ' ' TYR . 59.0 mttt -65.92 -29.45 69.87 Favored 'General case' 0 C--N 1.338 0.071 0 CA-C-N 117.625 0.193 . . . . 0.0 110.993 -179.122 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 60.6 t0 -75.16 -42.05 56.88 Favored 'General case' 0 N--CA 1.454 -0.242 0 O-C-N 123.374 0.421 . . . . 0.0 111.073 -179.189 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 14.1 mt -57.99 140.79 51.58 Favored 'General case' 0 N--CA 1.451 -0.396 0 C-N-CA 120.181 -0.608 . . . . 0.0 111.069 -176.483 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 1.1 mppt? -79.84 -21.42 44.19 Favored 'General case' 0 N--CA 1.454 -0.254 0 N-CA-C 109.319 -0.623 . . . . 0.0 109.319 176.543 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 22' ' ' SER . . . . . 0.402 ' C ' ' H ' ' A' ' 24' ' ' ILE . 85.8 p -76.75 -24.95 52.96 Favored 'General case' 0 CA--C 1.53 0.205 0 N-CA-C 109.557 -0.535 . . . . 0.0 109.557 169.82 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 71.7 -29.03 0.61 Allowed Glycine 0 CA--C 1.527 0.807 0 C-N-CA 125.294 1.426 . . . . 0.0 112.683 177.3 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . 0.402 ' H ' ' C ' ' A' ' 22' ' ' SER . 35.9 mt -89.73 155.07 3.12 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.557 0 N-CA-C 108.433 -0.951 . . . . 0.0 108.433 173.327 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 4.0 t -158.48 76.27 0.75 Allowed 'General case' 0 C--O 1.225 -0.199 0 CA-C-N 118.665 0.666 . . . . 0.0 110.518 -177.498 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -48.03 -49.86 22.91 Favored Glycine 0 CA--C 1.53 1.01 0 CA-C-O 118.592 -1.116 . . . . 0.0 115.403 -170.036 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 60.1 p -71.7 -35.96 70.4 Favored 'General case' 0 C--N 1.34 0.19 0 CA-C-N 120.173 1.987 . . . . 0.0 110.871 -176.182 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 75.2 mtt85 -70.94 -37.91 72.87 Favored 'General case' 0 C--N 1.341 0.237 0 CA-C-N 118.236 0.471 . . . . 0.0 110.183 178.027 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 41.3 mt -56.45 -45.03 81.73 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.446 0 N-CA-C 107.811 -1.181 . . . . 0.0 107.811 174.159 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 52.8 mtmt -68.36 -23.73 64.72 Favored 'General case' 0 N--CA 1.454 -0.225 0 CA-C-O 118.458 -0.782 . . . . 0.0 112.341 177.544 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . 0.539 ' HA ' ' HE3' ' A' ' 31' ' ' LYS . 0.0 OUTLIER -66.1 -59.28 3.93 Favored 'General case' 0 C--N 1.344 0.331 0 CA-C-N 119.629 1.104 . . . . 0.0 110.35 177.345 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.452 HD12 ' N ' ' A' ' 33' ' ' THR . 1.4 pp -74.17 -17.97 60.84 Favored 'General case' 0 N--CA 1.455 -0.176 0 C-N-CA 119.267 -0.973 . . . . 0.0 111.695 -177.024 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . 0.452 ' N ' HD12 ' A' ' 32' ' ' LEU . 39.7 m -73.54 -37.04 65.73 Favored 'General case' 0 N--CA 1.457 -0.12 0 N-CA-C 109.621 -0.511 . . . . 0.0 109.621 176.18 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 97.6 m -74.05 -37.27 64.33 Favored 'General case' 0 N--CA 1.453 -0.301 0 N-CA-C 110.231 -0.285 . . . . 0.0 110.231 -179.297 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 71.7 t80 -67.55 -33.32 74.81 Favored 'General case' 0 N--CA 1.454 -0.229 0 N-CA-C 109.718 -0.475 . . . . 0.0 109.718 176.727 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -71.14 -31.01 67.19 Favored 'General case' 0 N--CA 1.451 -0.386 0 CA-C-O 119.722 -0.18 . . . . 0.0 111.2 177.595 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 13.1 mt -71.92 -40.88 68.48 Favored 'General case' 0 N--CA 1.454 -0.23 0 C-N-CA 122.349 0.26 . . . . 0.0 111.123 178.101 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 41.8 t0 -67.6 -21.51 65.41 Favored 'General case' 0 CA--C 1.532 0.28 0 N-CA-C 110.504 -0.184 . . . . 0.0 110.504 178.613 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 74.6 m80 -146.39 92.0 2.12 Favored 'General case' 0 N--CA 1.453 -0.314 0 CA-C-O 120.88 0.372 . . . . 0.0 111.197 -177.662 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 40' ' ' ILE . . . . . 0.615 ' H ' HD13 ' A' ' 40' ' ' ILE . 0.0 OUTLIER -72.63 -16.99 18.3 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.54 0 CA-C-O 118.965 -0.54 . . . . 0.0 110.816 176.8 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 3.8 m-20 -57.68 -22.7 47.55 Favored 'General case' 0 N--CA 1.456 -0.16 0 N-CA-C 112.864 0.69 . . . . 0.0 112.864 -176.264 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -102.57 14.79 5.94 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.159 0 C-N-CA 122.636 0.374 . . . . 0.0 111.876 177.098 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 2.8 pp20? -51.51 -34.02 34.2 Favored 'General case' 0 C--O 1.226 -0.153 0 O-C-N 121.475 -0.765 . . . . 0.0 111.23 178.042 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 30.9 t -58.39 -49.88 75.67 Favored 'General case' 0 CA--C 1.531 0.225 0 N-CA-C 112.279 0.474 . . . . 0.0 112.279 -176.853 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . 0.513 ' HD3' ' CD1' ' A' ' 7' ' ' PHE . 19.4 ptpt -71.13 -23.22 62.04 Favored 'General case' 0 CA--C 1.529 0.153 0 O-C-N 121.959 -0.463 . . . . 0.0 110.326 -179.913 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 46' ' ' ILE . . . . . 0.477 HG12 ' CZ ' ' A' ' 10' ' ' PHE . 94.4 mt -75.2 -41.72 44.28 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.256 0 C-N-CA 122.888 0.475 . . . . 0.0 109.899 179.979 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 32.1 mm -62.61 -35.47 70.47 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.212 0 N-CA-C 109.185 -0.672 . . . . 0.0 109.185 175.672 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 17.9 t -63.59 -47.78 80.07 Favored 'General case' 0 N--CA 1.456 -0.152 0 C-N-CA 119.872 -0.731 . . . . 0.0 110.454 177.443 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 20.6 mt -64.5 -33.54 76.12 Favored 'General case' 0 N--CA 1.449 -0.496 0 CA-C-O 118.708 -0.663 . . . . 0.0 112.451 -175.788 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 24.6 pt -70.18 -42.71 79.12 Favored 'Isoleucine or valine' 0 C--O 1.226 -0.17 0 C-N-CA 119.366 -0.933 . . . . 0.0 110.669 178.554 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 43.3 pt -70.92 -39.96 75.85 Favored 'Isoleucine or valine' 0 C--N 1.342 0.264 0 CA-C-N 118.916 0.78 . . . . 0.0 110.68 179.756 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 76.3 m-20 -63.31 -48.86 76.29 Favored 'General case' 0 N--CA 1.454 -0.265 0 CA-C-N 117.783 0.265 . . . . 0.0 110.8 -179.987 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 53' ' ' TYR . . . . . 0.474 ' CE1' ' HG2' ' A' ' 18' ' ' LYS . 16.9 t80 -66.13 -47.14 75.08 Favored 'General case' 0 N--CA 1.454 -0.255 0 CA-C-O 119.443 -0.313 . . . . 0.0 110.41 -179.538 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 19.4 t -65.0 -27.91 69.15 Favored 'General case' 0 N--CA 1.454 -0.272 0 O-C-N 123.205 0.316 . . . . 0.0 111.796 -173.968 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . 0.43 HH22 ' CD ' ' A' ' 107' ' ' GLU . 90.2 mtt-85 -75.49 -51.29 13.34 Favored 'General case' 0 N--CA 1.455 -0.205 0 O-C-N 122.211 -0.306 . . . . 0.0 110.996 178.057 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 44.0 mt -75.17 -43.53 51.71 Favored 'General case' 0 N--CA 1.457 -0.112 0 N-CA-C 113.034 0.753 . . . . 0.0 113.034 -172.884 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 57' ' ' CYS . . . . . 0.461 ' O ' ' HE2' ' A' ' 62' ' ' LYS . 12.6 p -65.39 154.07 88.55 Favored Pre-proline 0 CA--C 1.538 0.483 0 N-CA-C 112.985 0.735 . . . . 0.0 112.985 -173.633 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 45.6 Cg_endo -80.23 -175.53 2.75 Favored 'Trans proline' 0 N--CA 1.458 -0.612 1 C-N-CA 125.381 4.054 . . . . 0.0 112.371 -179.557 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 59' ' ' ASP . . . . . 0.403 ' CG ' ' HA ' ' A' ' 116' ' ' SER . 35.4 t0 -36.86 -73.29 0.05 OUTLIER 'General case' 0 C--N 1.341 0.206 0 C-N-CA 126.422 1.889 . . . . 0.0 114.357 -174.134 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 19.7 m -61.88 -29.43 70.19 Favored 'General case' 0 C--O 1.232 0.138 0 O-C-N 122.079 -0.388 . . . . 0.0 111.544 -171.643 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 60.2 m80 -75.66 -29.2 59.0 Favored 'General case' 0 N--CA 1.45 -0.444 0 C-N-CA 122.467 0.307 . . . . 0.0 110.62 178.516 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . 0.461 ' HE2' ' O ' ' A' ' 57' ' ' CYS . 66.4 mttm -68.33 -37.85 80.96 Favored 'General case' 0 C--N 1.34 0.182 0 N-CA-C 109.092 -0.707 . . . . 0.0 109.092 174.241 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -61.61 -44.66 96.59 Favored 'General case' 0 C--N 1.341 0.213 0 N-CA-C 108.437 -0.949 . . . . 0.0 108.437 177.321 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -68.76 -28.31 73.2 Favored Glycine 0 CA--C 1.526 0.733 0 N-CA-C 111.609 -0.596 . . . . 0.0 111.609 -179.539 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 37.0 p -67.73 -36.94 81.49 Favored 'General case' 0 N--CA 1.452 -0.326 0 CA-C-N 117.965 0.883 . . . . 0.0 109.497 177.71 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 79.0 mt -75.47 -26.81 58.54 Favored 'General case' 0 N--CA 1.449 -0.5 0 CA-C-N 116.506 -0.315 . . . . 0.0 110.935 179.573 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 10.0 m-30 -69.29 -37.72 77.97 Favored 'General case' 0 CA--C 1.513 -0.476 0 CA-C-N 118.367 0.531 . . . . 0.0 110.97 174.231 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 68' ' ' ILE . . . . . 0.469 HD11 ' CE1' ' A' ' 17' ' ' PHE . 18.2 mt -63.87 -47.83 88.99 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.764 0 N-CA-C 107.501 -1.296 . . . . 0.0 107.501 178.907 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 97.0 mt -59.4 -32.56 48.93 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.155 0 C-N-CA 123.832 0.853 . . . . 0.0 111.34 177.056 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 15.2 t70 -68.89 -54.9 12.99 Favored 'General case' 0 CA--C 1.52 -0.196 0 CA-C-N 118.26 0.482 . . . . 0.0 111.134 179.183 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 32.3 t -70.02 -42.33 73.11 Favored 'General case' 0 N--CA 1.452 -0.342 0 C-N-CA 120.829 -0.348 . . . . 0.0 110.795 -174.353 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -74.99 -34.89 33.67 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.233 0 N-CA-C 109.583 -0.525 . . . . 0.0 109.583 179.851 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -70.15 -52.0 20.25 Favored Glycine 0 C--N 1.338 0.667 0 N-CA-C 111.619 -0.592 . . . . 0.0 111.619 -176.531 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 38.6 mtm180 -65.95 -41.79 90.83 Favored 'General case' 0 N--CA 1.45 -0.466 0 C-N-CA 120.306 -0.558 . . . . 0.0 109.608 178.839 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -67.44 -31.29 71.36 Favored 'General case' 0 N--CA 1.45 -0.442 0 C-N-CA 119.703 -0.799 . . . . 0.0 110.865 -177.645 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 1.4 m-30 -66.52 -44.84 81.38 Favored 'General case' 0 CA--C 1.52 -0.199 0 CA-C-N 118.801 0.728 . . . . 0.0 110.348 177.368 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 42.9 tp -70.62 -45.74 64.65 Favored 'General case' 0 N--CA 1.447 -0.6 0 C-N-CA 117.914 -1.514 . . . . 0.0 109.281 179.387 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 83.1 m-20 -56.91 -45.91 82.31 Favored 'General case' 0 CA--C 1.531 0.247 0 N-CA-C 113.164 0.802 . . . . 0.0 113.164 179.017 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 4.7 tm-20 -64.79 -48.62 73.78 Favored 'General case' 0 N--CA 1.453 -0.323 0 CA-C-N 119.115 0.87 . . . . 0.0 110.994 -179.66 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 68.9 p -67.41 -25.91 66.17 Favored 'General case' 0 CA--C 1.528 0.125 0 O-C-N 122.219 -0.301 . . . . 0.0 110.694 179.133 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 35.3 ttp180 -75.93 -20.36 58.04 Favored 'General case' 0 N--CA 1.452 -0.361 0 C-N-CA 124.155 0.982 . . . . 0.0 111.757 171.98 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 53.4 m . . . . . 0 CA--C 1.529 0.135 0 CA-C-O 119.364 -0.35 . . . . 0.0 111.77 -179.4 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 58.3 Cg_endo . . . . . 0 N--CA 1.453 -0.906 0 N-CA-C 108.647 -1.328 . . . . 0.0 108.647 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 96.1 19.56 28.19 Favored Glycine 0 CA--C 1.525 0.683 0 CA-C-O 119.466 -0.63 . . . . 0.0 112.569 -176.841 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 37.3 p -151.62 171.33 17.79 Favored 'General case' 0 CA--C 1.521 -0.17 0 CA-C-N 118.327 1.064 . . . . 0.0 110.922 178.595 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 94' ' ' CYS . . . . . 0.451 ' HB2' HD13 ' A' ' 98' ' ' ILE . 29.6 p -59.23 -24.79 63.47 Favored 'General case' 0 N--CA 1.451 -0.394 0 CA-C-N 115.404 -0.816 . . . . 0.0 109.287 175.133 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -60.69 -57.99 10.37 Favored 'General case' 0 N--CA 1.446 -0.675 0 N-CA-C 109.381 -0.6 . . . . 0.0 109.381 -176.814 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 63.0 t60 -75.4 -30.18 60.01 Favored 'General case' 0 N--CA 1.451 -0.406 0 N-CA-C 111.603 0.223 . . . . 0.0 111.603 -179.03 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -68.53 -51.36 43.84 Favored 'General case' 0 N--CA 1.448 -0.539 0 O-C-N 123.029 0.206 . . . . 0.0 111.127 -178.473 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 98' ' ' ILE . . . . . 0.451 HD13 ' HB2' ' A' ' 94' ' ' CYS . 2.0 mp -72.01 -29.62 33.66 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.198 0 C-N-CA 120.785 -0.366 . . . . 0.0 110.323 179.874 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 4.5 m120 -64.65 -48.78 73.56 Favored 'General case' 0 N--CA 1.455 -0.19 0 CA-C-N 118.373 0.533 . . . . 0.0 110.322 175.663 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 43.9 m -71.79 -33.94 69.0 Favored 'General case' 0 N--CA 1.456 -0.126 0 O-C-N 122.322 -0.236 . . . . 0.0 110.61 -175.717 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -71.04 -40.85 71.45 Favored 'General case' 0 N--CA 1.447 -0.578 0 N-CA-C 110.225 -0.287 . . . . 0.0 110.225 -179.794 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -64.27 -22.54 67.38 Favored Glycine 0 CA--C 1.528 0.906 0 CA-C-O 119.185 -0.786 . . . . 0.0 114.045 -172.333 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 16.0 mt-10 -95.16 -13.8 24.7 Favored 'General case' 0 C--O 1.231 0.116 0 CA-C-N 118.649 1.225 . . . . 0.0 112.015 -178.492 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 48.2 t -113.18 -23.45 4.34 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.198 0 CA-C-N 116.691 -0.231 . . . . 0.0 111.289 -173.543 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 105' ' ' ILE . . . . . . . . . . . . . 10.0 tp -59.98 -23.3 26.52 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.146 0 C-N-CA 122.922 0.489 . . . . 0.0 111.369 -178.34 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 26.5 pt20 -65.58 -29.53 70.14 Favored 'General case' 0 N--CA 1.452 -0.373 0 N-CA-C 110.288 -0.264 . . . . 0.0 110.288 179.351 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 107' ' ' GLU . . . . . 0.43 ' CD ' HH22 ' A' ' 55' ' ' ARG . 37.8 mt-10 -75.88 -39.91 55.54 Favored 'General case' 0 N--CA 1.455 -0.19 0 CA-C-N 118.079 0.4 . . . . 0.0 110.164 177.445 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 9.8 mp -67.95 -42.37 81.07 Favored 'General case' 0 N--CA 1.453 -0.314 0 N-CA-C 110.066 -0.346 . . . . 0.0 110.066 -178.462 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 90.2 mt -69.52 -59.17 3.15 Favored 'General case' 0 N--CA 1.454 -0.27 0 CA-C-O 119.113 -0.47 . . . . 0.0 110.583 -179.285 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 12.1 p -45.5 -52.74 9.88 Favored 'General case' 0 C--O 1.232 0.17 0 CA-C-N 118.163 0.438 . . . . 0.0 111.806 -179.696 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 34.2 t0 -64.34 -38.93 92.76 Favored 'General case' 0 N--CA 1.445 -0.706 0 N-CA-C 110.099 -0.334 . . . . 0.0 110.099 -178.271 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -70.41 -32.98 70.82 Favored 'General case' 0 N--CA 1.448 -0.568 0 CA-C-O 119.244 -0.407 . . . . 0.0 110.671 -177.914 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 113' ' ' ILE . . . . . . . . . . . . . 46.1 mm -65.23 -41.3 91.21 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.133 0 N-CA-C 108.525 -0.917 . . . . 0.0 108.525 178.175 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -74.6 -38.46 62.6 Favored 'General case' 0 N--CA 1.454 -0.27 0 N-CA-C 112.13 0.418 . . . . 0.0 112.13 179.89 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -75.5 -34.17 60.82 Favored 'General case' 0 C--N 1.339 0.138 0 N-CA-C 112.784 0.661 . . . . 0.0 112.784 -176.53 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 116' ' ' SER . . . . . 0.479 ' HB2' ' HB2' ' A' ' 120' ' ' HIS . 86.5 p -82.13 154.08 25.71 Favored 'General case' 0 N--CA 1.452 -0.352 0 N-CA-C 113.739 1.014 . . . . 0.0 113.739 -168.718 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 48.8 t30 -72.01 165.46 24.2 Favored 'General case' 0 CA--C 1.533 0.296 0 C-N-CA 124.036 0.935 . . . . 0.0 110.329 176.27 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 118' ' ' GLN . . . . . . . . . . . . . 25.6 mm100 -52.71 -40.78 63.31 Favored 'General case' 0 N--CA 1.456 -0.141 0 N-CA-C 113.239 0.829 . . . . 0.0 113.239 -171.633 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 20.4 p-10 -72.44 -41.06 66.56 Favored 'General case' 0 N--CA 1.456 -0.151 0 C-N-CA 120.606 -0.437 . . . . 0.0 109.828 -179.613 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 120' ' ' HIS . . . . . 0.479 ' HB2' ' HB2' ' A' ' 116' ' ' SER . 14.6 m-70 -65.22 -34.83 79.3 Favored 'General case' 0 N--CA 1.452 -0.334 0 C-N-CA 123.11 0.564 . . . . 0.0 110.366 178.226 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 55.8 mttm -61.15 -46.26 91.26 Favored 'General case' 0 C--N 1.341 0.208 0 N-CA-C 108.638 -0.875 . . . . 0.0 108.638 175.062 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 40.7 tp10 -67.39 -36.79 82.02 Favored 'General case' 0 N--CA 1.452 -0.336 0 CA-C-N 116.513 -0.312 . . . . 0.0 111.108 -176.313 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 34.1 mtmt -64.36 -31.68 72.98 Favored 'General case' 0 N--CA 1.452 -0.332 0 N-CA-C 109.61 -0.515 . . . . 0.0 109.61 176.912 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 124' ' ' ILE . . . . . . . . . . . . . 53.7 mt -74.0 -35.86 43.13 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.319 0 O-C-N 121.642 -0.661 . . . . 0.0 109.785 175.696 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 11.7 mmm180 -63.79 -39.74 94.97 Favored 'General case' 0 C--N 1.34 0.174 0 CA-C-N 118.522 0.601 . . . . 0.0 110.353 -179.778 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 126' ' ' MET . . . . . . . . . . . . . 18.6 ptp -68.9 -32.26 71.77 Favored 'General case' 0 N--CA 1.455 -0.189 0 C-N-CA 119.623 -0.831 . . . . 0.0 109.354 176.736 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 2.0 mp -60.52 -33.06 72.09 Favored 'General case' 0 CA--C 1.531 0.221 0 CA-C-N 118.647 0.658 . . . . 0.0 110.277 175.787 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 128' ' ' LEU . . . . . 0.435 ' HA ' HD13 ' A' ' 128' ' ' LEU . 3.1 mm? -70.27 -42.11 72.56 Favored 'General case' 0 CA--C 1.523 -0.064 0 CA-C-N 118.701 0.682 . . . . 0.0 109.992 177.196 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 15.6 t0 -61.0 -45.03 96.49 Favored 'General case' 0 N--CA 1.455 -0.211 0 CA-C-O 121.085 0.469 . . . . 0.0 109.797 177.124 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 53.6 mt -61.05 -36.89 75.6 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.348 0 C-N-CA 123.575 0.75 . . . . 0.0 110.511 -178.29 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 131' ' ' TRP . . . . . . . . . . . . . 51.3 m0 . . . . . 0 N--CA 1.451 -0.383 0 N-CA-C 112.897 0.703 . . . . 0.0 112.897 -179.834 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 18.8 p-10 . . . . . 0 N--CA 1.453 -0.32 0 N-CA-C 107.443 -1.317 . . . . 0.0 107.443 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER -62.34 -34.42 76.6 Favored 'General case' 0 N--CA 1.443 -0.816 0 C-N-CA 125.515 1.526 . . . . 0.0 111.174 -176.427 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 17.4 tp60 -50.56 -36.2 33.38 Favored 'General case' 0 N--CA 1.456 -0.135 0 C-N-CA 123.141 0.576 . . . . 0.0 111.325 -178.455 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 26.5 m-80 -70.99 -39.69 72.31 Favored 'General case' 0 N--CA 1.454 -0.248 0 N-CA-C 110.194 -0.298 . . . . 0.0 110.194 -179.389 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 10' ' ' PHE . . . . . 0.526 ' CE2' ' HB2' ' A' ' 32' ' ' LEU . 3.7 t80 -68.56 -37.51 79.96 Favored 'General case' 0 N--CA 1.451 -0.408 0 C-N-CA 123.476 0.71 . . . . 0.0 109.873 178.089 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 94.7 t -66.28 -51.19 61.67 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.219 0 N-CA-C 108.221 -1.029 . . . . 0.0 108.221 178.601 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -61.64 -25.76 67.57 Favored 'General case' 0 N--CA 1.452 -0.344 0 C-N-CA 122.844 0.458 . . . . 0.0 111.717 179.789 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 59.3 m -74.61 -37.02 62.96 Favored 'General case' 0 N--CA 1.456 -0.155 0 N-CA-C 108.972 -0.751 . . . . 0.0 108.972 175.613 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -66.49 -44.25 83.16 Favored 'General case' 0 N--CA 1.448 -0.54 0 N-CA-C 108.617 -0.883 . . . . 0.0 108.617 177.088 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 68.2 mm-40 -66.53 -27.03 67.44 Favored 'General case' 0 N--CA 1.451 -0.41 0 C-N-CA 123.952 0.901 . . . . 0.0 110.001 177.864 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 22.0 t -67.93 -35.16 77.97 Favored 'General case' 0 N--CA 1.451 -0.379 0 N-CA-C 109.316 -0.624 . . . . 0.0 109.316 177.521 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 17' ' ' PHE . . . . . 0.519 ' HA ' HD12 ' A' ' 20' ' ' LEU . 46.6 m-85 -67.9 -39.32 83.64 Favored 'General case' 0 CA--C 1.518 -0.267 0 C-N-CA 120.304 -0.558 . . . . 0.0 110.439 173.977 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 72.1 mttt -58.7 -32.81 69.5 Favored 'General case' 0 C--N 1.339 0.11 0 C-N-CA 120.46 -0.496 . . . . 0.0 109.714 178.849 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 24.9 t0 -76.33 -45.73 30.84 Favored 'General case' 0 N--CA 1.456 -0.151 0 C-N-CA 123.27 0.628 . . . . 0.0 111.05 176.292 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . 0.519 HD12 ' HA ' ' A' ' 17' ' ' PHE . 3.8 mt -46.99 136.49 8.38 Favored 'General case' 0 N--CA 1.454 -0.231 0 C-N-CA 123.224 0.61 . . . . 0.0 112.073 -173.473 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.49 -13.0 60.26 Favored 'General case' 0 CA--C 1.53 0.205 0 CA-C-N 115.252 -0.886 . . . . 0.0 111.88 -174.621 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 22' ' ' SER . . . . . 0.418 ' C ' ' H ' ' A' ' 24' ' ' ILE . 67.3 m -120.96 -10.85 9.02 Favored 'General case' 0 CA--C 1.528 0.122 0 C-N-CA 123.692 0.797 . . . . 0.0 112.005 -178.397 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 74.39 -21.66 1.43 Allowed Glycine 0 CA--C 1.531 1.059 0 N-CA-C 111.344 -0.702 . . . . 0.0 111.344 -174.824 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . 0.418 ' H ' ' C ' ' A' ' 22' ' ' SER . 81.0 mt -94.19 154.22 3.34 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.136 0 C-N-CA 124.498 1.119 . . . . 0.0 109.604 174.301 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . 0.507 ' HB2' HD13 ' A' ' 20' ' ' LEU . 30.3 t -168.44 107.38 0.49 Allowed 'General case' 0 CA--C 1.517 -0.306 0 CA-C-O 119.451 -0.309 . . . . 0.0 110.289 168.933 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . 0.421 ' O ' ' HE2' ' A' ' 30' ' ' LYS . . . -54.61 -39.57 67.13 Favored Glycine 0 CA--C 1.524 0.634 0 C-N-CA 120.091 -1.052 . . . . 0.0 110.618 179.924 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 29.0 t -63.08 -52.31 63.21 Favored 'General case' 0 N--CA 1.455 -0.193 0 CA-C-N 117.866 0.833 . . . . 0.0 110.745 -178.075 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 74.2 mmt-85 -68.17 -39.46 82.56 Favored 'General case' 0 C--O 1.231 0.129 0 O-C-N 122.103 -0.373 . . . . 0.0 110.265 -178.971 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 72.9 mt -61.01 -47.59 92.89 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.511 0 N-CA-C 109.595 -0.52 . . . . 0.0 109.595 178.789 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . 0.421 ' HE2' ' O ' ' A' ' 26' ' ' GLY . 51.2 mtmt -64.75 -28.97 69.94 Favored 'General case' 0 C--N 1.341 0.2 0 CA-C-O 119.289 -0.386 . . . . 0.0 111.151 -179.782 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . 0.434 ' HE2' ' HA ' ' A' ' 31' ' ' LYS . 4.6 mmpt? -65.63 -58.74 5.01 Favored 'General case' 0 C--O 1.231 0.085 0 CA-C-N 118.362 0.528 . . . . 0.0 110.839 179.547 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.556 HD12 ' N ' ' A' ' 33' ' ' THR . 1.6 pp -72.21 -20.97 61.48 Favored 'General case' 0 CA--C 1.528 0.115 0 C-N-CA 118.967 -1.093 . . . . 0.0 111.249 -177.642 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . 0.556 ' N ' HD12 ' A' ' 32' ' ' LEU . 55.2 m -72.51 -40.7 66.65 Favored 'General case' 0 N--CA 1.455 -0.215 0 N-CA-C 109.364 -0.606 . . . . 0.0 109.364 178.169 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 99.9 m -69.31 -38.29 78.17 Favored 'General case' 0 N--CA 1.451 -0.389 0 C-N-CA 121.008 -0.277 . . . . 0.0 110.392 -177.671 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 42.9 t80 -66.44 -34.33 77.7 Favored 'General case' 0 N--CA 1.455 -0.223 0 C-N-CA 119.821 -0.752 . . . . 0.0 110.047 176.547 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -71.49 -32.18 67.95 Favored 'General case' 0 N--CA 1.452 -0.347 0 CA-C-O 119.376 -0.345 . . . . 0.0 111.477 179.094 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -75.07 -34.1 61.77 Favored 'General case' 0 N--CA 1.457 -0.103 0 CA-C-N 118.129 0.422 . . . . 0.0 110.544 179.003 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 44.1 t0 -67.71 -22.74 65.24 Favored 'General case' 0 N--CA 1.455 -0.212 0 N-CA-C 110.403 -0.221 . . . . 0.0 110.403 175.86 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 98.1 m-70 -151.44 99.01 2.59 Favored 'General case' 0 C--N 1.342 0.263 0 C-N-CA 122.871 0.468 . . . . 0.0 111.461 -175.157 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 40' ' ' ILE . . . . . 0.505 ' H ' HD13 ' A' ' 40' ' ' ILE . 0.0 OUTLIER -75.91 -14.59 15.2 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.322 0 CA-C-O 119.268 -0.396 . . . . 0.0 110.478 175.14 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 89.4 m-20 -58.58 -16.88 17.76 Favored 'General case' 0 CA--C 1.531 0.232 0 N-CA-C 112.723 0.638 . . . . 0.0 112.723 -178.204 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -106.71 13.19 8.33 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.159 0 C-N-CA 122.803 0.441 . . . . 0.0 111.859 177.473 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 3.0 pp20? -52.49 -30.07 28.24 Favored 'General case' 0 CA--C 1.527 0.085 0 O-C-N 121.755 -0.591 . . . . 0.0 111.557 177.532 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 40.3 t -62.4 -48.19 80.79 Favored 'General case' 0 CA--C 1.53 0.209 0 N-CA-C 112.299 0.481 . . . . 0.0 112.299 -179.326 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 18.2 ptpt -71.93 -25.58 61.95 Favored 'General case' 0 C--N 1.339 0.139 0 N-CA-C 109.494 -0.558 . . . . 0.0 109.494 179.32 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 46' ' ' ILE . . . . . 0.467 HG12 ' CZ ' ' A' ' 10' ' ' PHE . 88.7 mt -71.01 -50.38 42.93 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.297 0 C-N-CA 122.798 0.439 . . . . 0.0 110.064 -178.96 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 35.5 mm -63.75 -35.03 71.58 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.169 0 N-CA-C 109.402 -0.592 . . . . 0.0 109.402 179.237 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 50.1 m -63.68 -39.4 94.22 Favored 'General case' 0 N--CA 1.452 -0.332 0 O-C-N 122.429 -0.17 . . . . 0.0 111.073 -179.192 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -78.46 -30.58 47.5 Favored 'General case' 0 N--CA 1.456 -0.163 0 N-CA-C 113.465 0.913 . . . . 0.0 113.465 -178.728 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 13.5 pt -70.15 -40.32 78.08 Favored 'Isoleucine or valine' 0 C--N 1.34 0.161 0 CA-C-N 119.963 1.256 . . . . 0.0 110.259 177.994 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 22.1 pt -69.11 -39.91 80.01 Favored 'Isoleucine or valine' 0 C--N 1.338 0.103 0 C-N-CA 120.138 -0.625 . . . . 0.0 110.315 179.584 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 44.4 t0 -65.42 -49.34 69.58 Favored 'General case' 0 N--CA 1.456 -0.174 0 CA-C-N 117.906 0.321 . . . . 0.0 110.841 178.492 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 44.5 t80 -62.74 -43.22 99.36 Favored 'General case' 0 N--CA 1.453 -0.31 0 N-CA-C 109.538 -0.542 . . . . 0.0 109.538 179.671 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 34.7 t -62.49 -30.83 71.55 Favored 'General case' 0 N--CA 1.454 -0.237 0 CA-C-N 118.175 0.443 . . . . 0.0 111.492 -177.786 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 7.1 tpt180 -81.34 -44.53 17.49 Favored 'General case' 0 N--CA 1.454 -0.25 0 CA-C-N 118.126 0.421 . . . . 0.0 111.271 -178.942 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 95.0 mt -77.37 -47.51 19.69 Favored 'General case' 0 N--CA 1.456 -0.146 0 N-CA-C 114.032 1.123 . . . . 0.0 114.032 -175.56 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 57' ' ' CYS . . . . . 0.425 ' HA ' ' HD3' ' A' ' 58' ' ' PRO . 13.5 p -61.39 158.46 38.09 Favored Pre-proline 0 CA--C 1.536 0.408 0 N-CA-C 113.957 1.095 . . . . 0.0 113.957 -169.718 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 58' ' ' PRO . . . . . 0.425 ' HD3' ' HA ' ' A' ' 57' ' ' CYS . 31.7 Cg_exo -59.12 174.05 1.09 Allowed 'Trans proline' 0 N--CA 1.455 -0.774 1 C-N-CA 125.801 4.334 . . . . 0.0 113.439 176.442 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 27.3 p30 -58.48 -47.75 83.06 Favored 'General case' 0 CA--C 1.531 0.225 0 CA-C-N 115.179 -0.919 . . . . 0.0 112.624 -173.695 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 34.3 m -70.66 -29.77 66.2 Favored 'General case' 0 N--CA 1.453 -0.299 0 CA-C-O 120.927 0.394 . . . . 0.0 110.18 -179.0 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 62.9 m80 -75.34 -27.16 59.1 Favored 'General case' 0 N--CA 1.45 -0.468 0 C-N-CA 122.812 0.445 . . . . 0.0 110.313 177.701 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . 0.416 ' HE2' ' O ' ' A' ' 57' ' ' CYS . 64.1 mttm -67.79 -37.46 82.05 Favored 'General case' 0 N--CA 1.457 -0.084 0 N-CA-C 109.668 -0.493 . . . . 0.0 109.668 171.613 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -62.79 -42.84 99.88 Favored 'General case' 0 CA--C 1.53 0.199 0 N-CA-C 108.045 -1.095 . . . . 0.0 108.045 173.341 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -66.83 -30.99 76.99 Favored Glycine 0 C--N 1.34 0.75 0 N-CA-C 111.811 -0.515 . . . . 0.0 111.811 -179.423 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 30.0 t -68.62 -40.45 80.37 Favored 'General case' 0 N--CA 1.45 -0.443 0 CA-C-N 117.665 0.732 . . . . 0.0 109.884 178.317 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 77.0 mt -70.99 -24.12 62.32 Favored 'General case' 0 N--CA 1.45 -0.438 0 N-CA-C 109.767 -0.457 . . . . 0.0 109.767 178.922 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -73.49 -38.85 65.25 Favored 'General case' 0 N--CA 1.456 -0.169 0 C-N-CA 122.822 0.449 . . . . 0.0 110.698 174.765 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 68' ' ' ILE . . . . . 0.443 HD11 ' CD1' ' A' ' 17' ' ' PHE . 19.6 mt -65.59 -51.06 67.61 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.295 0 N-CA-C 108.594 -0.891 . . . . 0.0 108.594 175.211 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 86.0 mt -55.89 -32.01 31.63 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.303 0 C-N-CA 123.662 0.785 . . . . 0.0 111.4 176.588 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 15.0 t70 -69.31 -51.41 37.43 Favored 'General case' 0 N--CA 1.454 -0.264 0 O-C-N 121.757 -0.589 . . . . 0.0 111.157 178.757 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 90.2 p -67.64 -48.06 67.79 Favored 'General case' 0 N--CA 1.452 -0.368 0 O-C-N 122.987 0.18 . . . . 0.0 111.059 -175.128 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -75.72 -34.79 29.32 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.168 0 N-CA-C 109.818 -0.438 . . . . 0.0 109.818 -179.672 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -67.82 -48.21 56.48 Favored Glycine 0 C--N 1.336 0.569 0 N-CA-C 110.811 -0.916 . . . . 0.0 110.811 -176.376 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 39.5 mtm180 -68.41 -42.9 78.33 Favored 'General case' 0 N--CA 1.448 -0.526 0 CA-C-N 117.408 0.604 . . . . 0.0 109.899 178.394 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -62.38 -31.31 71.96 Favored 'General case' 0 N--CA 1.449 -0.498 0 C-N-CA 120.302 -0.559 . . . . 0.0 110.498 -178.462 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 1.9 m-30 -70.86 -51.97 23.14 Favored 'General case' 0 N--CA 1.456 -0.169 0 CA-C-N 118.46 0.573 . . . . 0.0 110.934 176.413 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 43.6 tp -68.34 -36.92 79.96 Favored 'General case' 0 N--CA 1.449 -0.493 0 C-N-CA 118.212 -1.395 . . . . 0.0 110.092 -176.952 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 83.8 m-20 -64.89 -45.41 86.07 Favored 'General case' 0 N--CA 1.454 -0.274 0 CA-C-O 119.645 -0.217 . . . . 0.0 111.507 179.052 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 16.0 tm-20 -64.92 -49.04 71.95 Favored 'General case' 0 N--CA 1.446 -0.661 0 CA-C-N 118.17 0.441 . . . . 0.0 111.575 179.378 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 80' ' ' THR . . . . . 0.541 HG21 ' CB ' ' A' ' 94' ' ' CYS . 79.9 p -68.32 -25.45 65.12 Favored 'General case' 0 CA--C 1.531 0.243 0 CA-C-N 117.933 0.333 . . . . 0.0 110.577 -178.538 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 37.3 ttp-105 -74.73 -30.7 61.6 Favored 'General case' 0 CA--C 1.53 0.2 0 C-N-CA 122.813 0.445 . . . . 0.0 111.42 173.023 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 58.0 m . . . . . 0 N--CA 1.458 -0.063 0 N-CA-C 112.65 0.611 . . . . 0.0 112.65 -175.839 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 55.4 Cg_endo . . . . . 0 N--CA 1.454 -0.833 0 N-CA-C 108.352 -1.441 . . . . 0.0 108.352 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 95.76 15.53 42.51 Favored Glycine 0 CA--C 1.524 0.645 0 CA-C-O 119.464 -0.631 . . . . 0.0 112.314 -177.165 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 42.0 p -150.33 168.65 23.47 Favored 'General case' 0 C--N 1.34 0.157 0 CA-C-N 118.446 1.123 . . . . 0.0 111.436 177.825 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 94' ' ' CYS . . . . . 0.657 ' SG ' HD13 ' A' ' 98' ' ' ILE . 7.5 t -54.96 -28.12 48.99 Favored 'General case' 0 N--CA 1.449 -0.48 0 CA-C-N 115.021 -0.991 . . . . 0.0 109.653 173.262 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -57.84 -57.32 13.29 Favored 'General case' 0 N--CA 1.445 -0.71 0 N-CA-C 109.244 -0.65 . . . . 0.0 109.244 -178.324 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 61.0 t60 -75.64 -31.69 59.93 Favored 'General case' 0 N--CA 1.452 -0.35 0 C-N-CA 121.103 -0.239 . . . . 0.0 111.598 -179.193 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -67.4 -48.69 66.62 Favored 'General case' 0 N--CA 1.451 -0.422 0 O-C-N 122.92 0.138 . . . . 0.0 111.039 -177.255 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 98' ' ' ILE . . . . . 0.657 HD13 ' SG ' ' A' ' 94' ' ' CYS . 1.7 mp -73.69 -30.74 29.85 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.208 0 N-CA-C 109.903 -0.406 . . . . 0.0 109.903 179.998 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 3.5 m120 -64.68 -47.93 76.58 Favored 'General case' 0 N--CA 1.457 -0.09 0 CA-C-N 118.423 0.556 . . . . 0.0 110.942 175.104 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 47.5 m -72.39 -25.96 61.7 Favored 'General case' 0 N--CA 1.456 -0.157 0 C-N-CA 122.334 0.254 . . . . 0.0 110.563 -175.259 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 57.5 tp -80.33 -37.5 32.42 Favored 'General case' 0 N--CA 1.447 -0.595 0 C-N-CA 122.794 0.438 . . . . 0.0 110.867 178.876 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -75.02 -24.84 70.61 Favored Glycine 0 CA--C 1.527 0.809 0 CA-C-O 119.485 -0.619 . . . . 0.0 112.74 -175.954 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 24.1 pt-20 -78.14 -2.48 37.71 Favored 'General case' 0 CA--C 1.532 0.27 0 CA-C-N 117.98 0.89 . . . . 0.0 111.604 -179.928 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 36.0 m -138.47 9.56 0.69 Allowed 'Isoleucine or valine' 0 CA--C 1.529 0.167 0 N-CA-C 111.996 0.369 . . . . 0.0 111.996 176.288 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 105' ' ' ILE . . . . . . . . . . . . . 11.2 tp -62.28 -26.18 39.63 Favored 'Isoleucine or valine' 0 N--CA 1.458 -0.065 0 CA-C-N 118.697 0.681 . . . . 0.0 111.408 -175.367 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 10.2 pt20 -67.9 -28.47 67.53 Favored 'General case' 0 N--CA 1.453 -0.287 0 N-CA-C 110.154 -0.313 . . . . 0.0 110.154 178.617 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 74.6 mm-40 -75.55 -42.8 51.45 Favored 'General case' 0 N--CA 1.453 -0.283 0 N-CA-C 110.007 -0.368 . . . . 0.0 110.007 -178.017 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 7.3 mp -69.83 -43.77 71.3 Favored 'General case' 0 N--CA 1.448 -0.525 0 N-CA-C 109.703 -0.48 . . . . 0.0 109.703 -179.119 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 96.2 mt -66.72 -64.14 0.92 Allowed 'General case' 0 N--CA 1.452 -0.348 0 C-N-CA 120.592 -0.443 . . . . 0.0 110.261 178.788 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 21.1 t -50.86 -39.82 54.69 Favored 'General case' 0 C--O 1.233 0.199 0 N-CA-C 112.535 0.569 . . . . 0.0 112.535 -173.593 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 49.7 t0 -68.4 -43.8 76.44 Favored 'General case' 0 N--CA 1.456 -0.146 0 N-CA-C 110.206 -0.294 . . . . 0.0 110.206 178.914 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -69.21 -34.68 75.26 Favored 'General case' 0 N--CA 1.448 -0.569 0 CA-C-N 116.836 -0.166 . . . . 0.0 110.744 -178.137 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 113' ' ' ILE . . . . . . . . . . . . . 46.7 mm -66.96 -36.06 76.23 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.333 0 N-CA-C 109.334 -0.617 . . . . 0.0 109.334 179.204 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -74.81 -42.28 58.34 Favored 'General case' 0 N--CA 1.453 -0.31 0 N-CA-C 111.828 0.307 . . . . 0.0 111.828 178.03 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -78.14 -35.73 48.61 Favored 'General case' 0 N--CA 1.456 -0.163 0 N-CA-C 112.514 0.561 . . . . 0.0 112.514 -174.964 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 116' ' ' SER . . . . . 0.483 ' HB2' ' CB ' ' A' ' 120' ' ' HIS . 54.3 p -81.84 157.13 24.53 Favored 'General case' 0 N--CA 1.456 -0.172 0 N-CA-C 112.892 0.701 . . . . 0.0 112.892 -171.15 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 53.1 t30 -77.03 166.35 23.43 Favored 'General case' 0 C--O 1.226 -0.146 0 C-N-CA 123.203 0.601 . . . . 0.0 110.564 -178.563 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 118' ' ' GLN . . . . . . . . . . . . . 12.8 mt-30 -54.71 -36.54 64.83 Favored 'General case' 0 CA--C 1.531 0.221 0 N-CA-C 112.649 0.611 . . . . 0.0 112.649 -172.663 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 11.2 p-10 -70.99 -39.12 72.65 Favored 'General case' 0 C--O 1.226 -0.144 0 CA-C-O 121.099 0.476 . . . . 0.0 109.877 178.767 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 120' ' ' HIS . . . . . 0.483 ' CB ' ' HB2' ' A' ' 116' ' ' SER . 36.9 m170 -64.74 -38.89 92.53 Favored 'General case' 0 N--CA 1.45 -0.43 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.223 176.473 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 46.2 mttm -58.95 -43.4 91.23 Favored 'General case' 0 C--N 1.342 0.274 0 N-CA-C 108.719 -0.845 . . . . 0.0 108.719 177.196 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 41.6 tp10 -66.34 -38.73 88.3 Favored 'General case' 0 N--CA 1.454 -0.25 0 CA-C-O 119.459 -0.305 . . . . 0.0 111.358 -176.982 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 53.2 mtpt -65.74 -28.88 69.36 Favored 'General case' 0 N--CA 1.452 -0.341 0 CA-C-N 118.511 0.596 . . . . 0.0 110.225 177.729 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 124' ' ' ILE . . . . . . . . . . . . . 61.6 mt -74.44 -37.18 44.03 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.24 0 N-CA-C 109.544 -0.539 . . . . 0.0 109.544 176.822 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 55.8 mmm-85 -65.53 -42.81 91.57 Favored 'General case' 0 C--O 1.23 0.076 0 O-C-N 122.215 -0.303 . . . . 0.0 110.969 179.851 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 126' ' ' MET . . . . . . . . . . . . . 28.6 ptm -67.57 -29.54 68.93 Favored 'General case' 0 N--CA 1.454 -0.273 0 C-N-CA 119.747 -0.781 . . . . 0.0 109.237 176.563 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 1.7 mp -63.15 -29.61 70.93 Favored 'General case' 0 N--CA 1.455 -0.208 0 CA-C-O 118.993 -0.527 . . . . 0.0 110.29 172.849 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 76.0 mt -69.16 -43.2 74.76 Favored 'General case' 0 C--N 1.34 0.163 0 CA-C-N 119.23 0.923 . . . . 0.0 109.935 175.691 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 67.0 m-20 -60.17 -39.37 86.2 Favored 'General case' 0 N--CA 1.463 0.18 0 CA-C-N 118.331 0.514 . . . . 0.0 110.041 176.514 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 62.7 mt -66.15 -36.66 77.96 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.401 0 C-N-CA 122.911 0.484 . . . . 0.0 110.063 179.118 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 131' ' ' TRP . . . . . . . . . . . . . 49.4 m0 . . . . . 0 N--CA 1.455 -0.197 0 N-CA-C 112.56 0.578 . . . . 0.0 112.56 177.9 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 36.2 p-10 . . . . . 0 N--CA 1.453 -0.283 0 N-CA-C 108.788 -0.819 . . . . 0.0 108.788 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 7' ' ' PHE . . . . . 0.522 ' CE1' ' HD3' ' A' ' 45' ' ' LYS . 1.6 t80 -51.12 -37.31 45.3 Favored 'General case' 0 N--CA 1.448 -0.54 0 C-N-CA 124.375 1.07 . . . . 0.0 110.71 177.36 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 51.1 tp60 -53.64 -34.64 59.26 Favored 'General case' 0 N--CA 1.454 -0.268 0 C-N-CA 123.281 0.632 . . . . 0.0 111.579 -178.515 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 32.0 m-80 -72.49 -31.46 65.39 Favored 'General case' 0 N--CA 1.448 -0.528 0 N-CA-C 109.992 -0.373 . . . . 0.0 109.992 -179.587 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 10' ' ' PHE . . . . . 0.452 ' CE2' ' HB2' ' A' ' 32' ' ' LEU . 13.0 t80 -69.44 -40.94 76.89 Favored 'General case' 0 N--CA 1.449 -0.519 0 N-CA-C 108.986 -0.746 . . . . 0.0 108.986 175.412 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 62.6 t -64.35 -53.62 40.86 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.23 0 N-CA-C 108.657 -0.868 . . . . 0.0 108.657 179.467 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -59.84 -26.88 66.17 Favored 'General case' 0 N--CA 1.453 -0.279 0 C-N-CA 122.597 0.359 . . . . 0.0 111.808 179.534 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 91.2 m -74.25 -39.46 63.02 Favored 'General case' 0 CA--C 1.529 0.166 0 N-CA-C 109.077 -0.712 . . . . 0.0 109.077 176.703 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.495 ' HA ' ' CD1' ' A' ' 17' ' ' PHE . 10.9 tp -64.42 -45.31 88.09 Favored 'General case' 0 N--CA 1.452 -0.367 0 CA-C-O 121.374 0.607 . . . . 0.0 109.371 177.402 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 68.6 mm-40 -63.85 -28.28 69.74 Favored 'General case' 0 N--CA 1.453 -0.312 0 C-N-CA 124.069 0.948 . . . . 0.0 110.005 178.393 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 74.5 m -70.62 -28.19 64.66 Favored 'General case' 0 N--CA 1.453 -0.325 0 N-CA-C 109.616 -0.513 . . . . 0.0 109.616 177.281 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 17' ' ' PHE . . . . . 0.515 ' CE1' HD11 ' A' ' 68' ' ' ILE . 16.6 m-85 -69.74 -40.94 75.87 Favored 'General case' 0 N--CA 1.454 -0.243 0 C-N-CA 119.648 -0.821 . . . . 0.0 110.267 171.554 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 81.0 mttt -61.96 -28.51 69.6 Favored 'General case' 0 C--N 1.34 0.18 0 CA-C-O 120.617 0.246 . . . . 0.0 110.691 -178.575 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 46.3 t0 -71.42 -27.12 63.07 Favored 'General case' 0 CA--C 1.532 0.281 0 CA-C-N 115.826 -0.625 . . . . 0.0 112.192 -179.407 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 97.4 mt -74.02 152.92 39.89 Favored 'General case' 0 N--CA 1.455 -0.176 0 O-C-N 122.055 -0.403 . . . . 0.0 110.78 -177.563 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . 0.47 ' HE3' ' CA ' ' A' ' 21' ' ' LYS . 0.0 OUTLIER -77.13 -30.89 55.35 Favored 'General case' 0 C--N 1.339 0.135 0 N-CA-C 110.261 -0.274 . . . . 0.0 110.261 176.3 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 99.0 p -88.33 -22.47 23.82 Favored 'General case' 0 N--CA 1.457 -0.114 0 C-N-CA 122.983 0.513 . . . . 0.0 110.931 179.568 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 73.08 -22.04 0.98 Allowed Glycine 0 CA--C 1.527 0.801 0 C-N-CA 123.532 0.586 . . . . 0.0 112.752 178.919 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . 0.409 HD11 HD12 ' A' ' 63' ' ' LEU . 53.5 mt -78.93 149.38 5.57 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.212 0 N-CA-C 108.775 -0.824 . . . . 0.0 108.775 172.137 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 47.7 t -157.61 83.0 0.89 Allowed 'General case' 0 CA--C 1.517 -0.311 0 N-CA-C 110.146 -0.316 . . . . 0.0 110.146 177.355 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . 0.505 ' O ' ' HE2' ' A' ' 30' ' ' LYS . . . -48.58 -33.85 13.03 Favored Glycine 0 CA--C 1.526 0.741 0 N-CA-C 110.826 -0.91 . . . . 0.0 110.826 -178.89 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 4.7 t -67.76 -61.59 1.81 Allowed 'General case' 0 N--CA 1.452 -0.347 0 CA-C-N 117.407 0.604 . . . . 0.0 111.331 -178.084 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -72.68 -25.85 61.4 Favored 'General case' 0 N--CA 1.454 -0.256 0 CA-C-O 119.424 -0.322 . . . . 0.0 110.749 -175.615 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 56.7 mt -61.12 -46.51 96.49 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.332 0 N-CA-C 108.292 -1.003 . . . . 0.0 108.292 173.713 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . 0.505 ' HE2' ' O ' ' A' ' 26' ' ' GLY . 51.2 mtmt -64.74 -31.16 72.26 Favored 'General case' 0 C--N 1.34 0.154 0 CA-C-N 118.155 0.434 . . . . 0.0 111.258 178.268 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . 0.486 ' HA ' ' HE2' ' A' ' 31' ' ' LYS . 6.2 mmpt? -63.85 -59.93 3.92 Favored 'General case' 0 C--N 1.338 0.098 0 CA-C-O 119.215 -0.421 . . . . 0.0 111.61 -178.811 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.458 HD12 ' N ' ' A' ' 33' ' ' THR . 1.2 pp -75.51 -16.71 60.26 Favored 'General case' 0 CA--C 1.534 0.343 0 C-N-CA 119.539 -0.865 . . . . 0.0 111.942 -178.182 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . 0.458 ' N ' HD12 ' A' ' 32' ' ' LEU . 43.5 m -72.47 -38.36 68.23 Favored 'General case' 0 C--N 1.341 0.216 0 N-CA-C 108.656 -0.868 . . . . 0.0 108.656 174.58 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 80.4 m -70.03 -36.5 75.1 Favored 'General case' 0 N--CA 1.452 -0.371 0 N-CA-C 110.168 -0.308 . . . . 0.0 110.168 179.575 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 31.5 t80 -64.8 -36.11 83.26 Favored 'General case' 0 N--CA 1.456 -0.154 0 N-CA-C 109.791 -0.448 . . . . 0.0 109.791 176.045 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -71.36 -35.46 71.12 Favored 'General case' 0 N--CA 1.45 -0.451 0 CA-C-O 119.648 -0.215 . . . . 0.0 111.422 179.253 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 2.3 mm? -69.56 -32.37 71.12 Favored 'General case' 0 N--CA 1.455 -0.182 0 CA-C-O 119.74 -0.172 . . . . 0.0 110.578 179.858 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 40.2 t0 -69.44 -22.87 63.62 Favored 'General case' 0 N--CA 1.454 -0.246 0 O-C-N 122.9 0.125 . . . . 0.0 110.745 176.283 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 77.8 m80 -150.65 101.8 2.96 Favored 'General case' 0 N--CA 1.453 -0.305 0 N-CA-C 112.583 0.586 . . . . 0.0 112.583 -174.931 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 40' ' ' ILE . . . . . 0.606 ' H ' HD13 ' A' ' 40' ' ' ILE . 0.0 OUTLIER -74.56 -9.54 12.96 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.247 0 N-CA-C 109.701 -0.481 . . . . 0.0 109.701 170.865 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 34.0 m-20 -56.72 -17.64 9.69 Favored 'General case' 0 N--CA 1.457 -0.08 0 C-N-CA 124.3 1.04 . . . . 0.0 112.541 -178.92 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -120.08 17.96 6.37 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.267 0 C-N-CA 123.825 0.85 . . . . 0.0 111.461 -178.435 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 2.9 pp20? -52.64 -32.88 44.18 Favored 'General case' 0 CA--C 1.532 0.254 0 O-C-N 121.823 -0.548 . . . . 0.0 111.103 178.159 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 40.3 t -61.16 -46.66 89.6 Favored 'General case' 0 CA--C 1.531 0.242 0 N-CA-C 112.318 0.488 . . . . 0.0 112.318 -178.958 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . 0.522 ' HD3' ' CE1' ' A' ' 7' ' ' PHE . 19.1 ptpt -73.84 -24.13 59.73 Favored 'General case' 0 C--N 1.343 0.299 0 O-C-N 121.577 -0.702 . . . . 0.0 110.153 179.897 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 64.1 mt -71.65 -48.98 49.22 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.278 0 N-CA-C 109.733 -0.469 . . . . 0.0 109.733 -179.676 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 47' ' ' ILE . . . . . 0.455 HD13 HD11 ' A' ' 50' ' ' ILE . 39.4 mm -63.76 -35.93 74.8 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.237 0 N-CA-C 109.626 -0.509 . . . . 0.0 109.626 178.28 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 40.3 t -63.78 -43.48 96.24 Favored 'General case' 0 N--CA 1.455 -0.18 0 O-C-N 122.263 -0.273 . . . . 0.0 111.626 -178.985 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 33.3 mt -75.43 -33.22 60.89 Favored 'General case' 0 N--CA 1.449 -0.498 0 N-CA-C 113.23 0.826 . . . . 0.0 113.23 -176.286 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . 0.455 HD11 HD13 ' A' ' 47' ' ' ILE . 5.1 pt -72.65 -43.97 61.03 Favored 'Isoleucine or valine' 0 C--O 1.23 0.075 0 CA-C-N 119.284 0.947 . . . . 0.0 110.787 179.702 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 21.3 pt -62.21 -40.29 87.13 Favored 'Isoleucine or valine' 0 C--N 1.339 0.145 0 C-N-CA 119.628 -0.829 . . . . 0.0 109.962 178.366 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 94.0 m-20 -70.8 -33.62 70.91 Favored 'General case' 0 N--CA 1.455 -0.18 0 CA-C-N 118.061 0.392 . . . . 0.0 111.78 177.787 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 53' ' ' TYR . . . . . 0.455 ' CD2' ' HB2' ' A' ' 65' ' ' SER . 20.8 t80 -67.67 -34.26 76.57 Favored 'General case' 0 N--CA 1.454 -0.248 0 CA-C-N 118.535 0.607 . . . . 0.0 109.667 177.017 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 35.6 t -81.76 -18.26 44.84 Favored 'General case' 0 C--N 1.338 0.075 0 N-CA-C 111.882 0.327 . . . . 0.0 111.882 178.011 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 32.0 ttp180 -93.89 -42.86 8.86 Favored 'General case' 0 N--CA 1.453 -0.314 0 N-CA-C 112.797 0.666 . . . . 0.0 112.797 -178.19 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 41.8 mt -86.3 -49.37 7.72 Favored 'General case' 0 C--N 1.338 0.093 0 N-CA-C 113.407 0.892 . . . . 0.0 113.407 -175.222 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 57' ' ' CYS . . . . . 0.41 ' HB3' ' CD ' ' A' ' 58' ' ' PRO . 84.2 m -72.34 166.72 39.01 Favored Pre-proline 0 CA--C 1.533 0.326 0 N-CA-C 113.248 0.832 . . . . 0.0 113.248 -170.996 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 58' ' ' PRO . . . . . 0.41 ' CD ' ' HB3' ' A' ' 57' ' ' CYS . 35.6 Cg_exo -61.38 166.46 11.22 Favored 'Trans proline' 0 N--CA 1.453 -0.909 1 C-N-CA 125.816 4.344 . . . . 0.0 113.404 -175.178 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 31.8 p-10 -53.86 -44.66 70.56 Favored 'General case' 0 C--N 1.329 -0.314 0 C-N-CA 125.146 1.378 . . . . 0.0 113.618 -171.328 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 9.3 t -71.73 -29.13 64.19 Favored 'General case' 0 N--CA 1.452 -0.354 0 O-C-N 122.049 -0.407 . . . . 0.0 110.151 -179.623 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 52.8 m80 -75.82 -29.47 58.68 Favored 'General case' 0 N--CA 1.452 -0.361 0 C-N-CA 122.692 0.397 . . . . 0.0 109.965 176.104 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 59.1 mttm -61.93 -41.81 98.38 Favored 'General case' 0 C--N 1.341 0.197 0 N-CA-C 109.559 -0.534 . . . . 0.0 109.559 173.164 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . 0.466 HD23 HG13 ' A' ' 124' ' ' ILE . 3.0 tm? -63.03 -45.5 92.0 Favored 'General case' 0 N--CA 1.455 -0.222 0 N-CA-C 109.024 -0.732 . . . . 0.0 109.024 177.227 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -61.53 -27.17 67.55 Favored Glycine 0 C--N 1.339 0.729 0 N-CA-C 112.108 -0.397 . . . . 0.0 112.108 -178.95 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 65' ' ' SER . . . . . 0.455 ' HB2' ' CD2' ' A' ' 53' ' ' TYR . 30.1 t -74.66 -39.02 62.29 Favored 'General case' 0 N--CA 1.451 -0.397 0 CA-C-N 117.694 0.747 . . . . 0.0 110.561 176.795 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 82.9 mt -66.21 -23.49 66.44 Favored 'General case' 0 N--CA 1.452 -0.365 0 N-CA-C 109.721 -0.474 . . . . 0.0 109.721 177.546 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 2.3 m-30 -73.69 -39.33 64.44 Favored 'General case' 0 C--O 1.233 0.226 0 C-N-CA 122.397 0.279 . . . . 0.0 110.428 173.926 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 68' ' ' ILE . . . . . 0.515 HD11 ' CE1' ' A' ' 17' ' ' PHE . 31.5 mt -64.88 -51.19 70.0 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.543 0 N-CA-C 107.51 -1.293 . . . . 0.0 107.51 177.055 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 69' ' ' ILE . . . . . 0.451 HG12 HD12 ' A' ' 50' ' ' ILE . 43.5 mt -50.26 -36.84 13.45 Favored 'Isoleucine or valine' 0 CA--C 1.528 0.133 0 C-N-CA 124.21 1.004 . . . . 0.0 111.778 174.828 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 16.6 t70 -69.87 -53.86 16.1 Favored 'General case' 0 N--CA 1.455 -0.193 0 CA-C-N 118.774 0.715 . . . . 0.0 111.116 180.0 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 79.2 p -67.89 -46.72 70.83 Favored 'General case' 0 N--CA 1.451 -0.42 0 CA-C-N 116.717 -0.22 . . . . 0.0 110.772 -174.96 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -74.84 -35.03 35.1 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.133 0 N-CA-C 109.359 -0.608 . . . . 0.0 109.359 -179.172 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -65.82 -50.76 51.41 Favored Glycine 0 C--N 1.339 0.724 0 N-CA-C 111.58 -0.608 . . . . 0.0 111.58 -175.836 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 41.7 mtm105 -69.73 -38.56 76.91 Favored 'General case' 0 N--CA 1.451 -0.4 0 CA-C-N 117.267 0.533 . . . . 0.0 110.227 179.061 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -66.57 -32.68 74.17 Favored 'General case' 0 N--CA 1.451 -0.391 0 C-N-CA 120.714 -0.395 . . . . 0.0 110.743 -179.101 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 1.0 OUTLIER -68.72 -43.52 75.79 Favored 'General case' 0 CA--C 1.518 -0.28 0 CA-C-N 118.527 0.603 . . . . 0.0 110.297 176.091 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . 0.427 HD13 ' C ' ' A' ' 77' ' ' LEU . 3.0 tm? -64.89 -47.72 76.81 Favored 'General case' 0 N--CA 1.448 -0.534 0 C-N-CA 118.359 -1.336 . . . . 0.0 108.049 178.978 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 46.9 m-20 -58.25 -43.65 87.95 Favored 'General case' 0 C--O 1.23 0.065 0 N-CA-C 112.38 0.511 . . . . 0.0 112.38 -178.063 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 10.4 tm-20 -63.96 -45.06 90.78 Favored 'General case' 0 N--CA 1.447 -0.583 0 CA-C-N 118.186 0.448 . . . . 0.0 110.623 -177.81 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 61.2 p -69.8 -37.62 76.37 Favored 'General case' 0 N--CA 1.453 -0.321 0 CA-C-O 118.927 -0.559 . . . . 0.0 111.1 -177.136 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 7.4 ppt_? -75.85 -16.55 60.05 Favored 'General case' 0 C--N 1.341 0.211 0 CA-C-N 118.823 0.738 . . . . 0.0 111.627 178.05 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 36.9 m . . . . . 0 N--CA 1.456 -0.145 0 N-CA-C 112.353 0.501 . . . . 0.0 112.353 179.132 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_endo . . . . . 0 N--CA 1.453 -0.875 0 N-CA-C 110.384 -0.66 . . . . 0.0 110.384 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 96.04 17.29 35.41 Favored Glycine 0 CA--C 1.523 0.586 0 CA-C-O 119.363 -0.687 . . . . 0.0 112.908 177.071 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 35.2 p -151.77 169.24 22.7 Favored 'General case' 0 CA--C 1.518 -0.266 0 C-N-CA 123.907 0.883 . . . . 0.0 109.227 175.974 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 94' ' ' CYS . . . . . 0.432 ' HA ' ' HB3' ' A' ' 97' ' ' ALA . 1.8 p -67.16 -16.95 64.63 Favored 'General case' 0 N--CA 1.447 -0.612 0 N-CA-C 109.692 -0.485 . . . . 0.0 109.692 178.599 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -62.91 -57.24 11.46 Favored 'General case' 0 N--CA 1.449 -0.5 0 N-CA-C 109.833 -0.432 . . . . 0.0 109.833 -177.104 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 72.9 t60 -72.39 -31.25 65.4 Favored 'General case' 0 N--CA 1.451 -0.408 0 N-CA-C 110.208 -0.293 . . . . 0.0 110.208 179.243 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 97' ' ' ALA . . . . . 0.432 ' HB3' ' HA ' ' A' ' 94' ' ' CYS . . . -65.67 -56.56 11.5 Favored 'General case' 0 N--CA 1.451 -0.417 0 O-C-N 123.274 0.359 . . . . 0.0 111.517 -178.32 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 2.1 mp -67.72 -34.62 68.95 Favored 'Isoleucine or valine' 0 C--N 1.34 0.195 0 C-N-CA 120.494 -0.483 . . . . 0.0 110.456 -179.13 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 69.2 m-20 -66.71 -45.1 79.82 Favored 'General case' 0 N--CA 1.45 -0.448 0 CA-C-N 118.157 0.435 . . . . 0.0 111.509 179.534 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 98.3 m -69.12 -29.62 67.72 Favored 'General case' 0 C--N 1.338 0.088 0 CA-C-N 117.976 0.353 . . . . 0.0 110.455 -177.227 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 62.2 tp -74.11 -33.98 63.77 Favored 'General case' 0 N--CA 1.447 -0.607 0 C-N-CA 122.758 0.423 . . . . 0.0 110.431 179.558 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -67.59 -17.4 68.86 Favored Glycine 0 CA--C 1.526 0.774 0 CA-C-O 119.636 -0.536 . . . . 0.0 112.845 -177.232 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 25.5 mt-10 -79.5 -25.93 41.7 Favored 'General case' 0 C--N 1.338 0.096 0 CA-C-N 118.004 0.902 . . . . 0.0 111.316 -179.696 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 25.3 m -116.92 -6.67 11.91 Favored 'Isoleucine or valine' 0 C--O 1.23 0.061 0 N-CA-C 112.924 0.713 . . . . 0.0 112.924 -174.687 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 105' ' ' ILE . . . . . . . . . . . . . 17.5 tt -60.09 -23.07 26.17 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.25 0 CA-C-N 118.979 0.809 . . . . 0.0 111.635 -179.694 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 25.7 pt20 -61.6 -35.0 76.62 Favored 'General case' 0 N--CA 1.45 -0.447 0 C-N-CA 122.867 0.467 . . . . 0.0 110.19 175.906 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 49.2 mt-10 -71.95 -40.88 68.39 Favored 'General case' 0 N--CA 1.454 -0.232 0 N-CA-C 109.454 -0.573 . . . . 0.0 109.454 -179.828 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 20.2 mt -73.0 -40.87 64.84 Favored 'General case' 0 N--CA 1.449 -0.512 0 CA-C-N 115.899 -0.592 . . . . 0.0 110.706 -173.283 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 84.7 mt -68.56 -63.17 1.11 Allowed 'General case' 0 N--CA 1.448 -0.539 0 N-CA-C 109.626 -0.509 . . . . 0.0 109.626 178.517 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 24.4 p -46.0 -48.37 16.63 Favored 'General case' 0 CA--C 1.52 -0.183 0 C-N-CA 122.613 0.365 . . . . 0.0 111.976 -177.329 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 39.3 t0 -70.66 -35.99 73.14 Favored 'General case' 0 N--CA 1.447 -0.579 0 CA-C-N 116.882 -0.144 . . . . 0.0 110.977 -176.148 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -72.88 -31.54 64.77 Favored 'General case' 0 N--CA 1.448 -0.528 0 C-N-CA 120.882 -0.327 . . . . 0.0 110.735 -178.487 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 113' ' ' ILE . . . . . . . . . . . . . 45.4 mm -68.33 -40.86 83.12 Favored 'Isoleucine or valine' 0 C--N 1.339 0.111 0 N-CA-C 108.892 -0.781 . . . . 0.0 108.892 176.316 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -72.78 -38.3 67.33 Favored 'General case' 0 N--CA 1.45 -0.441 0 CA-C-N 115.697 -0.683 . . . . 0.0 111.926 -177.562 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -90.46 -33.53 15.95 Favored 'General case' 0 N--CA 1.453 -0.283 0 N-CA-C 113.844 1.053 . . . . 0.0 113.844 -174.968 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 116' ' ' SER . . . . . 0.525 ' O ' ' HE3' ' A' ' 121' ' ' LYS . 1.0 OUTLIER -89.4 160.47 16.8 Favored 'General case' 0 C--N 1.339 0.111 0 N-CA-C 113.45 0.907 . . . . 0.0 113.45 -167.886 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 46.4 t30 -75.51 169.69 17.6 Favored 'General case' 0 C--O 1.226 -0.164 0 C-N-CA 123.983 0.913 . . . . 0.0 111.872 -173.941 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 118' ' ' GLN . . . . . . . . . . . . . 14.8 mm100 -54.37 -37.23 64.74 Favored 'General case' 0 C--N 1.338 0.094 0 C-N-CA 124.03 0.932 . . . . 0.0 112.954 -173.456 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 16.7 p-10 -69.28 -43.3 74.16 Favored 'General case' 0 N--CA 1.453 -0.301 0 N-CA-C 109.393 -0.595 . . . . 0.0 109.393 179.401 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 78.8 m-70 -69.22 -36.12 76.9 Favored 'General case' 0 N--CA 1.45 -0.444 0 CA-C-O 119.311 -0.376 . . . . 0.0 110.939 177.949 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 121' ' ' LYS . . . . . 0.525 ' HE3' ' O ' ' A' ' 116' ' ' SER . 89.8 mttt -58.49 -40.91 84.08 Favored 'General case' 0 C--O 1.231 0.129 0 N-CA-C 108.793 -0.817 . . . . 0.0 108.793 176.063 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 38.3 tp10 -73.99 -35.13 64.41 Favored 'General case' 0 N--CA 1.451 -0.378 0 C-N-CA 122.32 0.248 . . . . 0.0 110.93 179.849 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 84.9 mttt -63.95 -37.65 88.2 Favored 'General case' 0 N--CA 1.453 -0.296 0 N-CA-C 109.546 -0.538 . . . . 0.0 109.546 177.572 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 124' ' ' ILE . . . . . 0.466 HG13 HD23 ' A' ' 63' ' ' LEU . 56.4 mt -66.05 -38.92 83.11 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.182 0 N-CA-C 110.032 -0.359 . . . . 0.0 110.032 174.737 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 17.5 mtp180 -66.43 -42.31 87.91 Favored 'General case' 0 C--N 1.34 0.158 0 C-N-CA 122.404 0.282 . . . . 0.0 111.398 -177.356 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 126' ' ' MET . . . . . . . . . . . . . 17.8 ptp -68.42 -31.55 70.96 Favored 'General case' 0 N--CA 1.452 -0.325 0 C-N-CA 119.613 -0.835 . . . . 0.0 109.424 176.482 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 2.2 mp -63.25 -35.39 80.18 Favored 'General case' 0 N--CA 1.454 -0.267 0 N-CA-C 109.695 -0.483 . . . . 0.0 109.695 177.245 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 99.2 mt -68.34 -38.15 81.22 Favored 'General case' 0 N--CA 1.454 -0.256 0 CA-C-N 118.471 0.578 . . . . 0.0 110.049 177.687 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 14.9 t0 -65.49 -45.63 82.84 Favored 'General case' 0 CA--C 1.531 0.212 0 CA-C-N 118.055 0.389 . . . . 0.0 110.052 175.567 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 51.5 mt -61.11 -34.11 58.86 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.296 0 C-N-CA 123.031 0.532 . . . . 0.0 110.202 -178.721 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 131' ' ' TRP . . . . . . . . . . . . . 50.5 m0 . . . . . 0 N--CA 1.452 -0.371 0 N-CA-C 112.928 0.714 . . . . 0.0 112.928 179.271 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 21.2 p-10 . . . . . 0 N--CA 1.457 -0.111 0 N-CA-C 108.032 -1.099 . . . . 0.0 108.032 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 7' ' ' PHE . . . . . 0.498 ' CD1' ' HD3' ' A' ' 45' ' ' LYS . 1.2 t80 -55.03 -30.47 59.62 Favored 'General case' 0 N--CA 1.445 -0.695 0 C-N-CA 126.09 1.756 . . . . 0.0 111.213 -178.02 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 52.1 tp60 -50.48 -36.51 33.97 Favored 'General case' 0 N--CA 1.455 -0.218 0 C-N-CA 124.125 0.97 . . . . 0.0 111.878 -177.679 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 33.8 m-80 -72.36 -36.36 68.75 Favored 'General case' 0 N--CA 1.454 -0.251 0 CA-C-N 117.939 0.336 . . . . 0.0 110.294 -179.195 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 1.9 t80 -70.84 -39.27 73.08 Favored 'General case' 0 N--CA 1.452 -0.336 0 C-N-CA 123.519 0.728 . . . . 0.0 109.044 178.008 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 76.6 t -66.59 -53.02 39.58 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.385 0 N-CA-C 108.776 -0.824 . . . . 0.0 108.776 179.446 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -60.07 -31.25 69.83 Favored 'General case' 0 N--CA 1.454 -0.267 0 C-N-CA 122.759 0.424 . . . . 0.0 111.839 -178.517 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 86.6 m -67.53 -43.78 79.95 Favored 'General case' 0 CA--C 1.531 0.241 0 N-CA-C 108.691 -0.855 . . . . 0.0 108.691 176.488 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.443 HD22 ' HG ' ' A' ' 49' ' ' LEU . 5.5 tp -69.36 -39.56 78.02 Favored 'General case' 0 N--CA 1.452 -0.356 0 CA-C-N 116.418 -0.355 . . . . 0.0 111.278 -179.559 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 69.4 mm-40 -62.73 -33.76 75.8 Favored 'General case' 0 N--CA 1.451 -0.421 0 C-N-CA 123.596 0.758 . . . . 0.0 109.206 178.226 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 49.5 m -66.21 -32.89 74.59 Favored 'General case' 0 N--CA 1.451 -0.412 0 N-CA-C 108.881 -0.785 . . . . 0.0 108.881 176.774 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 17' ' ' PHE . . . . . 0.467 ' CE2' ' HB3' ' A' ' 25' ' ' SER . 14.8 m-30 -69.83 -33.82 72.83 Favored 'General case' 0 C--N 1.339 0.126 0 N-CA-C 112.2 0.444 . . . . 0.0 112.2 174.904 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 70.5 mttt -64.54 -27.08 68.72 Favored 'General case' 0 C--N 1.339 0.134 0 N-CA-C 109.243 -0.651 . . . . 0.0 109.243 174.944 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 43.8 t0 -79.41 -22.24 44.54 Favored 'General case' 0 CA--C 1.535 0.368 0 CA-C-N 115.701 -0.681 . . . . 0.0 111.898 177.009 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 81.1 mt -72.65 148.54 44.69 Favored 'General case' 0 N--CA 1.457 -0.11 0 O-C-N 121.152 -0.968 . . . . 0.0 110.674 179.649 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 1.6 mppt? -86.73 20.31 2.6 Favored 'General case' 0 CA--C 1.534 0.351 0 CA-C-N 115.653 -0.703 . . . . 0.0 109.33 175.713 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 79.9 p -147.46 -32.51 0.29 Allowed 'General case' 0 CA--C 1.53 0.198 0 C-N-CA 123.953 0.901 . . . . 0.0 111.237 -176.803 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 80.07 -19.91 6.17 Favored Glycine 0 CA--C 1.527 0.841 0 CA-C-O 119.601 -0.555 . . . . 0.0 113.63 176.194 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 96.3 mt -89.86 145.88 6.86 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.128 0 CA-C-N 118.059 0.93 . . . . 0.0 109.549 176.188 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . 0.467 ' HB3' ' CE2' ' A' ' 17' ' ' PHE . 33.4 t -166.71 88.53 0.34 Allowed 'General case' 0 N--CA 1.455 -0.225 0 CA-C-N 117.679 0.218 . . . . 0.0 110.813 176.517 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -47.58 -56.55 8.27 Favored Glycine 0 CA--C 1.528 0.861 0 CA-C-O 119.111 -0.827 . . . . 0.0 114.623 -170.753 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . 0.588 ' HA ' ' HE3' ' A' ' 30' ' ' LYS . 38.9 m -63.55 -36.25 83.17 Favored 'General case' 0 CA--C 1.524 -0.027 0 CA-C-N 119.2 1.5 . . . . 0.0 112.026 -176.328 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -75.76 -37.54 59.17 Favored 'General case' 0 CA--C 1.529 0.172 0 N-CA-C 109.846 -0.427 . . . . 0.0 109.846 179.079 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 60.6 mt -58.03 -42.82 83.72 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.501 0 N-CA-C 108.237 -1.023 . . . . 0.0 108.237 172.163 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . 0.588 ' HE3' ' HA ' ' A' ' 27' ' ' SER . 45.2 mtmt -69.1 -23.36 63.99 Favored 'General case' 0 N--CA 1.454 -0.226 0 CA-C-O 118.846 -0.597 . . . . 0.0 111.497 178.777 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . 0.469 ' CE ' ' HA ' ' A' ' 31' ' ' LYS . 3.9 mmpt? -67.64 -51.59 48.18 Favored 'General case' 0 C--N 1.34 0.183 0 CA-C-N 118.904 0.775 . . . . 0.0 110.314 175.405 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 4.2 pp -75.0 -23.25 58.21 Favored 'General case' 0 CA--C 1.531 0.227 0 C-N-CA 119.943 -0.703 . . . . 0.0 110.671 179.431 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . 0.402 ' HB ' ' HA ' ' A' ' 30' ' ' LYS . 51.9 m -71.54 -39.34 70.76 Favored 'General case' 0 CA--C 1.523 -0.095 0 N-CA-C 109.678 -0.489 . . . . 0.0 109.678 177.125 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 99.7 m -70.61 -41.46 72.22 Favored 'General case' 0 N--CA 1.45 -0.47 0 N-CA-C 109.685 -0.487 . . . . 0.0 109.685 -177.881 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 29.1 t80 -66.07 -30.29 70.78 Favored 'General case' 0 N--CA 1.453 -0.282 0 C-N-CA 119.772 -0.771 . . . . 0.0 109.815 178.206 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -71.03 -27.86 63.97 Favored 'General case' 0 N--CA 1.449 -0.489 0 CA-C-O 119.492 -0.289 . . . . 0.0 111.375 176.102 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . 0.405 HD23 ' HA ' ' A' ' 37' ' ' LEU . 11.4 mt -81.18 -39.63 25.17 Favored 'General case' 0 CA--C 1.519 -0.242 0 N-CA-C 108.926 -0.768 . . . . 0.0 108.926 -179.943 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 86.1 m-20 -58.65 -30.79 67.58 Favored 'General case' 0 N--CA 1.44 -0.949 0 C-N-CA 123.843 0.857 . . . . 0.0 110.633 175.076 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 78.4 m80 -149.93 103.3 3.2 Favored 'General case' 0 N--CA 1.453 -0.306 0 C-N-CA 122.885 0.474 . . . . 0.0 111.299 179.147 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 40' ' ' ILE . . . . . 0.638 ' H ' HD13 ' A' ' 40' ' ' ILE . 0.0 OUTLIER -75.72 -9.92 13.1 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.449 0 N-CA-C 109.136 -0.69 . . . . 0.0 109.136 172.672 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 4.6 m-20 -55.21 -25.11 30.95 Favored 'General case' 0 N--CA 1.455 -0.224 0 C-N-CA 124.026 0.931 . . . . 0.0 111.58 -177.744 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -105.62 16.33 6.45 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.328 0 C-N-CA 123.454 0.701 . . . . 0.0 112.105 -179.656 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 2.7 pp20? -52.31 -31.31 32.48 Favored 'General case' 0 CA--C 1.529 0.135 0 CA-C-N 118.641 0.655 . . . . 0.0 111.051 178.583 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 40.8 t -62.27 -46.85 86.95 Favored 'General case' 0 CA--C 1.531 0.238 0 N-CA-C 112.265 0.469 . . . . 0.0 112.265 -177.879 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . 0.498 ' HD3' ' CD1' ' A' ' 7' ' ' PHE . 14.6 ptpt -74.34 -23.49 59.05 Favored 'General case' 0 C--N 1.341 0.219 0 O-C-N 121.892 -0.505 . . . . 0.0 110.149 179.21 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 85.5 mt -73.74 -47.81 42.45 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.307 0 N-CA-C 110.059 -0.348 . . . . 0.0 110.059 -178.697 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 40.7 mm -66.93 -38.28 81.08 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.13 0 N-CA-C 109.781 -0.452 . . . . 0.0 109.781 179.415 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 27.8 t -64.78 -34.25 77.91 Favored 'General case' 0 N--CA 1.454 -0.258 0 C-N-CA 121.103 -0.239 . . . . 0.0 110.459 178.14 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . 0.454 HD22 ' CE1' ' A' ' 7' ' ' PHE . 40.9 tp -75.15 -34.51 61.63 Favored 'General case' 0 N--CA 1.452 -0.353 0 N-CA-C 112.673 0.62 . . . . 0.0 112.673 -176.605 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 11.4 pt -71.23 -43.21 74.73 Favored 'Isoleucine or valine' 0 C--N 1.339 0.151 0 CA-C-N 118.459 0.572 . . . . 0.0 110.162 178.574 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 35.4 pt -65.29 -39.77 86.41 Favored 'Isoleucine or valine' 0 C--O 1.231 0.103 0 C-N-CA 119.87 -0.732 . . . . 0.0 110.842 -178.516 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 78.3 m-20 -65.11 -51.46 61.14 Favored 'General case' 0 N--CA 1.454 -0.254 0 CA-C-N 117.462 0.119 . . . . 0.0 111.214 179.04 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 53' ' ' TYR . . . . . 0.421 ' CB ' HD21 ' A' ' 14' ' ' LEU . 15.9 t80 -63.95 -45.54 88.72 Favored 'General case' 0 N--CA 1.453 -0.306 0 N-CA-C 110.1 -0.334 . . . . 0.0 110.1 -179.293 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 31.7 t -65.2 -29.9 70.75 Favored 'General case' 0 N--CA 1.455 -0.216 0 N-CA-C 112.646 0.61 . . . . 0.0 112.646 -175.204 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 17.0 tpt85 -82.14 -36.67 27.2 Favored 'General case' 0 N--CA 1.454 -0.235 0 C-N-CA 119.697 -0.801 . . . . 0.0 111.193 -178.492 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 57.7 mt -80.98 -43.26 19.93 Favored 'General case' 0 C--O 1.227 -0.111 0 N-CA-C 112.764 0.654 . . . . 0.0 112.764 -178.482 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 57' ' ' CYS . . . . . 0.466 ' HB2' ' HD2' ' A' ' 58' ' ' PRO . 13.3 p -62.06 159.78 35.09 Favored Pre-proline 0 CA--C 1.536 0.419 0 N-CA-C 112.875 0.695 . . . . 0.0 112.875 -173.93 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 58' ' ' PRO . . . . . 0.466 ' HD2' ' HB2' ' A' ' 57' ' ' CYS . 84.3 Cg_endo -74.7 169.94 21.45 Favored 'Trans proline' 0 N--CA 1.451 -1.014 0 C-N-CA 124.209 3.272 . . . . 0.0 110.183 179.4 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -50.5 -47.04 57.45 Favored 'General case' 0 N--CA 1.457 -0.124 0 N-CA-C 114.287 1.218 . . . . 0.0 114.287 -170.795 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 16.6 t -66.79 -32.1 73.16 Favored 'General case' 0 N--CA 1.455 -0.198 0 C-N-CA 119.539 -0.864 . . . . 0.0 110.038 -177.323 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 54.8 m170 -76.03 -27.55 57.36 Favored 'General case' 0 N--CA 1.453 -0.276 0 N-CA-C 109.973 -0.38 . . . . 0.0 109.973 177.221 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 68.0 mttm -65.73 -39.87 91.58 Favored 'General case' 0 C--N 1.343 0.305 0 N-CA-C 109.106 -0.702 . . . . 0.0 109.106 174.074 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -63.08 -41.64 99.46 Favored 'General case' 0 N--CA 1.452 -0.374 0 N-CA-C 108.283 -1.006 . . . . 0.0 108.283 176.702 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -67.63 -31.56 76.51 Favored Glycine 0 CA--C 1.525 0.704 0 CA-C-O 119.713 -0.493 . . . . 0.0 112.271 -179.197 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 22.6 t -74.28 -32.75 63.02 Favored 'General case' 0 N--CA 1.453 -0.277 0 CA-C-N 118.118 0.959 . . . . 0.0 110.566 178.157 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 69.1 mt -71.99 -24.86 61.64 Favored 'General case' 0 N--CA 1.452 -0.328 0 N-CA-C 109.336 -0.616 . . . . 0.0 109.336 176.037 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -72.47 -36.88 68.59 Favored 'General case' 0 N--CA 1.455 -0.19 0 N-CA-C 110.333 -0.247 . . . . 0.0 110.333 174.533 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 68' ' ' ILE . . . . . . . . . . . . . 27.1 mt -66.65 -49.58 73.53 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.356 0 N-CA-C 108.811 -0.811 . . . . 0.0 108.811 174.886 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 67.1 mt -54.14 -34.68 27.43 Favored 'Isoleucine or valine' 0 C--O 1.226 -0.177 0 C-N-CA 123.085 0.554 . . . . 0.0 111.702 175.78 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 28.9 t70 -68.3 -44.58 75.11 Favored 'General case' 0 N--CA 1.452 -0.331 0 CA-C-N 119.112 0.869 . . . . 0.0 110.651 176.538 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 31.9 t -67.45 -57.22 6.93 Favored 'General case' 0 N--CA 1.451 -0.382 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.926 -176.804 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 72' ' ' ILE . . . . . 0.408 HD11 ' CZ ' ' A' ' 76' ' ' TYR . 0.0 OUTLIER -75.12 -30.58 23.38 Favored 'Isoleucine or valine' 0 CA--C 1.523 -0.075 0 N-CA-C 110.465 -0.198 . . . . 0.0 110.465 -177.469 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -68.49 -54.3 16.64 Favored Glycine 0 C--N 1.336 0.545 0 N-CA-C 111.582 -0.607 . . . . 0.0 111.582 -175.774 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 44.3 mtm105 -69.75 -37.34 76.4 Favored 'General case' 0 N--CA 1.452 -0.327 0 C-N-CA 120.273 -0.571 . . . . 0.0 109.737 179.294 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -60.29 -37.02 79.22 Favored 'General case' 0 N--CA 1.45 -0.456 0 C-N-CA 120.299 -0.56 . . . . 0.0 110.323 179.486 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 76' ' ' TYR . . . . . 0.408 ' CZ ' HD11 ' A' ' 72' ' ' ILE . 2.1 m-30 -68.05 -54.08 20.94 Favored 'General case' 0 N--CA 1.451 -0.378 0 CA-C-N 118.075 0.398 . . . . 0.0 111.045 178.765 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 1.5 tt -67.84 -42.27 81.66 Favored 'General case' 0 N--CA 1.448 -0.531 0 C-N-CA 118.813 -1.155 . . . . 0.0 109.003 -174.837 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 79.6 m-20 -61.72 -49.45 76.4 Favored 'General case' 0 CA--C 1.531 0.235 0 N-CA-C 112.946 0.721 . . . . 0.0 112.946 179.07 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 65.5 mm-40 -66.32 -42.96 87.5 Favored 'General case' 0 C--N 1.34 0.158 0 CA-C-N 119.452 1.024 . . . . 0.0 111.688 -178.279 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 42.6 p -65.03 -35.34 80.87 Favored 'General case' 0 N--CA 1.45 -0.432 0 N-CA-C 109.737 -0.468 . . . . 0.0 109.737 178.15 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 33.1 ttp180 -69.16 -43.22 74.71 Favored 'General case' 0 N--CA 1.45 -0.432 0 C-N-CA 123.613 0.765 . . . . 0.0 111.792 179.259 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 42.0 t . . . . . 0 N--CA 1.454 -0.254 0 N-CA-C 113.568 0.951 . . . . 0.0 113.568 -176.56 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 70.5 Cg_exo . . . . . 0 N--CA 1.45 -1.075 0 N-CA-C 109.727 -0.913 . . . . 0.0 109.727 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 92.69 20.27 34.86 Favored Glycine 0 CA--C 1.528 0.851 0 CA-C-O 119.21 -0.772 . . . . 0.0 112.487 -178.246 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 60.6 p -151.67 167.61 27.61 Favored 'General case' 0 CA--C 1.522 -0.119 0 CA-C-N 118.11 0.955 . . . . 0.0 110.26 176.118 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 94' ' ' CYS . . . . . 0.461 ' HB2' HD13 ' A' ' 98' ' ' ILE . 17.2 p -59.51 -24.69 63.85 Favored 'General case' 0 N--CA 1.449 -0.512 0 CA-C-N 115.623 -0.717 . . . . 0.0 109.779 175.794 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -63.4 -57.65 9.61 Favored 'General case' 0 N--CA 1.446 -0.656 0 N-CA-C 109.376 -0.601 . . . . 0.0 109.376 -173.59 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 66.5 t60 -74.78 -29.28 61.06 Favored 'General case' 0 N--CA 1.449 -0.524 0 CA-C-N 116.553 -0.294 . . . . 0.0 110.631 -179.464 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -67.41 -54.52 19.7 Favored 'General case' 0 N--CA 1.452 -0.336 0 N-CA-C 111.643 0.238 . . . . 0.0 111.643 -179.125 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 98' ' ' ILE . . . . . 0.461 HD13 ' HB2' ' A' ' 94' ' ' CYS . 2.5 mp -70.0 -31.51 48.05 Favored 'Isoleucine or valine' 0 C--N 1.341 0.202 0 C-N-CA 120.817 -0.353 . . . . 0.0 110.504 -179.577 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 77.0 m-20 -68.65 -38.25 80.32 Favored 'General case' 0 N--CA 1.452 -0.37 0 CA-C-N 118.458 0.572 . . . . 0.0 111.379 176.544 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 58.2 m -73.14 -36.93 66.77 Favored 'General case' 0 N--CA 1.454 -0.228 0 CA-C-N 117.996 0.362 . . . . 0.0 110.378 179.874 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 60.0 tp -74.86 -31.92 61.75 Favored 'General case' 0 N--CA 1.452 -0.372 0 C-N-CA 121.394 -0.122 . . . . 0.0 111.089 179.137 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -62.91 -20.86 62.76 Favored Glycine 0 CA--C 1.525 0.71 0 CA-C-O 119.614 -0.548 . . . . 0.0 112.465 -176.047 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 6.1 mm-40 -85.92 -32.77 21.43 Favored 'General case' 0 N--CA 1.456 -0.164 0 CA-C-N 118.213 1.006 . . . . 0.0 111.428 177.711 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 43.9 t -96.06 -19.35 6.25 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.221 0 N-CA-C 112.701 0.63 . . . . 0.0 112.701 -175.415 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 105' ' ' ILE . . . . . . . . . . . . . 10.5 tp -57.59 -24.95 23.42 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.229 0 CA-C-N 118.604 0.638 . . . . 0.0 111.8 -177.025 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 27.5 pt20 -68.17 -25.3 65.18 Favored 'General case' 0 N--CA 1.452 -0.368 0 O-C-N 122.1 -0.375 . . . . 0.0 110.325 178.506 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 65.0 mm-40 -75.58 -39.95 57.31 Favored 'General case' 0 N--CA 1.456 -0.13 0 CA-C-N 118.271 0.487 . . . . 0.0 109.913 176.471 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 8.3 mp -70.56 -41.16 72.81 Favored 'General case' 0 N--CA 1.451 -0.376 0 N-CA-C 109.769 -0.456 . . . . 0.0 109.769 -178.583 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 89.1 mt -67.69 -61.45 1.88 Allowed 'General case' 0 N--CA 1.452 -0.337 0 CA-C-O 119.351 -0.357 . . . . 0.0 110.246 178.451 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 19.5 p -44.36 -51.24 8.69 Favored 'General case' 0 CA--C 1.52 -0.205 0 C-N-CA 122.993 0.517 . . . . 0.0 112.238 -178.076 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 62.3 t0 -63.69 -42.01 98.05 Favored 'General case' 0 N--CA 1.448 -0.539 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.438 -178.047 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -72.42 -35.75 68.44 Favored 'General case' 0 N--CA 1.447 -0.593 0 C-N-CA 120.762 -0.375 . . . . 0.0 111.268 -178.028 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 113' ' ' ILE . . . . . . . . . . . . . 34.9 mm -68.42 -38.27 79.06 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.185 0 CA-C-N 119.185 0.902 . . . . 0.0 109.569 -177.533 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -75.0 -45.46 41.79 Favored 'General case' 0 N--CA 1.451 -0.396 0 CA-C-N 117.471 0.123 . . . . 0.0 111.242 179.765 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 115' ' ' LYS . . . . . 0.611 ' HE2' ' HA ' ' A' ' 115' ' ' LYS . 0.2 OUTLIER -82.07 -31.16 30.94 Favored 'General case' 0 N--CA 1.455 -0.209 0 N-CA-C 113.869 1.063 . . . . 0.0 113.869 -173.111 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 116' ' ' SER . . . . . 0.464 ' HB2' ' CB ' ' A' ' 120' ' ' HIS . 45.5 p -76.39 156.12 33.48 Favored 'General case' 0 CA--C 1.528 0.13 0 N-CA-C 112.261 0.467 . . . . 0.0 112.261 -172.984 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 53.6 t30 -73.02 165.67 24.57 Favored 'General case' 0 N--CA 1.453 -0.277 0 C-N-CA 123.383 0.673 . . . . 0.0 110.708 -178.863 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 118' ' ' GLN . . . . . . . . . . . . . 20.5 mm100 -53.68 -38.1 63.86 Favored 'General case' 0 CA--C 1.531 0.226 0 N-CA-C 112.908 0.707 . . . . 0.0 112.908 -172.765 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 7.5 p-10 -71.65 -38.42 70.71 Favored 'General case' 0 N--CA 1.454 -0.272 0 N-CA-C 109.899 -0.408 . . . . 0.0 109.899 179.227 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 120' ' ' HIS . . . . . 0.464 ' CB ' ' HB2' ' A' ' 116' ' ' SER . 34.3 m170 -65.3 -40.78 94.26 Favored 'General case' 0 N--CA 1.451 -0.406 0 C-N-CA 122.681 0.392 . . . . 0.0 110.044 176.457 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 56.7 mttm -58.55 -42.94 89.02 Favored 'General case' 0 C--N 1.341 0.231 0 N-CA-C 108.895 -0.779 . . . . 0.0 108.895 178.225 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 43.8 tp10 -73.73 -36.5 65.18 Favored 'General case' 0 N--CA 1.451 -0.417 0 CA-C-N 116.661 -0.245 . . . . 0.0 111.468 -176.863 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 13.0 tppt? -62.41 -36.04 81.1 Favored 'General case' 0 N--CA 1.45 -0.431 0 N-CA-C 109.333 -0.617 . . . . 0.0 109.333 177.828 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 124' ' ' ILE . . . . . . . . . . . . . 61.2 mt -69.37 -36.26 71.14 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.261 0 O-C-N 121.957 -0.464 . . . . 0.0 109.892 177.51 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 13.7 mtp-105 -68.05 -35.34 78.07 Favored 'General case' 0 N--CA 1.457 -0.099 0 CA-C-O 119.468 -0.301 . . . . 0.0 111.511 -178.472 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 126' ' ' MET . . . . . . . . . . . . . 27.2 ptm -72.92 -28.01 62.2 Favored 'General case' 0 N--CA 1.455 -0.177 0 C-N-CA 119.488 -0.885 . . . . 0.0 109.452 174.666 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 4.2 mp -65.77 -31.62 72.69 Favored 'General case' 0 CA--C 1.529 0.163 0 CA-C-N 118.084 0.402 . . . . 0.0 110.134 172.999 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 95.6 mt -70.12 -38.72 75.66 Favored 'General case' 0 C--N 1.34 0.19 0 CA-C-N 118.755 0.707 . . . . 0.0 109.868 176.237 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 10.7 t70 -60.37 -44.02 96.01 Favored 'General case' 0 N--CA 1.454 -0.231 0 N-CA-C 109.182 -0.673 . . . . 0.0 109.182 175.561 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 73.9 mt -61.87 -39.07 82.18 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.417 0 CA-C-N 116.418 -0.355 . . . . 0.0 110.632 -179.532 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 131' ' ' TRP . . . . . . . . . . . . . 48.1 m0 . . . . . 0 N--CA 1.45 -0.43 0 N-CA-C 112.355 0.502 . . . . 0.0 112.355 -179.045 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 26.8 p-10 . . . . . 0 N--CA 1.454 -0.27 0 CA-C-O 120.965 0.412 . . . . 0.0 110.017 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 1.6 t80 -53.83 -37.54 63.7 Favored 'General case' 0 N--CA 1.45 -0.461 0 CA-C-N 115.965 -0.561 . . . . 0.0 109.983 178.966 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 53.3 tp60 -56.58 -32.17 64.95 Favored 'General case' 0 N--CA 1.452 -0.369 0 C-N-CA 123.166 0.586 . . . . 0.0 111.813 -177.017 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 13.7 t-20 -71.45 -34.45 70.25 Favored 'General case' 0 N--CA 1.452 -0.346 0 N-CA-C 109.832 -0.433 . . . . 0.0 109.832 177.964 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 10' ' ' PHE . . . . . 0.464 ' CE2' ' HB2' ' A' ' 32' ' ' LEU . 6.7 t80 -68.97 -38.85 79.61 Favored 'General case' 0 N--CA 1.45 -0.43 0 C-N-CA 123.176 0.591 . . . . 0.0 109.5 176.014 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 87.4 t -64.48 -55.14 23.05 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.316 0 N-CA-C 109.092 -0.707 . . . . 0.0 109.092 178.279 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -59.7 -28.45 67.33 Favored 'General case' 0 N--CA 1.452 -0.334 0 C-N-CA 122.973 0.509 . . . . 0.0 112.1 -178.932 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 90.7 m -74.57 -39.94 61.94 Favored 'General case' 0 N--CA 1.456 -0.174 0 N-CA-C 109.222 -0.659 . . . . 0.0 109.222 176.99 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.466 ' HA ' ' CD1' ' A' ' 17' ' ' PHE . 13.0 tp -65.77 -44.48 85.71 Favored 'General case' 0 N--CA 1.452 -0.367 0 N-CA-C 109.3 -0.63 . . . . 0.0 109.3 179.366 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 67.7 mm-40 -62.48 -29.65 70.69 Favored 'General case' 0 N--CA 1.45 -0.458 0 C-N-CA 124.304 1.042 . . . . 0.0 109.446 177.591 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 40.8 t -69.13 -28.44 66.45 Favored 'General case' 0 N--CA 1.451 -0.392 0 CA-C-O 119.052 -0.499 . . . . 0.0 110.147 177.52 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 17' ' ' PHE . . . . . 0.532 ' CD1' HD11 ' A' ' 68' ' ' ILE . 29.2 m-85 -71.98 -36.67 69.86 Favored 'General case' 0 C--N 1.339 0.115 0 CA-C-N 118.693 0.679 . . . . 0.0 110.824 171.979 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 80.6 mttt -63.25 -24.21 67.77 Favored 'General case' 0 C--N 1.339 0.144 0 N-CA-C 110.169 -0.308 . . . . 0.0 110.169 177.429 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 30.1 t0 -76.59 -16.76 59.5 Favored 'General case' 0 CA--C 1.538 0.505 0 N-CA-C 112.466 0.543 . . . . 0.0 112.466 176.697 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . 0.405 ' C ' ' HE3' ' A' ' 21' ' ' LYS . 10.1 mt -85.44 161.08 19.56 Favored 'General case' 0 N--CA 1.457 -0.107 0 CA-C-N 118.728 0.694 . . . . 0.0 111.983 -174.043 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . 0.51 ' HE3' ' N ' ' A' ' 21' ' ' LYS . 0.8 OUTLIER -82.64 -36.59 25.9 Favored 'General case' 0 N--CA 1.454 -0.229 0 N-CA-C 108.803 -0.814 . . . . 0.0 108.803 176.797 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 35.9 t -90.16 -24.77 20.96 Favored 'General case' 0 C--N 1.341 0.231 0 C-N-CA 124.034 0.934 . . . . 0.0 111.648 -179.791 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 77.7 -10.52 24.14 Favored Glycine 0 CA--C 1.532 1.146 0 CA-C-O 119.675 -0.514 . . . . 0.0 111.896 -177.372 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 70.0 mt -96.05 148.93 4.93 Favored 'Isoleucine or valine' 0 C--N 1.34 0.188 0 CA-C-N 117.507 0.654 . . . . 0.0 111.155 178.447 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 19.1 t -167.68 100.82 0.48 Allowed 'General case' 0 CA--C 1.518 -0.252 0 N-CA-C 108.777 -0.823 . . . . 0.0 108.777 176.177 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -54.67 -45.62 77.68 Favored Glycine 0 CA--C 1.527 0.8 0 C-N-CA 120.861 -0.685 . . . . 0.0 112.025 -175.106 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 8.9 m -64.51 -42.72 95.64 Favored 'General case' 0 N--CA 1.456 -0.135 0 CA-C-N 118.232 1.016 . . . . 0.0 111.349 -177.327 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 28.7 mtt180 -74.63 -39.12 62.32 Favored 'General case' 0 N--CA 1.453 -0.281 0 CA-C-N 118.231 0.468 . . . . 0.0 110.083 -177.821 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 69.8 mt -58.95 -45.23 92.12 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.607 0 N-CA-C 109.045 -0.724 . . . . 0.0 109.045 174.516 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 50.4 mtmt -69.18 -25.04 64.14 Favored 'General case' 0 C--O 1.231 0.092 0 CA-C-O 119.069 -0.491 . . . . 0.0 111.403 -179.994 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . 0.466 ' CE ' ' HA ' ' A' ' 31' ' ' LYS . 3.1 mmpt? -66.22 -55.95 13.71 Favored 'General case' 0 N--CA 1.455 -0.203 0 CA-C-N 118.662 0.665 . . . . 0.0 110.14 177.856 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.473 HD12 ' N ' ' A' ' 33' ' ' THR . 1.6 pp -75.43 -17.64 60.11 Favored 'General case' 0 CA--C 1.53 0.207 0 C-N-CA 119.165 -1.014 . . . . 0.0 111.554 -179.613 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . 0.473 ' N ' HD12 ' A' ' 32' ' ' LEU . 29.8 m -73.03 -41.6 64.06 Favored 'General case' 0 C--N 1.341 0.201 0 N-CA-C 108.926 -0.768 . . . . 0.0 108.926 176.378 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 97.0 m -69.59 -37.92 77.12 Favored 'General case' 0 N--CA 1.449 -0.499 0 N-CA-C 110.414 -0.217 . . . . 0.0 110.414 -178.36 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 14.8 t80 -62.92 -40.12 96.64 Favored 'General case' 0 N--CA 1.455 -0.216 0 N-CA-C 110.103 -0.332 . . . . 0.0 110.103 175.576 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -70.92 -31.95 68.72 Favored 'General case' 0 N--CA 1.45 -0.455 0 C-N-CA 122.337 0.255 . . . . 0.0 111.148 179.954 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . 0.455 HD21 ' HB1' ' A' ' 75' ' ' ALA . 20.1 mt -71.34 -40.08 70.94 Favored 'General case' 0 N--CA 1.453 -0.296 0 C-N-CA 122.618 0.367 . . . . 0.0 110.733 179.844 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 42.6 t0 -65.55 -23.41 66.86 Favored 'General case' 0 N--CA 1.453 -0.285 0 CA-C-N 116.463 -0.335 . . . . 0.0 110.847 177.037 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 98.1 m-70 -149.27 98.39 2.8 Favored 'General case' 0 N--CA 1.452 -0.336 0 CA-C-O 121.071 0.462 . . . . 0.0 111.651 -175.96 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 40' ' ' ILE . . . . . 0.628 ' H ' HD13 ' A' ' 40' ' ' ILE . 0.0 OUTLIER -76.59 -10.54 13.35 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.368 0 C-N-CA 122.847 0.459 . . . . 0.0 110.357 175.385 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 8.0 m-20 -57.42 -23.99 52.83 Favored 'General case' 0 N--CA 1.455 -0.18 0 C-N-CA 123.0 0.52 . . . . 0.0 111.66 -178.322 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . 0.479 ' HB ' ' HE2' ' A' ' 45' ' ' LYS . 0.0 OUTLIER -101.92 15.77 5.07 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.244 0 C-N-CA 122.877 0.471 . . . . 0.0 112.163 177.999 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 3.0 pp20? -52.43 -29.64 25.42 Favored 'General case' 0 CA--C 1.531 0.247 0 CA-C-N 119.067 0.849 . . . . 0.0 110.812 179.262 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 39.5 t -62.0 -52.61 63.31 Favored 'General case' 0 C--O 1.234 0.28 0 N-CA-C 112.028 0.381 . . . . 0.0 112.028 -178.706 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . 0.479 ' HE2' ' HB ' ' A' ' 42' ' ' ILE . 17.7 pttt -68.43 -25.89 65.25 Favored 'General case' 0 C--N 1.34 0.184 0 CA-C-N 118.245 0.475 . . . . 0.0 109.924 179.897 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 87.0 mt -73.28 -45.8 51.89 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.493 0 C-N-CA 122.649 0.38 . . . . 0.0 110.425 -176.656 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 34.2 mm -64.89 -34.7 72.17 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.215 0 N-CA-C 109.584 -0.525 . . . . 0.0 109.584 177.84 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 23.3 t -63.78 -46.84 83.42 Favored 'General case' 0 C--O 1.227 -0.09 0 C-N-CA 119.968 -0.693 . . . . 0.0 110.367 177.708 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 6.6 mp -66.65 -30.65 70.96 Favored 'General case' 0 N--CA 1.454 -0.273 0 CA-C-O 118.635 -0.698 . . . . 0.0 112.317 -175.135 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 20.3 pt -71.93 -42.76 68.88 Favored 'Isoleucine or valine' 0 C--N 1.34 0.192 0 CA-C-N 119.64 1.109 . . . . 0.0 110.126 176.982 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 38.0 pt -68.94 -42.33 82.27 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.239 0 C-N-CA 119.459 -0.896 . . . . 0.0 110.487 179.395 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 74.3 m-20 -62.54 -37.68 87.07 Favored 'General case' 0 N--CA 1.455 -0.201 0 CA-C-N 117.779 0.263 . . . . 0.0 110.806 179.767 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 26.8 t80 -72.79 -29.75 63.53 Favored 'General case' 0 CA--C 1.528 0.118 0 N-CA-C 110.29 -0.263 . . . . 0.0 110.29 177.211 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 37.7 m -75.28 -21.94 58.15 Favored 'General case' 0 N--CA 1.455 -0.221 0 N-CA-C 111.952 0.353 . . . . 0.0 111.952 179.532 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 22.6 mmm180 -93.95 -53.23 4.07 Favored 'General case' 0 N--CA 1.453 -0.284 0 N-CA-C 112.686 0.624 . . . . 0.0 112.686 -179.569 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 46.6 mt -74.18 -46.11 44.18 Favored 'General case' 0 C--N 1.334 -0.099 0 N-CA-C 112.507 0.558 . . . . 0.0 112.507 -170.188 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 57' ' ' CYS . . . . . 0.469 ' HB3' ' HD2' ' A' ' 58' ' ' PRO . 74.4 m -74.08 158.28 85.87 Favored Pre-proline 0 CA--C 1.535 0.382 0 C-N-CA 122.539 0.336 . . . . 0.0 111.598 -176.209 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 58' ' ' PRO . . . . . 0.469 ' HD2' ' HB3' ' A' ' 57' ' ' CYS . 91.8 Cg_endo -76.89 175.09 11.82 Favored 'Trans proline' 0 N--CA 1.453 -0.894 0 C-N-CA 125.127 3.885 . . . . 0.0 112.009 -169.46 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 35.3 p-10 -46.95 -46.33 21.41 Favored 'General case' 0 CA--C 1.528 0.115 0 C-N-CA 125.182 1.393 . . . . 0.0 113.677 -171.728 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 36.3 m -67.36 -36.3 81.1 Favored 'General case' 0 N--CA 1.453 -0.298 0 N-CA-C 109.992 -0.373 . . . . 0.0 109.992 -177.17 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 61' ' ' HIS . . . . . 0.431 ' ND1' ' HD2' ' A' ' 58' ' ' PRO . 53.6 m170 -75.41 -23.9 57.06 Favored 'General case' 0 N--CA 1.452 -0.366 0 N-CA-C 110.023 -0.362 . . . . 0.0 110.023 178.261 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 57.2 mttm -68.55 -34.42 75.8 Favored 'General case' 0 CA--C 1.528 0.107 0 N-CA-C 109.405 -0.591 . . . . 0.0 109.405 172.978 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -64.64 -44.47 90.37 Favored 'General case' 0 CA--C 1.532 0.261 0 N-CA-C 108.029 -1.1 . . . . 0.0 108.029 174.579 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -66.6 -28.45 73.75 Favored Glycine 0 C--N 1.336 0.576 0 N-CA-C 111.538 -0.625 . . . . 0.0 111.538 -179.749 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 38.7 t -69.88 -44.16 70.34 Favored 'General case' 0 N--CA 1.451 -0.401 0 CA-C-N 117.387 0.594 . . . . 0.0 110.08 177.371 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 60.6 mt -65.7 -25.04 67.14 Favored 'General case' 0 N--CA 1.453 -0.307 0 N-CA-C 109.581 -0.526 . . . . 0.0 109.581 178.781 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 1.2 m-85 -72.24 -37.67 69.08 Favored 'General case' 0 N--CA 1.454 -0.235 0 C-N-CA 122.617 0.367 . . . . 0.0 110.811 174.585 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 68' ' ' ILE . . . . . 0.532 HD11 ' CD1' ' A' ' 17' ' ' PHE . 20.2 mt -69.72 -46.76 73.84 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.317 0 N-CA-C 109.137 -0.69 . . . . 0.0 109.137 176.226 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 93.7 mt -57.6 -34.14 46.51 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.258 0 C-N-CA 123.556 0.742 . . . . 0.0 110.784 176.86 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 18.7 t70 -68.73 -43.68 75.42 Favored 'General case' 0 N--CA 1.451 -0.393 0 CA-C-N 118.123 0.419 . . . . 0.0 110.757 178.165 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 30.3 t -69.31 -56.55 7.2 Favored 'General case' 0 N--CA 1.452 -0.352 0 CA-C-N 116.401 -0.363 . . . . 0.0 110.65 -177.304 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -74.97 -31.34 25.09 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.253 0 N-CA-C 110.177 -0.305 . . . . 0.0 110.177 -176.623 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -66.42 -55.61 17.33 Favored Glycine 0 C--N 1.336 0.561 0 N-CA-C 111.214 -0.754 . . . . 0.0 111.214 -176.523 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 37.6 mtm105 -66.41 -40.84 89.82 Favored 'General case' 0 N--CA 1.452 -0.349 0 C-N-CA 120.489 -0.485 . . . . 0.0 109.934 -179.358 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 75' ' ' ALA . . . . . 0.455 ' HB1' HD21 ' A' ' 37' ' ' LEU . . . -64.48 -30.29 71.32 Favored 'General case' 0 N--CA 1.45 -0.426 0 C-N-CA 120.058 -0.657 . . . . 0.0 110.998 -177.893 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 1.3 m-30 -69.66 -46.66 65.62 Favored 'General case' 0 C--N 1.34 0.191 0 CA-C-N 118.18 0.446 . . . . 0.0 110.858 177.55 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 50.0 tp -71.82 -38.5 70.17 Favored 'General case' 0 N--CA 1.451 -0.419 0 C-N-CA 118.01 -1.476 . . . . 0.0 109.451 -179.611 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 91.1 m-20 -60.98 -47.84 84.6 Favored 'General case' 0 CA--C 1.529 0.156 0 N-CA-C 112.893 0.701 . . . . 0.0 112.893 178.548 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 21.3 mm-40 -66.84 -45.53 77.92 Favored 'General case' 0 CA--C 1.522 -0.098 0 CA-C-N 119.221 0.919 . . . . 0.0 111.342 179.877 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 80' ' ' THR . . . . . 0.416 HG21 ' HB3' ' A' ' 94' ' ' CYS . 60.0 p -65.34 -30.76 71.63 Favored 'General case' 0 N--CA 1.456 -0.142 0 C-N-CA 120.195 -0.602 . . . . 0.0 110.632 179.847 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 38.2 ttp-105 -72.15 -30.86 65.43 Favored 'General case' 0 N--CA 1.454 -0.226 0 CA-C-N 117.98 0.355 . . . . 0.0 111.631 175.415 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 17.2 m . . . . . 0 N--CA 1.457 -0.102 0 N-CA-C 113.495 0.924 . . . . 0.0 113.495 -174.422 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 57.5 Cg_exo . . . . . 0 N--CA 1.452 -0.959 0 N-CA-C 111.154 -0.364 . . . . 0.0 111.154 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 90.52 16.55 54.95 Favored Glycine 0 CA--C 1.523 0.571 0 CA-C-O 119.278 -0.735 . . . . 0.0 112.878 178.539 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 30.9 p -153.04 167.95 27.51 Favored 'General case' 0 CA--C 1.52 -0.202 0 CA-C-N 118.399 1.1 . . . . 0.0 110.591 177.864 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 94' ' ' CYS . . . . . 0.429 ' HB2' HD13 ' A' ' 98' ' ' ILE . 31.1 p -58.34 -24.3 59.33 Favored 'General case' 0 N--CA 1.451 -0.402 0 CA-C-N 115.478 -0.783 . . . . 0.0 110.27 175.561 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -60.9 -59.82 4.77 Favored 'General case' 0 N--CA 1.446 -0.638 0 N-CA-C 109.497 -0.557 . . . . 0.0 109.497 -175.722 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 72.4 t60 -73.56 -32.78 64.35 Favored 'General case' 0 N--CA 1.449 -0.492 0 N-CA-C 110.553 -0.166 . . . . 0.0 110.553 -178.92 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -66.08 -52.53 48.01 Favored 'General case' 0 N--CA 1.453 -0.323 0 N-CA-C 111.836 0.309 . . . . 0.0 111.836 -177.86 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 98' ' ' ILE . . . . . 0.429 HD13 ' HB2' ' A' ' 94' ' ' CYS . 1.8 mp -71.01 -33.87 53.3 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.146 0 O-C-N 121.916 -0.49 . . . . 0.0 109.908 -178.829 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 75.8 m-20 -68.1 -43.37 78.64 Favored 'General case' 0 N--CA 1.45 -0.429 0 CA-C-N 118.242 0.474 . . . . 0.0 111.626 179.34 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 91.3 m -68.32 -37.6 80.75 Favored 'General case' 0 N--CA 1.455 -0.221 0 CA-C-N 117.886 0.312 . . . . 0.0 110.472 -177.579 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 65.2 tp -75.81 -36.73 59.63 Favored 'General case' 0 N--CA 1.451 -0.424 0 CA-C-N 116.661 -0.245 . . . . 0.0 111.283 179.906 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -65.56 -22.78 69.99 Favored Glycine 0 CA--C 1.522 0.527 0 CA-C-O 119.67 -0.517 . . . . 0.0 112.437 -175.187 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 17.6 mm-40 -72.68 -44.89 61.21 Favored 'General case' 0 N--CA 1.452 -0.359 0 CA-C-N 118.201 1.0 . . . . 0.0 111.873 178.138 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 25.0 m -92.1 -1.6 10.27 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.171 0 O-C-N 123.928 0.767 . . . . 0.0 112.369 -174.63 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 105' ' ' ILE . . . . . . . . . . . . . 10.1 tp -66.68 -25.15 34.15 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.167 0 CA-C-N 118.384 0.538 . . . . 0.0 110.954 -176.25 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 15.2 pt20 -71.76 -34.29 69.36 Favored 'General case' 0 N--CA 1.452 -0.345 0 CA-C-O 119.181 -0.438 . . . . 0.0 109.841 -178.631 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 57.9 mp0 -73.69 -37.96 65.05 Favored 'General case' 0 C--N 1.341 0.203 0 CA-C-N 118.929 0.786 . . . . 0.0 110.38 177.001 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 94.1 mt -71.74 -41.36 68.57 Favored 'General case' 0 N--CA 1.452 -0.343 0 CA-C-O 119.186 -0.435 . . . . 0.0 111.053 -177.568 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 81.5 mt -69.66 -55.62 9.5 Favored 'General case' 0 N--CA 1.45 -0.441 0 C-N-CA 120.494 -0.483 . . . . 0.0 110.146 179.156 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 14.2 p -49.18 -51.76 30.65 Favored 'General case' 0 CA--C 1.52 -0.181 0 CA-C-N 118.243 0.474 . . . . 0.0 111.48 -177.506 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 43.2 t0 -69.0 -31.17 69.8 Favored 'General case' 0 N--CA 1.447 -0.585 0 C-N-CA 120.897 -0.321 . . . . 0.0 110.508 -177.14 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -72.52 -31.27 65.19 Favored 'General case' 0 N--CA 1.448 -0.545 0 C-N-CA 120.822 -0.351 . . . . 0.0 110.496 178.902 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 113' ' ' ILE . . . . . . . . . . . . . 36.5 mm -66.31 -36.89 78.46 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.175 0 N-CA-C 108.317 -0.994 . . . . 0.0 108.317 176.375 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -74.56 -40.08 61.9 Favored 'General case' 0 N--CA 1.454 -0.26 0 N-CA-C 112.205 0.446 . . . . 0.0 112.205 177.92 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -77.24 -36.46 54.54 Favored 'General case' 0 C--N 1.339 0.123 0 N-CA-C 112.531 0.567 . . . . 0.0 112.531 -175.536 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 116' ' ' SER . . . . . 0.516 ' HB2' ' CB ' ' A' ' 120' ' ' HIS . 83.8 p -79.38 153.74 29.52 Favored 'General case' 0 N--CA 1.454 -0.246 0 N-CA-C 112.991 0.737 . . . . 0.0 112.991 -170.952 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 47.2 t30 -75.62 167.43 21.9 Favored 'General case' 0 C--O 1.225 -0.22 0 C-N-CA 123.772 0.829 . . . . 0.0 110.251 -178.611 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 118' ' ' GLN . . . . . . . . . . . . . 59.8 mt-30 -45.87 -55.67 6.38 Favored 'General case' 0 C--N 1.34 0.187 0 C-N-CA 123.478 0.711 . . . . 0.0 111.542 -174.438 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 3.9 p30 -63.15 -36.88 85.1 Favored 'General case' 0 C--O 1.232 0.143 0 C-N-CA 122.778 0.431 . . . . 0.0 110.95 -177.341 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 120' ' ' HIS . . . . . 0.516 ' CB ' ' HB2' ' A' ' 116' ' ' SER . 34.0 m170 -64.93 -39.04 92.9 Favored 'General case' 0 N--CA 1.449 -0.501 0 CA-C-O 119.168 -0.444 . . . . 0.0 110.14 176.441 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 57.6 mttm -57.54 -46.88 83.36 Favored 'General case' 0 C--N 1.342 0.271 0 N-CA-C 109.329 -0.619 . . . . 0.0 109.329 179.285 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 40.1 mm-40 -64.22 -40.53 96.23 Favored 'General case' 0 N--CA 1.452 -0.354 0 C-N-CA 122.397 0.279 . . . . 0.0 111.605 -177.022 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 63.5 mttm -64.35 -29.34 70.41 Favored 'General case' 0 N--CA 1.453 -0.277 0 C-N-CA 120.342 -0.543 . . . . 0.0 110.39 179.594 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 124' ' ' ILE . . . . . . . . . . . . . 51.8 mt -75.77 -33.13 25.3 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.218 0 N-CA-C 109.874 -0.417 . . . . 0.0 109.874 176.0 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 11.3 mmm180 -66.44 -39.06 88.67 Favored 'General case' 0 C--N 1.339 0.147 0 CA-C-N 118.135 0.425 . . . . 0.0 110.466 179.676 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 126' ' ' MET . . . . . . . . . . . . . 27.8 ptm -72.43 -33.28 66.98 Favored 'General case' 0 N--CA 1.455 -0.218 0 C-N-CA 120.314 -0.554 . . . . 0.0 109.674 177.793 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 3.3 mp -64.69 -33.96 77.17 Favored 'General case' 0 N--CA 1.455 -0.212 0 N-CA-C 109.644 -0.502 . . . . 0.0 109.644 175.042 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 31.6 tp -66.4 -42.25 88.12 Favored 'General case' 0 N--CA 1.452 -0.329 0 N-CA-C 110.077 -0.342 . . . . 0.0 110.077 179.134 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 18.0 t0 -64.7 -44.72 89.35 Favored 'General case' 0 N--CA 1.455 -0.218 0 N-CA-C 110.243 -0.281 . . . . 0.0 110.243 177.856 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 59.7 mt -58.79 -35.22 54.83 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.203 0 N-CA-C 110.238 -0.282 . . . . 0.0 110.238 -179.176 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 131' ' ' TRP . . . . . . . . . . . . . 45.6 m0 . . . . . 0 N--CA 1.455 -0.182 0 N-CA-C 112.874 0.694 . . . . 0.0 112.874 -179.917 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 21.2 p-10 . . . . . 0 N--CA 1.455 -0.196 0 N-CA-C 108.549 -0.908 . . . . 0.0 108.549 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 7' ' ' PHE . . . . . 0.445 ' CD1' ' HD3' ' A' ' 45' ' ' LYS . 1.0 OUTLIER -55.35 -33.06 63.05 Favored 'General case' 0 N--CA 1.447 -0.606 0 C-N-CA 125.584 1.554 . . . . 0.0 111.462 -177.253 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 51.1 tp60 -51.8 -36.89 49.37 Favored 'General case' 0 N--CA 1.454 -0.272 0 C-N-CA 123.201 0.601 . . . . 0.0 112.21 -176.993 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 27.6 m-80 -71.29 -36.22 71.59 Favored 'General case' 0 N--CA 1.455 -0.223 0 CA-C-O 121.175 0.512 . . . . 0.0 110.016 -179.437 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 10' ' ' PHE . . . . . 0.424 ' CE2' ' HB2' ' A' ' 32' ' ' LEU . 7.1 t80 -69.96 -39.8 75.8 Favored 'General case' 0 N--CA 1.451 -0.408 0 C-N-CA 124.05 0.94 . . . . 0.0 109.349 177.139 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 83.2 t -66.17 -51.72 56.2 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.493 0 N-CA-C 109.042 -0.725 . . . . 0.0 109.042 179.693 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -59.45 -32.12 69.93 Favored 'General case' 0 CA--C 1.53 0.175 0 C-N-CA 122.508 0.323 . . . . 0.0 111.381 -179.422 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 85.5 m -71.55 -39.53 70.62 Favored 'General case' 0 CA--C 1.531 0.246 0 N-CA-C 109.025 -0.732 . . . . 0.0 109.025 176.484 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.552 ' HA ' ' CD1' ' A' ' 17' ' ' PHE . 4.9 tp -64.84 -42.15 95.14 Favored 'General case' 0 N--CA 1.45 -0.471 0 CA-C-O 121.215 0.531 . . . . 0.0 110.208 178.624 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 69.0 mm-40 -63.83 -28.06 69.6 Favored 'General case' 0 N--CA 1.45 -0.469 0 C-N-CA 124.762 1.225 . . . . 0.0 109.337 178.09 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 43.6 t -70.23 -27.35 64.4 Favored 'General case' 0 N--CA 1.449 -0.516 0 N-CA-C 110.417 -0.216 . . . . 0.0 110.417 174.942 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 17' ' ' PHE . . . . . 0.582 ' CE1' HD11 ' A' ' 68' ' ' ILE . 21.8 m-85 -71.42 -41.1 69.95 Favored 'General case' 0 C--N 1.338 0.108 0 C-N-CA 119.335 -0.946 . . . . 0.0 110.879 170.441 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . 0.529 ' HG2' ' CE1' ' A' ' 53' ' ' TYR . 65.9 mttt -60.62 -25.55 66.36 Favored 'General case' 0 C--N 1.34 0.19 0 CA-C-N 118.138 0.426 . . . . 0.0 111.008 175.799 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 10.6 t0 -72.47 -47.06 51.78 Favored 'General case' 0 C--N 1.331 -0.22 0 C-N-CA 123.231 0.612 . . . . 0.0 110.26 178.784 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 63.3 mt -66.78 136.31 55.28 Favored 'General case' 0 N--CA 1.453 -0.306 0 CA-C-O 120.967 0.413 . . . . 0.0 110.405 -178.769 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 1.2 mppt? -75.3 -24.24 57.46 Favored 'General case' 0 N--CA 1.454 -0.236 0 N-CA-C 109.105 -0.702 . . . . 0.0 109.105 177.35 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 80.7 p -80.94 -23.4 38.87 Favored 'General case' 0 N--CA 1.457 -0.119 0 C-N-CA 123.773 0.829 . . . . 0.0 110.391 175.845 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 72.35 -33.73 0.67 Allowed Glycine 0 CA--C 1.526 0.728 0 C-N-CA 124.846 1.212 . . . . 0.0 112.938 178.239 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 63.0 mt -76.16 147.38 7.89 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.333 0 CA-C-N 117.528 0.664 . . . . 0.0 110.109 178.112 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 32.9 t -162.37 94.2 0.88 Allowed 'General case' 0 N--CA 1.455 -0.198 0 N-CA-C 109.058 -0.719 . . . . 0.0 109.058 171.67 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . 0.429 ' O ' ' HE2' ' A' ' 30' ' ' LYS . . . -55.28 -38.33 67.95 Favored Glycine 0 CA--C 1.524 0.613 0 C-N-CA 121.12 -0.562 . . . . 0.0 111.91 -172.426 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . 0.432 ' HA ' ' HE3' ' A' ' 30' ' ' LYS . 74.7 p -71.71 -48.66 45.69 Favored 'General case' 0 N--CA 1.452 -0.354 0 CA-C-N 118.21 1.005 . . . . 0.0 110.898 -177.196 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 71.5 mmt-85 -65.53 -38.56 90.0 Favored 'General case' 0 C--O 1.233 0.2 0 N-CA-C 109.617 -0.512 . . . . 0.0 109.617 -179.637 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 47.9 mt -59.96 -44.41 94.49 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.814 0 N-CA-C 108.71 -0.848 . . . . 0.0 108.71 176.06 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . 0.432 ' HE3' ' HA ' ' A' ' 27' ' ' SER . 49.2 mtmt -66.17 -25.79 67.12 Favored 'General case' 0 C--N 1.34 0.166 0 CA-C-O 118.727 -0.654 . . . . 0.0 111.562 177.635 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . 0.565 ' HA ' ' HE2' ' A' ' 31' ' ' LYS . 8.9 mmpt? -66.88 -57.97 5.93 Favored 'General case' 0 C--N 1.341 0.214 0 CA-C-N 119.433 1.015 . . . . 0.0 109.95 179.435 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.528 HD12 ' N ' ' A' ' 33' ' ' THR . 1.4 pp -75.1 -20.07 59.64 Favored 'General case' 0 CA--C 1.53 0.194 0 C-N-CA 118.929 -1.109 . . . . 0.0 111.917 -176.782 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . 0.528 ' N ' HD12 ' A' ' 32' ' ' LEU . 54.3 m -71.16 -38.28 72.2 Favored 'General case' 0 N--CA 1.452 -0.366 0 N-CA-C 108.626 -0.879 . . . . 0.0 108.626 175.548 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 63.8 m -69.76 -37.37 76.4 Favored 'General case' 0 N--CA 1.45 -0.431 0 N-CA-C 110.032 -0.358 . . . . 0.0 110.032 -178.949 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 72.8 t80 -67.39 -33.81 75.96 Favored 'General case' 0 N--CA 1.455 -0.18 0 C-N-CA 120.279 -0.569 . . . . 0.0 110.248 177.42 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -69.47 -37.11 77.13 Favored 'General case' 0 N--CA 1.45 -0.472 0 CA-C-N 116.627 -0.261 . . . . 0.0 110.588 178.207 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 2.9 mm? -71.23 -34.5 70.84 Favored 'General case' 0 N--CA 1.456 -0.154 0 C-N-CA 122.478 0.311 . . . . 0.0 110.227 179.781 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 45.5 t0 -67.17 -26.49 66.67 Favored 'General case' 0 N--CA 1.453 -0.297 0 C-N-CA 122.315 0.246 . . . . 0.0 110.475 176.289 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 39' ' ' HIS . . . . . 0.403 ' HB2' HD11 ' A' ' 42' ' ' ILE . 97.1 m-70 -149.0 100.29 3.05 Favored 'General case' 0 C--N 1.341 0.197 0 N-CA-C 111.82 0.304 . . . . 0.0 111.82 -175.737 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 40' ' ' ILE . . . . . 0.621 ' H ' HD13 ' A' ' 40' ' ' ILE . 0.0 OUTLIER -75.65 -13.49 15.06 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.488 0 CA-C-O 119.158 -0.449 . . . . 0.0 110.061 174.116 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 32.6 m-20 -58.15 -16.68 14.29 Favored 'General case' 0 CA--C 1.532 0.286 0 C-N-CA 123.124 0.57 . . . . 0.0 112.11 -176.07 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . 0.403 HD11 ' HB2' ' A' ' 39' ' ' HIS . 0.0 OUTLIER -113.65 19.17 7.24 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.177 0 C-N-CA 123.41 0.684 . . . . 0.0 111.834 176.903 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 2.9 pp20? -54.02 -28.84 40.8 Favored 'General case' 0 C--N 1.339 0.131 0 O-C-N 121.544 -0.722 . . . . 0.0 111.693 179.175 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 3.9 m -67.31 -44.04 80.14 Favored 'General case' 0 N--CA 1.454 -0.231 0 O-C-N 121.962 -0.461 . . . . 0.0 111.518 -176.662 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . 0.445 ' HD3' ' CD1' ' A' ' 7' ' ' PHE . 16.6 ptpt -73.73 -27.47 61.2 Favored 'General case' 0 C--N 1.341 0.206 0 CA-C-N 118.699 0.681 . . . . 0.0 109.789 177.56 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 64.0 mt -71.45 -53.88 19.26 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.274 0 C-N-CA 123.102 0.561 . . . . 0.0 110.721 -178.29 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 34.0 mm -68.18 -39.82 81.84 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.351 0 C-N-CA 122.381 0.272 . . . . 0.0 110.313 -176.49 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 66.0 p -68.15 -33.55 74.68 Favored 'General case' 0 N--CA 1.452 -0.347 0 C-N-CA 120.219 -0.592 . . . . 0.0 110.54 179.922 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 48.4 tp -75.21 -35.13 61.52 Favored 'General case' 0 N--CA 1.453 -0.286 0 N-CA-C 113.033 0.753 . . . . 0.0 113.033 -177.823 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . 0.443 HD12 HG12 ' A' ' 69' ' ' ILE . 3.4 pt -73.06 -42.61 59.21 Favored 'Isoleucine or valine' 0 CA--C 1.526 0.041 0 CA-C-N 118.788 0.722 . . . . 0.0 111.137 179.311 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 21.8 pt -65.79 -39.17 84.01 Favored 'Isoleucine or valine' 0 CA--C 1.528 0.112 0 C-N-CA 119.649 -0.821 . . . . 0.0 110.708 177.707 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 84.8 m-20 -68.79 -35.44 77.04 Favored 'General case' 0 N--CA 1.453 -0.325 0 CA-C-N 118.248 0.476 . . . . 0.0 111.279 177.901 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 53' ' ' TYR . . . . . 0.529 ' CE1' ' HG2' ' A' ' 18' ' ' LYS . 7.7 t80 -62.02 -45.33 94.04 Favored 'General case' 0 N--CA 1.453 -0.301 0 N-CA-C 108.501 -0.926 . . . . 0.0 108.501 174.781 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 20.5 m -63.27 -33.93 76.58 Favored 'General case' 0 N--CA 1.454 -0.232 0 C-N-CA 123.258 0.623 . . . . 0.0 111.99 -175.193 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 64.6 mtm180 -79.0 -42.65 26.1 Favored 'General case' 0 N--CA 1.455 -0.201 0 N-CA-C 111.883 0.327 . . . . 0.0 111.883 -176.685 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 45.2 mt -77.47 -43.29 32.81 Favored 'General case' 0 N--CA 1.457 -0.08 0 N-CA-C 112.309 0.485 . . . . 0.0 112.309 -177.743 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 57' ' ' CYS . . . . . 0.461 ' HB2' ' HD2' ' A' ' 58' ' ' PRO . 10.6 p -67.49 161.42 65.37 Favored Pre-proline 0 CA--C 1.532 0.264 0 N-CA-C 113.049 0.759 . . . . 0.0 113.049 -173.489 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 58' ' ' PRO . . . . . 0.461 ' HD2' ' HB2' ' A' ' 57' ' ' CYS . 86.3 Cg_endo -72.89 179.25 5.5 Favored 'Trans proline' 0 N--CA 1.454 -0.823 0 C-N-CA 124.249 3.299 . . . . 0.0 110.59 174.614 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 59' ' ' ASP . . . . . 0.493 ' CG ' ' HA ' ' A' ' 116' ' ' SER . 49.9 t0 -55.37 -52.52 63.24 Favored 'General case' 0 N--CA 1.453 -0.311 0 N-CA-C 113.958 1.095 . . . . 0.0 113.958 -173.479 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 97.4 p -63.4 -39.61 94.96 Favored 'General case' 0 C--O 1.231 0.131 0 CA-C-N 119.091 0.86 . . . . 0.0 110.545 -174.297 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 49.6 m170 -66.11 -34.71 78.67 Favored 'General case' 0 N--CA 1.452 -0.348 0 N-CA-C 109.666 -0.494 . . . . 0.0 109.666 175.54 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . 0.599 ' HE3' HD11 ' A' ' 124' ' ' ILE . 0.0 OUTLIER -72.36 -32.1 66.18 Favored 'General case' 0 N--CA 1.453 -0.283 0 C-N-CA 122.893 0.477 . . . . 0.0 111.954 -178.464 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 1.7 tm? -75.29 -35.11 61.34 Favored 'General case' 0 CA--C 1.532 0.276 0 N-CA-C 107.783 -1.192 . . . . 0.0 107.783 178.699 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -71.49 -31.64 65.42 Favored Glycine 0 CA--C 1.526 0.77 0 N-CA-C 111.601 -0.6 . . . . 0.0 111.601 176.449 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 65' ' ' SER . . . . . 0.453 ' HA ' HD12 ' A' ' 68' ' ' ILE . 82.6 p -71.96 -31.47 66.33 Favored 'General case' 0 N--CA 1.451 -0.401 0 O-C-N 121.822 -0.81 . . . . 0.0 109.882 177.797 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 76.8 mt -75.05 -25.08 58.4 Favored 'General case' 0 N--CA 1.455 -0.222 0 CA-C-O 119.568 -0.253 . . . . 0.0 110.413 174.781 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 4.1 m-30 -66.5 -36.26 82.29 Favored 'General case' 0 CA--C 1.516 -0.341 0 N-CA-C 109.453 -0.573 . . . . 0.0 109.453 172.465 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 68' ' ' ILE . . . . . 0.582 HD11 ' CE1' ' A' ' 17' ' ' PHE . 41.0 mt -68.32 -55.82 14.86 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.567 0 N-CA-C 108.758 -0.83 . . . . 0.0 108.758 178.03 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 69' ' ' ILE . . . . . 0.443 HG12 HD12 ' A' ' 50' ' ' ILE . 61.9 mt -47.87 -37.67 6.45 Favored 'Isoleucine or valine' 0 C--N 1.343 0.297 0 C-N-CA 124.089 0.956 . . . . 0.0 111.742 176.016 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 15.4 t70 -70.4 -44.07 68.73 Favored 'General case' 0 C--O 1.233 0.203 0 CA-C-N 118.557 0.617 . . . . 0.0 110.881 178.976 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 20.4 m -68.97 -52.32 30.2 Favored 'General case' 0 N--CA 1.455 -0.183 0 N-CA-C 110.202 -0.296 . . . . 0.0 110.202 -175.46 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 72' ' ' ILE . . . . . 0.476 HD11 ' CZ ' ' A' ' 76' ' ' TYR . 0.0 OUTLIER -73.97 -31.04 29.28 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.403 0 N-CA-C 109.68 -0.489 . . . . 0.0 109.68 -176.403 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -68.76 -53.84 17.87 Favored Glycine 0 C--N 1.338 0.694 0 N-CA-C 111.695 -0.562 . . . . 0.0 111.695 -175.458 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 37.8 mtm105 -68.5 -39.5 81.24 Favored 'General case' 0 N--CA 1.452 -0.335 0 C-N-CA 120.672 -0.411 . . . . 0.0 110.157 179.844 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -65.26 -30.9 71.81 Favored 'General case' 0 N--CA 1.451 -0.386 0 C-N-CA 120.457 -0.497 . . . . 0.0 110.755 -179.183 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 76' ' ' TYR . . . . . 0.476 ' CZ ' HD11 ' A' ' 72' ' ' ILE . 1.4 m-30 -68.23 -48.06 66.14 Favored 'General case' 0 CA--C 1.517 -0.318 0 CA-C-N 118.225 0.466 . . . . 0.0 110.779 176.358 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 51.3 tp -68.59 -37.25 79.69 Favored 'General case' 0 N--CA 1.448 -0.534 0 C-N-CA 118.617 -1.233 . . . . 0.0 110.021 -177.669 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 96.5 m-20 -67.87 -40.27 83.61 Favored 'General case' 0 C--N 1.333 -0.139 0 N-CA-C 113.273 0.842 . . . . 0.0 113.273 -179.584 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 13.6 mm-40 -65.8 -48.37 71.97 Favored 'General case' 0 N--CA 1.456 -0.175 0 C-N-CA 119.917 -0.713 . . . . 0.0 110.336 174.06 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 80' ' ' THR . . . . . 0.447 HG21 ' HB3' ' A' ' 94' ' ' CYS . 76.5 p -66.53 -26.86 67.35 Favored 'General case' 0 CA--C 1.529 0.145 0 CA-C-N 118.505 0.593 . . . . 0.0 111.251 -179.632 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 74.7 mtt180 -65.41 -37.75 87.88 Favored 'General case' 0 C--N 1.338 0.067 0 C-N-CA 122.717 0.407 . . . . 0.0 110.393 170.858 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 20.7 m . . . . . 0 N--CA 1.452 -0.326 0 N-CA-C 112.07 0.396 . . . . 0.0 112.07 -176.645 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 91.0 Cg_endo . . . . . 0 N--CA 1.454 -0.83 0 N-CA-C 108.951 -1.211 . . . . 0.0 108.951 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 92' ' ' GLY . . . . . 0.413 ' HA2' ' O ' ' A' ' 40' ' ' ILE . . . 97.73 16.65 33.09 Favored Glycine 0 CA--C 1.527 0.842 0 CA-C-O 119.507 -0.607 . . . . 0.0 113.793 179.944 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 21.9 p -152.22 169.36 22.66 Favored 'General case' 0 C--O 1.231 0.099 0 CA-C-N 118.14 0.97 . . . . 0.0 110.508 178.179 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 94' ' ' CYS . . . . . 0.478 ' HB2' HD13 ' A' ' 98' ' ' ILE . 30.0 p -57.8 -23.24 51.52 Favored 'General case' 0 N--CA 1.449 -0.514 0 CA-C-N 115.956 -0.565 . . . . 0.0 109.64 175.88 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -60.38 -55.84 28.68 Favored 'General case' 0 N--CA 1.446 -0.659 0 N-CA-C 109.358 -0.608 . . . . 0.0 109.358 -178.013 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 53.9 t60 -76.06 -29.5 58.04 Favored 'General case' 0 N--CA 1.451 -0.401 0 N-CA-C 111.608 0.225 . . . . 0.0 111.608 179.997 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -67.58 -49.46 63.04 Favored 'General case' 0 N--CA 1.448 -0.528 0 N-CA-C 110.493 -0.188 . . . . 0.0 110.493 -178.596 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 98' ' ' ILE . . . . . 0.478 HD13 ' HB2' ' A' ' 94' ' ' CYS . 2.1 mp -72.47 -26.84 24.83 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.313 0 C-N-CA 120.546 -0.461 . . . . 0.0 110.062 178.78 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 3.7 m120 -63.69 -45.0 92.02 Favored 'General case' 0 N--CA 1.454 -0.264 0 CA-C-N 118.912 0.778 . . . . 0.0 110.193 173.251 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 85.0 m -65.04 -35.5 81.38 Favored 'General case' 0 N--CA 1.455 -0.189 0 C-N-CA 122.705 0.402 . . . . 0.0 110.967 -176.395 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 93.3 mt -75.74 -35.36 60.24 Favored 'General case' 0 N--CA 1.448 -0.559 0 N-CA-C 110.501 -0.185 . . . . 0.0 110.501 176.461 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -75.44 -30.23 58.73 Favored Glycine 0 CA--C 1.527 0.813 0 CA-C-O 119.785 -0.453 . . . . 0.0 112.941 -175.843 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 25.8 pt-20 -75.99 -6.11 49.43 Favored 'General case' 0 CA--C 1.53 0.183 0 CA-C-N 117.856 0.828 . . . . 0.0 111.926 -177.348 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 27.0 m -140.17 21.04 0.56 Allowed 'Isoleucine or valine' 0 CA--C 1.531 0.218 0 CA-C-N 118.102 0.41 . . . . 0.0 111.064 175.524 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 105' ' ' ILE . . . . . . . . . . . . . 10.0 tp -62.05 -39.21 82.95 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.288 0 CA-C-N 118.033 0.379 . . . . 0.0 111.768 -173.958 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 13.3 pt20 -73.86 -31.08 63.0 Favored 'General case' 0 N--CA 1.454 -0.228 0 O-C-N 122.009 -0.432 . . . . 0.0 110.19 -179.421 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 58.7 mm-40 -76.11 -41.42 50.28 Favored 'General case' 0 N--CA 1.454 -0.258 0 CA-C-N 117.743 0.247 . . . . 0.0 110.467 -179.863 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 65.7 tp -70.32 -38.49 74.94 Favored 'General case' 0 N--CA 1.45 -0.463 0 C-N-CA 122.657 0.383 . . . . 0.0 110.61 -177.775 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 88.5 mt -73.44 -42.51 61.9 Favored 'General case' 0 N--CA 1.453 -0.31 0 C-N-CA 120.692 -0.403 . . . . 0.0 110.16 177.386 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 45.6 t -58.07 -43.96 87.26 Favored 'General case' 0 N--CA 1.456 -0.129 0 CA-C-N 118.187 0.449 . . . . 0.0 110.465 178.753 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 55.0 t0 -64.48 -39.72 94.33 Favored 'General case' 0 N--CA 1.453 -0.299 0 N-CA-C 108.682 -0.859 . . . . 0.0 108.682 175.59 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 112' ' ' ALA . . . . . 0.428 ' HA ' ' HD2' ' A' ' 62' ' ' LYS . . . -66.39 -38.32 87.26 Favored 'General case' 0 N--CA 1.444 -0.742 0 N-CA-C 112.202 0.445 . . . . 0.0 112.202 -175.89 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 113' ' ' ILE . . . . . 0.451 HG22 ' HE3' ' A' ' 121' ' ' LYS . 9.3 mm -71.83 -38.99 67.26 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.287 0 CA-C-N 118.462 0.574 . . . . 0.0 109.809 179.816 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -71.26 -35.44 71.4 Favored 'General case' 0 CA--C 1.531 0.23 0 N-CA-C 112.247 0.462 . . . . 0.0 112.247 178.916 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 5.2 tppp? -74.15 -32.91 63.33 Favored 'General case' 0 N--CA 1.456 -0.141 0 C-N-CA 123.004 0.522 . . . . 0.0 110.779 178.436 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 116' ' ' SER . . . . . 0.493 ' HA ' ' CG ' ' A' ' 59' ' ' ASP . 94.4 p -90.93 142.86 27.32 Favored 'General case' 0 N--CA 1.452 -0.37 0 N-CA-C 113.188 0.811 . . . . 0.0 113.188 -169.972 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 14.0 t-20 -76.82 170.53 16.3 Favored 'General case' 0 N--CA 1.454 -0.23 0 N-CA-C 109.013 -0.736 . . . . 0.0 109.013 173.456 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 118' ' ' GLN . . . . . . . . . . . . . 13.9 mm100 -58.88 -32.2 69.27 Favored 'General case' 0 CA--C 1.528 0.097 0 N-CA-C 112.489 0.551 . . . . 0.0 112.489 -170.859 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 10.5 t0 -63.22 -51.81 64.78 Favored 'General case' 0 C--O 1.233 0.221 0 CA-C-O 121.508 0.671 . . . . 0.0 109.257 175.572 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 120' ' ' HIS . . . . . 0.404 ' HB2' ' HB2' ' A' ' 116' ' ' SER . 98.5 m-70 -72.83 -25.44 61.13 Favored 'General case' 0 N--CA 1.447 -0.595 0 CA-C-N 116.046 -0.524 . . . . 0.0 111.098 -177.555 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 121' ' ' LYS . . . . . 0.451 ' HE3' HG22 ' A' ' 113' ' ' ILE . 56.3 mttp -61.44 -44.65 96.75 Favored 'General case' 0 C--N 1.338 0.073 0 N-CA-C 108.973 -0.751 . . . . 0.0 108.973 172.012 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 41.0 tp10 -67.63 -35.78 79.56 Favored 'General case' 0 N--CA 1.454 -0.246 0 C-N-CA 122.185 0.194 . . . . 0.0 111.123 -177.223 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 43.7 mtmt -71.21 -30.23 66.12 Favored 'General case' 0 N--CA 1.454 -0.246 0 O-C-N 122.129 -0.357 . . . . 0.0 110.537 178.147 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 124' ' ' ILE . . . . . 0.599 HD11 ' HE3' ' A' ' 62' ' ' LYS . 56.4 mt -68.8 -37.69 77.78 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.195 0 N-CA-C 108.891 -0.781 . . . . 0.0 108.891 171.802 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 125' ' ' ARG . . . . . 0.422 ' HA ' ' HD2' ' A' ' 125' ' ' ARG . 6.1 mmm180 -61.5 -45.33 94.65 Favored 'General case' 0 N--CA 1.453 -0.284 0 CA-C-O 118.717 -0.659 . . . . 0.0 111.476 -179.606 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 126' ' ' MET . . . . . . . . . . . . . 28.5 ptm -64.85 -34.34 78.15 Favored 'General case' 0 N--CA 1.455 -0.176 0 C-N-CA 119.187 -1.005 . . . . 0.0 108.923 177.712 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 3.6 mp -64.41 -39.82 94.59 Favored 'General case' 0 CA--C 1.531 0.224 0 CA-C-N 118.317 0.508 . . . . 0.0 110.873 175.742 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 81.3 mt -70.23 -30.59 67.71 Favored 'General case' 0 N--CA 1.454 -0.263 0 CA-C-N 118.404 0.547 . . . . 0.0 111.191 179.755 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 48.5 m-20 -73.97 -35.86 64.52 Favored 'General case' 0 N--CA 1.456 -0.143 0 N-CA-C 109.951 -0.389 . . . . 0.0 109.951 176.102 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 60.1 mt -62.15 -35.8 70.87 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.22 0 N-CA-C 109.133 -0.691 . . . . 0.0 109.133 175.273 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 131' ' ' TRP . . . . . . . . . . . . . 43.3 m0 . . . . . 0 N--CA 1.455 -0.21 0 N-CA-C 112.975 0.732 . . . . 0.0 112.975 179.536 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 28.6 p-10 . . . . . 0 N--CA 1.452 -0.342 0 CA-C-O 120.555 0.217 . . . . 0.0 110.434 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 7' ' ' PHE . . . . . 0.472 ' CD1' ' HD3' ' A' ' 45' ' ' LYS . 1.5 t80 -59.18 -41.97 89.73 Favored 'General case' 0 N--CA 1.449 -0.508 0 CA-C-N 116.746 -0.207 . . . . 0.0 110.489 -178.984 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 9.7 tp60 -55.18 -32.74 62.41 Favored 'General case' 0 N--CA 1.454 -0.252 0 C-N-CA 122.635 0.374 . . . . 0.0 110.934 -178.793 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 27.4 m-20 -70.84 -34.64 71.88 Favored 'General case' 0 N--CA 1.45 -0.455 0 N-CA-C 109.49 -0.559 . . . . 0.0 109.49 179.856 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 10' ' ' PHE . . . . . 0.519 ' CE2' ' HB2' ' A' ' 32' ' ' LEU . 11.7 t80 -69.14 -41.45 77.29 Favored 'General case' 0 N--CA 1.453 -0.284 0 C-N-CA 123.295 0.638 . . . . 0.0 109.411 175.503 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 94.6 t -63.68 -50.1 79.42 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.36 0 N-CA-C 109.032 -0.729 . . . . 0.0 109.032 179.771 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -61.13 -28.45 69.11 Favored 'General case' 0 N--CA 1.451 -0.409 0 C-N-CA 122.702 0.401 . . . . 0.0 111.137 179.731 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 85.8 m -73.98 -38.22 64.23 Favored 'General case' 0 N--CA 1.454 -0.266 0 N-CA-C 109.335 -0.617 . . . . 0.0 109.335 175.817 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.408 ' HA ' ' CD1' ' A' ' 17' ' ' PHE . 0.1 OUTLIER -64.67 -43.82 92.36 Favored 'General case' 0 N--CA 1.453 -0.285 0 N-CA-C 108.809 -0.811 . . . . 0.0 108.809 176.916 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 66.4 mm-40 -65.22 -29.05 69.82 Favored 'General case' 0 N--CA 1.454 -0.243 0 C-N-CA 123.88 0.872 . . . . 0.0 109.988 178.633 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 67.0 m -69.76 -29.03 66.28 Favored 'General case' 0 N--CA 1.451 -0.397 0 N-CA-C 109.787 -0.449 . . . . 0.0 109.787 176.968 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 17' ' ' PHE . . . . . 0.467 ' CD1' HD11 ' A' ' 68' ' ' ILE . 18.4 m-85 -68.55 -40.49 80.62 Favored 'General case' 0 N--CA 1.456 -0.151 0 C-N-CA 120.195 -0.602 . . . . 0.0 109.869 172.814 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . 0.4 ' HG2' ' CE1' ' A' ' 53' ' ' TYR . 65.5 mttt -65.48 -26.14 67.8 Favored 'General case' 0 N--CA 1.463 0.187 0 CA-C-O 121.134 0.492 . . . . 0.0 110.544 178.338 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 31.7 t0 -81.04 -6.81 59.24 Favored 'General case' 0 CA--C 1.536 0.442 0 C-N-CA 123.748 0.819 . . . . 0.0 112.99 -178.537 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . 0.42 ' CD1' ' HB2' ' A' ' 25' ' ' SER . 18.4 mt -93.6 151.01 19.96 Favored 'General case' 0 N--CA 1.455 -0.2 0 N-CA-C 113.17 0.804 . . . . 0.0 113.17 -176.558 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -71.75 -6.36 40.77 Favored 'General case' 0 CA--C 1.53 0.188 0 C-N-CA 124.049 0.939 . . . . 0.0 112.978 178.532 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 58.9 m -137.85 -7.8 1.63 Allowed 'General case' 0 CA--C 1.522 -0.096 0 N-CA-C 112.925 0.713 . . . . 0.0 112.925 -176.875 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 72.52 -25.69 0.74 Allowed Glycine 0 CA--C 1.528 0.859 0 C-N-CA 123.758 0.694 . . . . 0.0 112.512 -179.805 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 94.8 mt -76.98 141.64 15.35 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.263 0 N-CA-C 108.012 -1.107 . . . . 0.0 108.012 175.388 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . 0.42 ' HB2' ' CD1' ' A' ' 20' ' ' LEU . 7.5 t -160.51 79.88 0.65 Allowed 'General case' 0 CA--C 1.518 -0.254 0 N-CA-C 110.209 -0.293 . . . . 0.0 110.209 -174.598 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . 0.4 ' O ' ' HE2' ' A' ' 30' ' ' LYS . . . -48.28 -49.95 24.19 Favored Glycine 0 CA--C 1.527 0.782 0 CA-C-O 118.851 -0.972 . . . . 0.0 114.17 -171.002 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . 0.522 ' HA ' ' HE3' ' A' ' 30' ' ' LYS . 47.3 p -73.27 -33.34 65.2 Favored 'General case' 0 C--N 1.339 0.14 0 CA-C-N 119.962 1.881 . . . . 0.0 111.641 -174.54 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 2.3 mpt_? -73.91 -36.8 64.76 Favored 'General case' 0 N--CA 1.456 -0.147 0 N-CA-C 109.253 -0.647 . . . . 0.0 109.253 177.344 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 74.5 mt -61.25 -47.51 93.17 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.287 0 N-CA-C 109.007 -0.738 . . . . 0.0 109.007 175.417 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . 0.522 ' HE3' ' HA ' ' A' ' 27' ' ' SER . 52.1 mtmt -64.87 -30.15 71.14 Favored 'General case' 0 C--N 1.339 0.122 0 CA-C-O 119.36 -0.352 . . . . 0.0 111.135 179.65 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . 0.47 ' CE ' ' HA ' ' A' ' 31' ' ' LYS . 2.8 mmpt? -65.87 -60.07 3.23 Favored 'General case' 0 N--CA 1.455 -0.223 0 CA-C-N 118.455 0.57 . . . . 0.0 111.328 -179.942 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.519 ' HB2' ' CE2' ' A' ' 10' ' ' PHE . 1.2 pp -75.89 -16.55 60.02 Favored 'General case' 0 CA--C 1.532 0.276 0 C-N-CA 119.247 -0.981 . . . . 0.0 111.687 -177.925 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . 0.434 ' N ' HD12 ' A' ' 32' ' ' LEU . 24.7 m -70.26 -42.94 71.49 Favored 'General case' 0 N--CA 1.454 -0.232 0 N-CA-C 108.398 -0.964 . . . . 0.0 108.398 173.338 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 93.5 m -66.65 -41.46 88.19 Favored 'General case' 0 N--CA 1.45 -0.459 0 N-CA-C 109.664 -0.495 . . . . 0.0 109.664 -178.728 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 23.8 t80 -60.49 -36.53 78.54 Favored 'General case' 0 C--N 1.339 0.122 0 N-CA-C 110.155 -0.313 . . . . 0.0 110.155 177.073 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -72.3 -28.12 62.88 Favored 'General case' 0 N--CA 1.451 -0.391 0 CA-C-O 119.211 -0.423 . . . . 0.0 111.516 179.457 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 2.7 mm? -82.12 -34.08 29.4 Favored 'General case' 0 CA--C 1.518 -0.281 0 N-CA-C 108.822 -0.807 . . . . 0.0 108.822 -177.923 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 86.7 m-20 -64.4 -27.19 68.83 Favored 'General case' 0 N--CA 1.444 -0.766 0 C-N-CA 123.652 0.781 . . . . 0.0 110.959 174.274 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 65.8 m80 -151.53 106.62 3.29 Favored 'General case' 0 N--CA 1.454 -0.234 0 C-N-CA 122.624 0.37 . . . . 0.0 111.621 -179.187 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 40' ' ' ILE . . . . . 0.597 ' H ' HD13 ' A' ' 40' ' ' ILE . 0.0 OUTLIER -80.53 -10.15 12.3 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.359 0 C-N-CA 123.058 0.543 . . . . 0.0 109.728 173.631 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -55.4 -23.39 24.45 Favored 'General case' 0 N--CA 1.457 -0.122 0 C-N-CA 123.86 0.864 . . . . 0.0 111.86 -178.016 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -108.6 18.0 6.74 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.246 0 C-N-CA 124.032 0.933 . . . . 0.0 111.95 -179.83 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 3.0 pp20? -53.33 -30.1 37.46 Favored 'General case' 0 CA--C 1.53 0.183 0 O-C-N 121.649 -0.657 . . . . 0.0 111.598 178.985 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 47.1 t -65.33 -44.49 87.61 Favored 'General case' 0 CA--C 1.53 0.196 0 N-CA-C 111.756 0.28 . . . . 0.0 111.756 -175.89 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . 0.472 ' HD3' ' CD1' ' A' ' 7' ' ' PHE . 19.4 ptpt -73.94 -24.79 59.71 Favored 'General case' 0 C--N 1.341 0.22 0 O-C-N 121.738 -0.601 . . . . 0.0 110.167 179.253 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 84.8 mt -72.99 -48.17 45.4 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.327 0 C-N-CA 122.873 0.469 . . . . 0.0 109.948 -179.475 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 35.5 mm -63.92 -35.54 73.69 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.323 0 N-CA-C 109.646 -0.501 . . . . 0.0 109.646 178.977 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 15.4 t -63.25 -45.76 90.06 Favored 'General case' 0 N--CA 1.453 -0.276 0 C-N-CA 119.813 -0.755 . . . . 0.0 110.557 178.158 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . 0.417 HD23 ' HA ' ' A' ' 49' ' ' LEU . 25.7 mt -66.6 -33.6 76.03 Favored 'General case' 0 N--CA 1.451 -0.415 0 CA-C-O 118.677 -0.677 . . . . 0.0 112.684 -175.671 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 15.9 pt -69.58 -42.64 80.67 Favored 'Isoleucine or valine' 0 C--N 1.339 0.12 0 CA-C-N 119.553 1.069 . . . . 0.0 110.85 177.077 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 37.7 pt -71.03 -39.86 75.32 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.173 0 C-N-CA 119.926 -0.71 . . . . 0.0 111.13 179.8 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 79.7 m-20 -65.99 -42.31 89.98 Favored 'General case' 0 N--CA 1.454 -0.238 0 C-N-CA 122.492 0.317 . . . . 0.0 110.589 178.984 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 53' ' ' TYR . . . . . 0.4 ' CE1' ' HG2' ' A' ' 18' ' ' LYS . 14.5 t80 -64.95 -45.23 86.63 Favored 'General case' 0 N--CA 1.451 -0.419 0 N-CA-C 109.566 -0.531 . . . . 0.0 109.566 178.266 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 23.7 m -63.84 -30.16 71.27 Favored 'General case' 0 N--CA 1.456 -0.156 0 N-CA-C 111.502 0.186 . . . . 0.0 111.502 -177.522 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 15.6 tpp180 -75.63 -45.07 39.44 Favored 'General case' 0 N--CA 1.453 -0.281 0 O-C-N 122.957 0.161 . . . . 0.0 110.822 -177.16 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 42.0 mt -83.71 -43.4 15.56 Favored 'General case' 0 N--CA 1.456 -0.154 0 N-CA-C 113.379 0.881 . . . . 0.0 113.379 -174.912 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 9.0 p -64.42 154.42 83.85 Favored Pre-proline 0 CA--C 1.535 0.4 0 N-CA-C 113.074 0.768 . . . . 0.0 113.074 -172.088 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 94.6 Cg_endo -74.43 171.6 17.79 Favored 'Trans proline' 0 N--CA 1.455 -0.745 0 C-N-CA 125.125 3.883 . . . . 0.0 111.824 179.806 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -43.5 -49.14 7.39 Favored 'General case' 0 CA--C 1.532 0.255 0 C-N-CA 125.909 1.684 . . . . 0.0 113.794 -174.173 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 87.9 p -70.08 -35.34 74.12 Favored 'General case' 0 N--CA 1.457 -0.118 0 O-C-N 121.967 -0.458 . . . . 0.0 110.684 -176.408 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 62.3 m170 -75.33 -24.91 57.45 Favored 'General case' 0 N--CA 1.45 -0.438 0 CA-C-O 119.28 -0.39 . . . . 0.0 110.379 178.617 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 66.3 mttm -64.61 -47.76 77.43 Favored 'General case' 0 C--N 1.342 0.251 0 N-CA-C 109.094 -0.706 . . . . 0.0 109.094 172.913 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -58.93 -43.23 91.12 Favored 'General case' 0 CA--C 1.533 0.316 0 N-CA-C 108.003 -1.11 . . . . 0.0 108.003 177.454 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -63.02 -34.84 91.05 Favored Glycine 0 CA--C 1.526 0.733 0 N-CA-C 111.146 -0.782 . . . . 0.0 111.146 -179.582 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 44.6 t -67.32 -39.18 85.84 Favored 'General case' 0 N--CA 1.452 -0.337 0 CA-C-N 117.61 0.705 . . . . 0.0 109.644 177.409 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 8.0 mp -64.27 -28.92 70.05 Favored 'General case' 0 N--CA 1.453 -0.324 0 N-CA-C 110.098 -0.334 . . . . 0.0 110.098 178.38 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 0.9 OUTLIER -69.96 -41.27 74.71 Favored 'General case' 0 CA--C 1.528 0.123 0 CA-C-N 117.784 0.265 . . . . 0.0 110.59 175.673 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 68' ' ' ILE . . . . . 0.467 HD11 ' CD1' ' A' ' 17' ' ' PHE . 8.3 mt -64.19 -48.56 85.11 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.269 0 N-CA-C 109.73 -0.471 . . . . 0.0 109.73 176.874 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 91.2 mt -57.75 -33.71 46.02 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.317 0 C-N-CA 123.129 0.572 . . . . 0.0 111.504 178.117 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 17.6 t70 -69.63 -41.84 75.11 Favored 'General case' 0 CA--C 1.521 -0.139 0 CA-C-N 119.116 0.871 . . . . 0.0 110.563 176.986 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 35.4 t -66.24 -59.6 3.58 Favored 'General case' 0 N--CA 1.45 -0.431 0 C-N-CA 122.672 0.389 . . . . 0.0 110.279 -177.381 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -75.17 -33.05 27.56 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.272 0 O-C-N 122.262 -0.274 . . . . 0.0 110.511 -177.217 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -68.33 -50.32 39.41 Favored Glycine 0 CA--C 1.524 0.613 0 N-CA-C 111.739 -0.544 . . . . 0.0 111.739 -174.119 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 41.6 mtm105 -72.13 -39.17 69.0 Favored 'General case' 0 N--CA 1.452 -0.347 0 CA-C-N 117.482 0.641 . . . . 0.0 109.753 179.061 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -62.56 -30.33 71.23 Favored 'General case' 0 N--CA 1.45 -0.461 0 C-N-CA 119.788 -0.765 . . . . 0.0 110.334 -179.611 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 1.7 m-30 -70.02 -53.46 17.49 Favored 'General case' 0 CA--C 1.518 -0.25 0 CA-C-N 118.161 0.437 . . . . 0.0 111.133 176.317 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -71.4 -32.0 67.92 Favored 'General case' 0 N--CA 1.449 -0.512 0 C-N-CA 117.751 -1.58 . . . . 0.0 109.865 -175.04 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 85.5 m-20 -68.9 -45.57 70.57 Favored 'General case' 0 N--CA 1.457 -0.096 0 CA-C-N 118.218 0.463 . . . . 0.0 112.152 179.378 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 15.7 tm-20 -65.19 -50.13 67.08 Favored 'General case' 0 N--CA 1.444 -0.727 0 C-N-CA 120.764 -0.374 . . . . 0.0 110.64 179.705 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 80' ' ' THR . . . . . 0.431 HG21 ' HB3' ' A' ' 94' ' ' CYS . 69.3 p -64.74 -27.11 68.68 Favored 'General case' 0 N--CA 1.454 -0.262 0 N-CA-C 111.708 0.262 . . . . 0.0 111.708 -179.242 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 32.8 ttp-105 -75.26 -30.56 60.51 Favored 'General case' 0 N--CA 1.456 -0.156 0 C-N-CA 122.806 0.442 . . . . 0.0 110.807 175.468 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 19.8 m . . . . . 0 N--CA 1.454 -0.232 0 C-N-CA 122.894 0.478 . . . . 0.0 111.673 -179.75 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 31.2 Cg_exo . . . . . 0 N--CA 1.451 -1.022 0 N-CA-C 109.368 -1.051 . . . . 0.0 109.368 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 83.6 13.81 74.9 Favored Glycine 0 CA--C 1.528 0.871 0 N-CA-C 111.65 -0.58 . . . . 0.0 111.65 -177.088 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -153.52 165.23 36.53 Favored 'General case' 0 N--CA 1.454 -0.245 0 C-N-CA 124.534 1.134 . . . . 0.0 109.469 -179.845 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 94' ' ' CYS . . . . . 0.431 ' HB3' HG21 ' A' ' 80' ' ' THR . 29.4 p -56.22 -21.35 22.76 Favored 'General case' 0 N--CA 1.453 -0.305 0 C-N-CA 123.519 0.728 . . . . 0.0 110.925 177.323 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -58.31 -63.44 1.27 Allowed 'General case' 0 N--CA 1.447 -0.616 0 O-C-N 122.297 -0.252 . . . . 0.0 110.327 -176.111 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 76.8 t60 -71.62 -33.28 68.83 Favored 'General case' 0 N--CA 1.451 -0.418 0 CA-C-N 117.609 0.186 . . . . 0.0 110.514 -179.489 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -62.75 -52.78 61.89 Favored 'General case' 0 N--CA 1.451 -0.388 0 O-C-N 123.229 0.331 . . . . 0.0 111.535 -176.837 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 98' ' ' ILE . . . . . 0.426 HD13 ' HB2' ' A' ' 94' ' ' CYS . 1.8 mp -71.82 -36.11 57.31 Favored 'Isoleucine or valine' 0 C--N 1.338 0.097 0 C-N-CA 121.001 -0.28 . . . . 0.0 110.75 -178.69 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 24.4 m-80 -69.02 -38.51 79.25 Favored 'General case' 0 N--CA 1.455 -0.2 0 CA-C-N 118.442 0.565 . . . . 0.0 111.736 -179.996 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 99.6 m -73.37 -33.68 65.18 Favored 'General case' 0 N--CA 1.456 -0.143 0 CA-C-N 118.422 0.555 . . . . 0.0 110.449 -178.98 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 62.6 tp -75.29 -37.56 60.79 Favored 'General case' 0 N--CA 1.449 -0.489 0 N-CA-C 110.317 -0.253 . . . . 0.0 110.317 179.707 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -61.96 -22.75 62.83 Favored Glycine 0 CA--C 1.527 0.81 0 CA-C-O 119.448 -0.64 . . . . 0.0 113.138 -173.752 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 13.7 mm-40 -80.14 -39.32 29.67 Favored 'General case' 0 N--CA 1.452 -0.36 0 CA-C-N 117.702 0.751 . . . . 0.0 112.403 -179.939 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 21.7 m -100.61 -14.77 7.8 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.092 0 N-CA-C 112.992 0.738 . . . . 0.0 112.992 -175.746 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 105' ' ' ILE . . . . . . . . . . . . . 9.8 tp -63.5 -26.8 41.62 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.206 0 CA-C-N 118.511 0.596 . . . . 0.0 111.206 -177.458 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 20.3 pt20 -66.27 -29.85 70.17 Favored 'General case' 0 N--CA 1.452 -0.361 0 O-C-N 122.006 -0.434 . . . . 0.0 111.039 -179.937 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 84.0 mt-10 -73.74 -40.7 63.34 Favored 'General case' 0 N--CA 1.453 -0.31 0 N-CA-C 109.511 -0.552 . . . . 0.0 109.511 177.395 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 66.1 mt -74.96 -35.94 62.08 Favored 'General case' 0 N--CA 1.451 -0.405 0 C-N-CA 122.996 0.518 . . . . 0.0 111.343 -174.853 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 92.7 mt -70.54 -52.71 19.84 Favored 'General case' 0 N--CA 1.452 -0.341 0 N-CA-C 109.583 -0.525 . . . . 0.0 109.583 177.163 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 13.1 t -59.26 -37.43 77.6 Favored 'General case' 0 N--CA 1.453 -0.276 0 CA-C-N 117.749 0.249 . . . . 0.0 111.034 -178.153 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 36.9 t0 -62.87 -45.75 91.1 Favored 'General case' 0 N--CA 1.454 -0.267 0 N-CA-C 108.883 -0.784 . . . . 0.0 108.883 174.59 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -65.7 -30.36 71.03 Favored 'General case' 0 N--CA 1.448 -0.569 0 CA-C-O 118.959 -0.543 . . . . 0.0 110.837 -176.538 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 113' ' ' ILE . . . . . . . . . . . . . 49.6 mm -68.19 -50.78 54.91 Favored 'Isoleucine or valine' 0 C--N 1.34 0.156 0 CA-C-N 119.073 0.851 . . . . 0.0 109.56 177.647 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -69.63 -41.29 75.82 Favored 'General case' 0 N--CA 1.449 -0.501 0 O-C-N 123.03 0.207 . . . . 0.0 111.088 -175.381 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 115' ' ' LYS . . . . . 0.575 ' HE2' ' HA ' ' A' ' 115' ' ' LYS . 0.6 OUTLIER -75.61 -40.42 56.4 Favored 'General case' 0 N--CA 1.45 -0.429 0 N-CA-C 113.977 1.103 . . . . 0.0 113.977 -176.521 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 116' ' ' SER . . . . . 0.479 ' HB3' ' CB ' ' A' ' 120' ' ' HIS . 2.4 m -80.53 157.33 26.14 Favored 'General case' 0 CA--C 1.53 0.188 0 C-N-CA 120.181 -0.608 . . . . 0.0 112.539 -169.156 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 62.9 t30 -72.74 171.35 12.76 Favored 'General case' 0 CA--C 1.531 0.213 0 C-N-CA 124.05 0.94 . . . . 0.0 111.887 -174.845 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 118' ' ' GLN . . . . . . . . . . . . . 53.6 mt-30 -51.4 -44.3 62.18 Favored 'General case' 0 C--O 1.231 0.115 0 C-N-CA 123.615 0.766 . . . . 0.0 111.553 -176.826 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 22.5 t0 -65.97 -33.04 74.9 Favored 'General case' 0 N--CA 1.454 -0.234 0 CA-C-O 121.469 0.652 . . . . 0.0 109.975 -179.717 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 120' ' ' HIS . . . . . 0.479 ' CB ' ' HB3' ' A' ' 116' ' ' SER . 21.9 m170 -75.98 -45.88 32.5 Favored 'General case' 0 N--CA 1.447 -0.576 0 CA-C-N 115.746 -0.661 . . . . 0.0 110.342 -178.824 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 52.8 mttm -57.7 -37.77 74.07 Favored 'General case' 0 C--N 1.341 0.234 0 N-CA-C 108.856 -0.794 . . . . 0.0 108.856 179.792 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 7.0 tm-20 -62.48 -51.99 65.29 Favored 'General case' 0 N--CA 1.452 -0.373 0 C-N-CA 122.251 0.221 . . . . 0.0 110.758 179.004 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 3.1 mtmm -64.77 -27.12 68.68 Favored 'General case' 0 N--CA 1.454 -0.226 0 CA-C-N 116.761 -0.2 . . . . 0.0 111.244 179.866 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 124' ' ' ILE . . . . . . . . . . . . . 54.6 mt -74.81 -39.65 45.81 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.242 0 O-C-N 121.576 -0.702 . . . . 0.0 109.517 175.706 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 125' ' ' ARG . . . . . 0.424 ' HA ' HH11 ' A' ' 125' ' ' ARG . 7.2 mmm180 -59.79 -41.5 91.3 Favored 'General case' 0 N--CA 1.454 -0.271 0 CA-C-O 119.073 -0.489 . . . . 0.0 111.09 178.584 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 126' ' ' MET . . . . . . . . . . . . . 28.1 ptm -66.23 -39.98 89.93 Favored 'General case' 0 N--CA 1.449 -0.48 0 C-N-CA 118.542 -1.263 . . . . 0.0 108.409 176.663 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 4.0 mp -62.29 -36.95 83.7 Favored 'General case' 0 N--CA 1.456 -0.174 0 CA-C-N 118.839 0.745 . . . . 0.0 111.549 179.845 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 93.2 mt -67.61 -42.94 81.58 Favored 'General case' 0 N--CA 1.457 -0.099 0 CA-C-N 118.551 0.614 . . . . 0.0 110.325 178.598 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 27.6 m-20 -69.73 -32.4 70.93 Favored 'General case' 0 N--CA 1.454 -0.261 0 N-CA-C 110.045 -0.354 . . . . 0.0 110.045 178.946 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 34.5 mt -61.98 -39.76 84.82 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.286 0 N-CA-C 109.885 -0.413 . . . . 0.0 109.885 176.641 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 131' ' ' TRP . . . . . . . . . . . . . 32.3 m0 . . . . . 0 N--CA 1.453 -0.302 0 C-N-CA 120.372 -0.531 . . . . 0.0 112.084 -179.779 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 21.3 p-10 . . . . . 0 CA--C 1.518 -0.28 0 CA-C-O 120.649 0.261 . . . . 0.0 111.678 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -75.65 -41.58 53.7 Favored 'General case' 0 N--CA 1.441 -0.905 0 C-N-CA 120.356 -0.538 . . . . 0.0 111.534 -170.501 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 52.2 tp60 -52.52 -36.57 55.62 Favored 'General case' 0 N--CA 1.453 -0.298 0 N-CA-C 112.169 0.433 . . . . 0.0 112.169 -176.179 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 54.2 m-80 -71.74 -35.64 70.2 Favored 'General case' 0 N--CA 1.453 -0.291 0 C-N-CA 120.541 -0.463 . . . . 0.0 110.139 179.391 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 10' ' ' PHE . . . . . 0.426 ' CE1' HD22 ' A' ' 32' ' ' LEU . 1.9 t80 -71.99 -37.49 69.84 Favored 'General case' 0 N--CA 1.451 -0.394 0 C-N-CA 123.011 0.524 . . . . 0.0 110.891 178.987 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 99.3 t -65.79 -57.3 11.23 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.337 0 N-CA-C 108.625 -0.88 . . . . 0.0 108.625 179.6 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -59.06 -31.35 68.79 Favored 'General case' 0 N--CA 1.453 -0.284 0 C-N-CA 122.894 0.477 . . . . 0.0 112.021 -177.246 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 79.2 m -70.31 -39.36 74.85 Favored 'General case' 0 N--CA 1.456 -0.144 0 CA-C-N 118.723 0.692 . . . . 0.0 109.588 176.707 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.441 ' HA ' ' CD1' ' A' ' 17' ' ' PHE . 2.8 tp -70.15 -39.66 75.24 Favored 'General case' 0 N--CA 1.453 -0.285 0 CA-C-O 121.169 0.509 . . . . 0.0 110.489 -179.479 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 61.7 mm-40 -64.07 -29.69 70.81 Favored 'General case' 0 N--CA 1.45 -0.431 0 N-CA-C 108.872 -0.788 . . . . 0.0 108.872 177.617 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 32.3 t -71.59 -29.18 64.41 Favored 'General case' 0 N--CA 1.45 -0.455 0 CA-C-O 119.476 -0.297 . . . . 0.0 110.427 177.306 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 17' ' ' PHE . . . . . 0.535 ' CD1' HD11 ' A' ' 68' ' ' ILE . 27.3 m-85 -67.6 -36.66 81.29 Favored 'General case' 0 C--N 1.342 0.253 0 CA-C-N 118.508 0.595 . . . . 0.0 110.845 172.503 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . 0.495 ' HG2' ' CE1' ' A' ' 53' ' ' TYR . 61.2 mttt -61.49 -37.72 84.66 Favored 'General case' 0 C--N 1.341 0.202 0 C-N-CA 120.088 -0.645 . . . . 0.0 109.367 176.643 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 39.1 t0 -81.07 -18.87 45.13 Favored 'General case' 0 CA--C 1.534 0.331 0 N-CA-C 113.176 0.806 . . . . 0.0 113.176 -178.908 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . 0.451 HD12 ' HA ' ' A' ' 17' ' ' PHE . 1.4 mt -64.8 -7.51 11.38 Favored 'General case' 0 C--O 1.227 -0.1 0 CA-C-O 118.439 -0.791 . . . . 0.0 112.816 178.722 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 36.0 mmtm 64.19 -48.08 0.29 Allowed 'General case' 0 CA--C 1.528 0.111 0 C-N-CA 126.506 1.923 . . . . 0.0 112.547 179.602 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 53.3 m -85.74 -13.26 48.9 Favored 'General case' 0 N--CA 1.451 -0.418 0 C-N-CA 123.186 0.594 . . . . 0.0 110.861 174.309 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 79.31 -34.33 1.99 Allowed Glycine 0 CA--C 1.527 0.834 0 C-N-CA 124.45 1.024 . . . . 0.0 113.16 175.553 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 93.9 mt -80.45 146.15 8.02 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.252 0 CA-C-N 118.025 0.912 . . . . 0.0 111.401 -178.933 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 35.1 t -169.02 97.68 0.36 Allowed 'General case' 0 CA--C 1.517 -0.326 0 N-CA-C 108.274 -1.01 . . . . 0.0 108.274 173.438 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -53.41 -34.72 49.22 Favored Glycine 0 CA--C 1.526 0.742 0 CA-C-O 119.405 -0.664 . . . . 0.0 111.672 -176.518 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 98.4 p -66.6 -49.92 64.74 Favored 'General case' 0 N--CA 1.456 -0.157 0 CA-C-N 118.255 1.027 . . . . 0.0 110.432 -178.261 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 33.8 mtm180 -73.83 -34.9 64.75 Favored 'General case' 0 C--O 1.231 0.127 0 C-N-CA 122.383 0.273 . . . . 0.0 110.788 -179.077 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 59.7 mt -58.79 -50.44 79.32 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.467 0 N-CA-C 109.228 -0.656 . . . . 0.0 109.228 174.55 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 70.9 mttt -64.47 -28.73 69.87 Favored 'General case' 0 CA--C 1.529 0.141 0 CA-C-O 118.904 -0.569 . . . . 0.0 111.43 178.773 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . 0.439 ' CE ' ' HA ' ' A' ' 31' ' ' LYS . 3.4 mmpt? -63.41 -58.88 5.65 Favored 'General case' 0 N--CA 1.457 -0.083 0 CA-C-N 118.624 0.647 . . . . 0.0 111.205 179.124 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.514 HD12 ' N ' ' A' ' 33' ' ' THR . 1.4 pp -75.78 -18.42 59.53 Favored 'General case' 0 N--CA 1.454 -0.256 0 C-N-CA 118.732 -1.187 . . . . 0.0 111.739 -178.714 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . 0.514 ' N ' HD12 ' A' ' 32' ' ' LEU . 38.6 m -70.76 -41.49 71.68 Favored 'General case' 0 N--CA 1.455 -0.201 0 N-CA-C 108.664 -0.865 . . . . 0.0 108.664 175.931 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 98.2 m -69.54 -38.31 77.43 Favored 'General case' 0 N--CA 1.45 -0.46 0 CA-C-N 116.459 -0.337 . . . . 0.0 110.441 -178.188 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 26.6 t80 -69.89 -29.81 67.1 Favored 'General case' 0 N--CA 1.454 -0.259 0 C-N-CA 119.826 -0.75 . . . . 0.0 110.899 178.369 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -68.94 -32.15 71.55 Favored 'General case' 0 N--CA 1.448 -0.571 0 N-CA-C 110.313 -0.254 . . . . 0.0 110.313 176.53 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -76.98 -34.26 57.56 Favored 'General case' 0 N--CA 1.456 -0.154 0 N-CA-C 110.173 -0.306 . . . . 0.0 110.173 174.171 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 40.4 t0 -60.55 -24.81 65.7 Favored 'General case' 0 CA--C 1.531 0.229 0 C-N-CA 122.926 0.49 . . . . 0.0 110.563 175.547 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 27.3 m-70 -158.32 110.19 2.25 Favored 'General case' 0 N--CA 1.455 -0.193 0 C-N-CA 123.374 0.67 . . . . 0.0 111.28 172.691 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 40' ' ' ILE . . . . . 0.584 ' H ' HD13 ' A' ' 40' ' ' ILE . 0.0 OUTLIER -77.35 -11.39 13.59 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.385 0 N-CA-C 109.626 -0.509 . . . . 0.0 109.626 173.45 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 48.0 m-20 -59.33 -19.91 50.28 Favored 'General case' 0 CA--C 1.532 0.264 0 C-N-CA 122.987 0.515 . . . . 0.0 111.87 -177.916 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -102.95 13.36 6.93 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.195 0 C-N-CA 123.068 0.547 . . . . 0.0 111.848 176.576 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 3.0 pp20? -52.78 -32.01 41.51 Favored 'General case' 0 CA--C 1.527 0.093 0 O-C-N 121.613 -0.679 . . . . 0.0 112.096 -179.659 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 48.2 t -61.99 -48.86 78.46 Favored 'General case' 0 N--CA 1.455 -0.199 0 O-C-N 122.172 -0.33 . . . . 0.0 111.563 -176.113 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 19.6 ptpt -71.9 -24.66 61.69 Favored 'General case' 0 C--N 1.34 0.156 0 O-C-N 121.857 -0.527 . . . . 0.0 109.837 179.764 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 46' ' ' ILE . . . . . 0.42 HG12 ' CZ ' ' A' ' 10' ' ' PHE . 89.6 mt -71.87 -46.0 62.51 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.263 0 C-N-CA 122.763 0.425 . . . . 0.0 110.427 -179.393 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 33.9 mm -63.99 -35.67 74.26 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.224 0 N-CA-C 109.478 -0.564 . . . . 0.0 109.478 178.058 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 13.3 t -63.25 -41.6 99.08 Favored 'General case' 0 N--CA 1.453 -0.319 0 C-N-CA 119.644 -0.822 . . . . 0.0 110.36 177.801 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 4.4 mp -67.99 -37.13 81.12 Favored 'General case' 0 N--CA 1.454 -0.272 0 CA-C-O 118.791 -0.623 . . . . 0.0 112.172 -176.202 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 15.6 pt -69.33 -41.54 80.98 Favored 'Isoleucine or valine' 0 C--O 1.23 0.076 0 CA-C-N 119.168 0.895 . . . . 0.0 110.597 179.901 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 27.5 pt -71.48 -39.75 71.3 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.178 0 C-N-CA 120.084 -0.647 . . . . 0.0 110.646 179.164 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 90.1 m-20 -68.19 -41.67 81.05 Favored 'General case' 0 N--CA 1.452 -0.33 0 CA-C-N 118.1 0.409 . . . . 0.0 112.002 -179.93 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 53' ' ' TYR . . . . . 0.495 ' CE1' ' HG2' ' A' ' 18' ' ' LYS . 8.5 t80 -67.1 -47.04 72.42 Favored 'General case' 0 N--CA 1.453 -0.292 0 N-CA-C 109.202 -0.666 . . . . 0.0 109.202 178.512 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 39.8 t -65.19 -28.16 69.2 Favored 'General case' 0 N--CA 1.453 -0.288 0 N-CA-C 111.589 0.218 . . . . 0.0 111.589 -178.052 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 55.7 ttp85 -75.48 -41.46 55.44 Favored 'General case' 0 N--CA 1.454 -0.232 0 C-N-CA 123.405 0.682 . . . . 0.0 112.251 -179.078 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 46.8 mt -86.98 -43.54 12.28 Favored 'General case' 0 C--O 1.227 -0.111 0 N-CA-C 112.541 0.571 . . . . 0.0 112.541 -176.448 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 8.2 p -66.48 156.8 84.83 Favored Pre-proline 0 CA--C 1.538 0.486 0 N-CA-C 113.416 0.895 . . . . 0.0 113.416 -172.666 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 87.2 Cg_endo -73.49 173.3 14.06 Favored 'Trans proline' 0 N--CA 1.456 -0.711 0 C-N-CA 124.707 3.605 . . . . 0.0 111.048 178.887 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -51.78 -42.78 62.68 Favored 'General case' 0 CA--C 1.53 0.197 0 N-CA-C 113.581 0.956 . . . . 0.0 113.581 -172.96 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 51.0 m -66.88 -40.39 87.78 Favored 'General case' 0 N--CA 1.455 -0.189 0 CA-C-N 118.076 0.398 . . . . 0.0 110.283 -177.006 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 39.9 m170 -75.78 -24.11 55.97 Favored 'General case' 0 N--CA 1.45 -0.44 0 N-CA-C 109.89 -0.411 . . . . 0.0 109.89 177.272 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . 0.405 ' HB2' ' HE2' ' A' ' 62' ' ' LYS . 19.7 ttmm -73.61 -34.02 64.86 Favored 'General case' 0 N--CA 1.454 -0.257 0 C-N-CA 123.744 0.817 . . . . 0.0 109.595 178.51 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -66.54 -45.18 80.28 Favored 'General case' 0 CA--C 1.53 0.186 0 N-CA-C 107.334 -1.358 . . . . 0.0 107.334 172.719 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -64.96 -30.45 78.04 Favored Glycine 0 C--N 1.34 0.768 0 N-CA-C 111.193 -0.763 . . . . 0.0 111.193 179.241 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 59.4 m -67.54 -40.63 85.02 Favored 'General case' 0 N--CA 1.454 -0.255 0 N-CA-C 109.419 -0.586 . . . . 0.0 109.419 177.649 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 59.6 mt -70.82 -24.05 62.47 Favored 'General case' 0 N--CA 1.452 -0.326 0 N-CA-C 110.187 -0.301 . . . . 0.0 110.187 178.885 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -72.43 -37.91 68.47 Favored 'General case' 0 C--O 1.231 0.101 0 CA-C-N 117.932 0.333 . . . . 0.0 110.105 175.421 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 68' ' ' ILE . . . . . 0.535 HD11 ' CD1' ' A' ' 17' ' ' PHE . 18.2 mt -68.48 -44.94 82.79 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.342 0 N-CA-C 109.114 -0.699 . . . . 0.0 109.114 176.609 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 76.2 mt -58.34 -32.01 44.06 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.114 0 C-N-CA 123.156 0.582 . . . . 0.0 110.748 175.791 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 19.7 t70 -69.57 -47.11 64.72 Favored 'General case' 0 N--CA 1.454 -0.263 0 CA-C-N 117.967 0.349 . . . . 0.0 111.325 179.696 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 99.2 p -71.59 -47.35 55.38 Favored 'General case' 0 N--CA 1.449 -0.503 0 C-N-CA 121.092 -0.243 . . . . 0.0 110.73 -176.538 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -75.66 -34.04 27.88 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.28 0 N-CA-C 109.879 -0.415 . . . . 0.0 109.879 -178.539 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -66.23 -52.41 36.5 Favored Glycine 0 C--N 1.334 0.466 0 N-CA-C 111.248 -0.741 . . . . 0.0 111.248 -175.745 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 44.5 mtm105 -71.46 -38.65 71.26 Favored 'General case' 0 N--CA 1.451 -0.408 0 CA-C-O 119.168 -0.444 . . . . 0.0 110.767 -179.926 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -63.16 -30.94 71.99 Favored 'General case' 0 N--CA 1.451 -0.401 0 C-N-CA 119.763 -0.775 . . . . 0.0 109.972 -179.231 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 1.8 m-30 -69.76 -52.14 27.94 Favored 'General case' 0 N--CA 1.454 -0.234 0 CA-C-O 119.265 -0.398 . . . . 0.0 110.965 176.473 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 8.0 tt -70.28 -45.53 66.17 Favored 'General case' 0 N--CA 1.448 -0.547 0 C-N-CA 117.328 -1.749 . . . . 0.0 109.458 -176.474 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 91.0 m-20 -56.96 -47.64 80.25 Favored 'General case' 0 N--CA 1.455 -0.189 0 CA-C-O 119.17 -0.443 . . . . 0.0 111.795 -176.244 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 75.5 mm-40 -70.41 -41.38 73.05 Favored 'General case' 0 N--CA 1.455 -0.22 0 CA-C-N 118.498 0.59 . . . . 0.0 111.902 -179.614 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 80.9 p -72.38 -28.14 62.82 Favored 'General case' 0 CA--C 1.529 0.148 0 CA-C-N 118.804 0.729 . . . . 0.0 111.574 -179.429 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 5.7 tmm_? -82.48 -35.05 27.79 Favored 'General case' 0 N--CA 1.457 -0.09 0 C-N-CA 123.22 0.608 . . . . 0.0 111.48 179.372 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 40.0 t . . . . . 0 N--CA 1.457 -0.082 0 N-CA-C 113.086 0.773 . . . . 0.0 113.086 -179.326 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 83.7 Cg_endo . . . . . 0 N--CA 1.453 -0.877 0 N-CA-C 108.94 -1.215 . . . . 0.0 108.94 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 88.64 15.33 60.05 Favored Glycine 0 CA--C 1.526 0.762 0 C-N-CA 121.186 -0.53 . . . . 0.0 112.175 -177.753 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -152.48 164.35 37.75 Favored 'General case' 0 N--CA 1.455 -0.187 0 C-N-CA 124.025 0.93 . . . . 0.0 110.042 179.679 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 94' ' ' CYS . . . . . 0.593 ' SG ' HD13 ' A' ' 98' ' ' ILE . 2.5 t -52.63 -26.47 13.74 Favored 'General case' 0 N--CA 1.453 -0.317 0 C-N-CA 123.316 0.646 . . . . 0.0 110.716 175.93 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -55.74 -58.76 6.48 Favored 'General case' 0 N--CA 1.449 -0.501 0 O-C-N 122.164 -0.335 . . . . 0.0 110.598 -176.98 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 76.3 t60 -75.49 -32.96 60.74 Favored 'General case' 0 N--CA 1.453 -0.306 0 O-C-N 122.286 -0.259 . . . . 0.0 111.117 -179.833 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -65.4 -51.86 57.45 Favored 'General case' 0 N--CA 1.449 -0.493 0 O-C-N 122.977 0.173 . . . . 0.0 111.453 -176.255 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 98' ' ' ILE . . . . . 0.593 HD13 ' SG ' ' A' ' 94' ' ' CYS . 1.7 mp -72.03 -34.18 49.67 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.153 0 N-CA-C 110.18 -0.304 . . . . 0.0 110.18 -179.248 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 1.7 m120 -66.87 -46.18 75.78 Favored 'General case' 0 N--CA 1.452 -0.355 0 C-N-CA 120.319 -0.552 . . . . 0.0 111.304 178.281 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 87.8 m -67.95 -35.03 77.7 Favored 'General case' 0 N--CA 1.456 -0.125 0 CA-C-N 118.077 0.399 . . . . 0.0 110.896 -176.319 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 57.7 tp -75.9 -39.83 55.57 Favored 'General case' 0 N--CA 1.449 -0.489 0 CA-C-O 119.779 -0.153 . . . . 0.0 111.05 -179.261 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -66.37 -16.09 64.49 Favored Glycine 0 CA--C 1.528 0.849 0 CA-C-O 119.634 -0.537 . . . . 0.0 112.717 -175.549 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 14.9 mm-40 -78.83 -34.77 44.9 Favored 'General case' 0 N--CA 1.455 -0.211 0 CA-C-N 117.754 0.777 . . . . 0.0 112.133 179.908 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 18.9 m -112.44 3.47 8.4 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.135 0 O-C-N 124.007 0.817 . . . . 0.0 112.88 -174.027 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 105' ' ' ILE . . . . . . . . . . . . . 10.9 tp -68.93 -26.93 33.68 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.224 0 O-C-N 121.927 -0.483 . . . . 0.0 111.49 -177.915 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 14.1 pt20 -70.32 -31.56 68.93 Favored 'General case' 0 N--CA 1.455 -0.214 0 O-C-N 121.786 -0.571 . . . . 0.0 110.085 -178.888 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 48.4 mp0 -71.49 -38.74 71.15 Favored 'General case' 0 N--CA 1.451 -0.394 0 CA-C-N 118.256 0.48 . . . . 0.0 110.32 177.705 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 87.3 mt -74.11 -36.24 64.2 Favored 'General case' 0 N--CA 1.455 -0.212 0 N-CA-C 110.669 -0.122 . . . . 0.0 110.669 -178.401 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 87.6 mt -71.58 -47.7 53.14 Favored 'General case' 0 N--CA 1.452 -0.344 0 C-N-CA 120.874 -0.33 . . . . 0.0 110.295 176.133 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 48.3 t -57.16 -40.34 77.06 Favored 'General case' 0 N--CA 1.457 -0.105 0 C-N-CA 122.435 0.294 . . . . 0.0 110.604 179.716 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 39.8 t0 -64.12 -42.75 96.72 Favored 'General case' 0 N--CA 1.453 -0.282 0 N-CA-C 109.256 -0.646 . . . . 0.0 109.256 176.156 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -70.79 -39.01 73.39 Favored 'General case' 0 N--CA 1.445 -0.68 0 CA-C-O 119.141 -0.457 . . . . 0.0 111.36 -175.252 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 113' ' ' ILE . . . . . . . . . . . . . 12.1 mm -68.65 -38.53 79.12 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.276 0 CA-C-N 119.592 1.087 . . . . 0.0 109.75 -179.308 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -67.2 -47.6 70.41 Favored 'General case' 0 N--CA 1.45 -0.464 0 C-N-CA 122.839 0.456 . . . . 0.0 111.707 178.234 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 115' ' ' LYS . . . . . 0.588 ' HE2' ' HA ' ' A' ' 115' ' ' LYS . 0.3 OUTLIER -84.05 -34.79 24.16 Favored 'General case' 0 N--CA 1.455 -0.194 0 N-CA-C 114.018 1.118 . . . . 0.0 114.018 -172.907 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 116' ' ' SER . . . . . 0.453 ' HB2' ' CB ' ' A' ' 120' ' ' HIS . 28.3 p -77.63 159.42 29.21 Favored 'General case' 0 CA--C 1.528 0.121 0 N-CA-C 112.527 0.565 . . . . 0.0 112.527 -172.505 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 7.8 t-20 -80.35 164.58 23.02 Favored 'General case' 0 C--O 1.225 -0.22 0 C-N-CA 123.713 0.805 . . . . 0.0 111.127 -178.461 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 118' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -44.76 -48.86 10.85 Favored 'General case' 0 N--CA 1.455 -0.197 0 C-N-CA 124.034 0.934 . . . . 0.0 113.05 -179.176 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 49.8 t0 -60.76 -39.69 89.68 Favored 'General case' 0 CA--C 1.531 0.217 0 CA-C-O 121.002 0.429 . . . . 0.0 110.192 178.51 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 120' ' ' HIS . . . . . 0.453 ' CB ' ' HB2' ' A' ' 116' ' ' SER . 24.9 m170 -68.67 -40.8 79.96 Favored 'General case' 0 N--CA 1.451 -0.38 0 N-CA-C 109.69 -0.485 . . . . 0.0 109.69 -179.053 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 94.8 mttt -59.26 -34.6 72.44 Favored 'General case' 0 C--N 1.339 0.127 0 N-CA-C 109.446 -0.576 . . . . 0.0 109.446 178.87 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 24.2 tt0 -67.58 -45.98 73.97 Favored 'General case' 0 N--CA 1.455 -0.193 0 C-N-CA 122.527 0.331 . . . . 0.0 110.766 179.134 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 14.4 mptt -68.18 -35.42 77.99 Favored 'General case' 0 C--N 1.338 0.099 0 C-N-CA 120.42 -0.512 . . . . 0.0 110.386 -177.753 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 124' ' ' ILE . . . . . . . . . . . . . 63.5 mt -66.7 -38.52 81.74 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.207 0 N-CA-C 108.96 -0.756 . . . . 0.0 108.96 177.513 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 125' ' ' ARG . . . . . 0.442 ' HA ' ' HD2' ' A' ' 125' ' ' ARG . 25.0 tpt85 -66.39 -42.22 88.21 Favored 'General case' 0 N--CA 1.443 -0.776 0 N-CA-C 111.849 0.314 . . . . 0.0 111.849 -172.431 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 126' ' ' MET . . . . . . . . . . . . . 27.1 ptm -67.13 -33.28 75.1 Favored 'General case' 0 N--CA 1.45 -0.436 0 N-CA-C 108.965 -0.754 . . . . 0.0 108.965 175.606 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 2.7 mp -61.92 -34.55 76.28 Favored 'General case' 0 CA--C 1.53 0.203 0 CA-C-O 119.271 -0.395 . . . . 0.0 110.146 176.227 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 53.6 mt -68.1 -43.46 78.4 Favored 'General case' 0 N--CA 1.455 -0.201 0 CA-C-N 119.139 0.881 . . . . 0.0 110.459 178.743 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 55.3 m-20 -65.47 -37.74 87.74 Favored 'General case' 0 CA--C 1.529 0.163 0 C-N-CA 120.314 -0.555 . . . . 0.0 110.042 177.925 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 53.1 mt -63.06 -36.39 75.65 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.319 0 C-N-CA 122.766 0.426 . . . . 0.0 110.297 178.516 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 131' ' ' TRP . . . . . . . . . . . . . 51.4 m0 . . . . . 0 N--CA 1.453 -0.299 0 N-CA-C 112.522 0.564 . . . . 0.0 112.522 -179.27 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 23.1 p-10 . . . . . 0 CA--C 1.52 -0.184 0 N-CA-C 106.835 -1.543 . . . . 0.0 106.835 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 7' ' ' PHE . . . . . 0.44 ' CE1' HD22 ' A' ' 49' ' ' LEU . 0.7 OUTLIER -75.05 -34.3 61.82 Favored 'General case' 0 N--CA 1.441 -0.886 0 CA-C-N 115.341 -0.845 . . . . 0.0 110.129 -179.023 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 60.5 tp60 -48.19 -39.84 22.27 Favored 'General case' 0 CA--C 1.529 0.163 0 C-N-CA 123.984 0.914 . . . . 0.0 112.125 -175.427 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 4.1 m-80 -70.16 -38.65 75.49 Favored 'General case' 0 CA--C 1.529 0.173 0 CA-C-O 121.264 0.554 . . . . 0.0 110.283 -178.867 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 1.8 t80 -70.82 -37.38 73.2 Favored 'General case' 0 N--CA 1.451 -0.425 0 C-N-CA 124.289 1.036 . . . . 0.0 109.601 179.503 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 74.9 t -68.6 -52.9 31.26 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.302 0 N-CA-C 108.872 -0.788 . . . . 0.0 108.872 179.322 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -57.91 -31.43 66.77 Favored 'General case' 0 N--CA 1.453 -0.29 0 CA-C-N 117.78 0.264 . . . . 0.0 111.519 -179.135 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 82.9 m -69.31 -42.67 75.1 Favored 'General case' 0 CA--C 1.534 0.332 0 N-CA-C 109.015 -0.735 . . . . 0.0 109.015 175.366 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.459 HD11 ' CD2' ' A' ' 53' ' ' TYR . 0.1 OUTLIER -64.09 -40.23 95.77 Favored 'General case' 0 N--CA 1.454 -0.232 0 C-N-CA 122.947 0.499 . . . . 0.0 110.039 179.152 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 73.1 mm-40 -65.27 -32.5 74.19 Favored 'General case' 0 N--CA 1.451 -0.38 0 C-N-CA 123.565 0.746 . . . . 0.0 109.702 179.558 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 16.2 p -65.14 -34.28 78.02 Favored 'General case' 0 N--CA 1.454 -0.253 0 N-CA-C 109.537 -0.542 . . . . 0.0 109.537 176.068 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 17' ' ' PHE . . . . . 0.536 ' CD1' HD11 ' A' ' 68' ' ' ILE . 14.8 m-30 -67.18 -34.26 77.15 Favored 'General case' 0 N--CA 1.458 -0.038 0 C-N-CA 121.187 -0.205 . . . . 0.0 111.529 175.845 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . 0.513 ' HG2' ' CE1' ' A' ' 53' ' ' TYR . 53.2 mttt -68.99 -24.9 64.28 Favored 'General case' 0 C--O 1.227 -0.089 0 N-CA-C 110.084 -0.339 . . . . 0.0 110.084 175.172 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 30.6 t0 -78.43 -23.9 46.41 Favored 'General case' 0 CA--C 1.534 0.359 0 C-N-CA 123.106 0.563 . . . . 0.0 111.811 178.23 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 93.3 mt -75.53 164.93 25.84 Favored 'General case' 0 CA--C 1.529 0.17 0 CA-C-O 121.132 0.492 . . . . 0.0 111.196 179.101 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -94.01 -45.53 7.55 Favored 'General case' 0 N--CA 1.455 -0.212 0 N-CA-C 108.573 -0.899 . . . . 0.0 108.573 177.533 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 53.9 m -80.43 -16.35 54.62 Favored 'General case' 0 CA--C 1.529 0.139 0 C-N-CA 122.949 0.5 . . . . 0.0 111.563 -179.235 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 72.6 -29.05 0.73 Allowed Glycine 0 CA--C 1.529 0.963 0 C-N-CA 124.29 0.948 . . . . 0.0 113.203 178.134 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 94.6 mt -75.81 147.54 7.95 Favored 'Isoleucine or valine' 0 C--N 1.339 0.109 0 CA-C-N 117.94 0.87 . . . . 0.0 109.455 177.028 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 6.4 t -163.7 78.23 0.41 Allowed 'General case' 0 N--CA 1.453 -0.312 0 N-CA-C 110.322 -0.251 . . . . 0.0 110.322 -178.495 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -45.72 -52.74 9.12 Favored Glycine 0 CA--C 1.527 0.798 0 CA-C-O 118.928 -0.929 . . . . 0.0 114.126 -170.63 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 37.8 t -65.5 -45.04 85.12 Favored 'General case' 0 N--CA 1.456 -0.157 0 CA-C-N 119.432 1.616 . . . . 0.0 110.918 -175.374 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 17.1 mtm180 -70.48 -37.64 74.26 Favored 'General case' 0 CA--C 1.527 0.091 0 CA-C-O 119.385 -0.341 . . . . 0.0 111.228 -179.356 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 63.4 mt -56.5 -43.92 79.25 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.474 0 N-CA-C 108.185 -1.042 . . . . 0.0 108.185 172.105 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 46.0 mtmt -70.81 -19.3 62.69 Favored 'General case' 0 N--CA 1.452 -0.337 0 CA-C-O 118.653 -0.689 . . . . 0.0 111.753 179.382 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . 0.518 ' HA ' ' HE3' ' A' ' 31' ' ' LYS . 0.0 OUTLIER -69.32 -55.17 11.21 Favored 'General case' 0 C--N 1.343 0.284 0 CA-C-N 119.223 0.919 . . . . 0.0 109.585 174.793 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.422 HD12 ' N ' ' A' ' 33' ' ' THR . 3.2 pp -75.18 -19.71 59.69 Favored 'General case' 0 N--CA 1.456 -0.145 0 C-N-CA 119.567 -0.853 . . . . 0.0 111.177 -178.773 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . 0.422 ' N ' HD12 ' A' ' 32' ' ' LEU . 53.3 m -71.84 -43.18 65.97 Favored 'General case' 0 N--CA 1.453 -0.314 0 N-CA-C 108.923 -0.769 . . . . 0.0 108.923 175.535 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 80.6 m -67.39 -37.53 83.27 Favored 'General case' 0 N--CA 1.453 -0.284 0 O-C-N 122.359 -0.213 . . . . 0.0 110.449 -177.7 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 81.0 t80 -68.68 -34.42 75.65 Favored 'General case' 0 N--CA 1.45 -0.467 0 O-C-N 122.285 -0.259 . . . . 0.0 110.493 177.451 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -68.48 -36.18 78.58 Favored 'General case' 0 N--CA 1.451 -0.421 0 O-C-N 122.288 -0.257 . . . . 0.0 110.352 177.688 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -69.86 -33.84 72.8 Favored 'General case' 0 N--CA 1.455 -0.208 0 C-N-CA 122.729 0.412 . . . . 0.0 110.32 179.357 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 43.5 t0 -69.44 -21.59 63.72 Favored 'General case' 0 N--CA 1.451 -0.393 0 C-N-CA 122.564 0.346 . . . . 0.0 110.767 176.129 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 95.6 m-70 -150.67 95.62 2.25 Favored 'General case' 0 C--N 1.341 0.22 0 N-CA-C 112.208 0.447 . . . . 0.0 112.208 -175.413 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 40' ' ' ILE . . . . . 0.617 ' H ' HD13 ' A' ' 40' ' ' ILE . 0.0 OUTLIER -74.28 -13.28 15.64 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.291 0 CA-C-O 119.529 -0.272 . . . . 0.0 110.311 175.09 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 19.1 m-20 -57.68 -22.46 46.16 Favored 'General case' 0 N--CA 1.456 -0.131 0 C-N-CA 122.975 0.51 . . . . 0.0 112.104 -176.997 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -108.77 18.38 6.6 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.185 0 C-N-CA 122.897 0.479 . . . . 0.0 112.255 178.384 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 3.1 pp20? -52.85 -27.58 19.03 Favored 'General case' 0 C--O 1.226 -0.165 0 CA-C-N 118.365 0.529 . . . . 0.0 109.582 174.785 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 90.3 p -58.94 -55.11 39.42 Favored 'General case' 0 N--CA 1.453 -0.294 0 C-N-CA 123.668 0.787 . . . . 0.0 111.315 -178.708 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . 0.435 ' HD3' ' CD1' ' A' ' 7' ' ' PHE . 17.0 ptpt -73.76 -21.5 60.17 Favored 'General case' 0 C--N 1.338 0.108 0 O-C-N 122.298 -0.251 . . . . 0.0 110.98 -179.858 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 93.5 mt -74.37 -45.61 46.01 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.198 0 N-CA-C 110.045 -0.354 . . . . 0.0 110.045 -179.81 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 34.6 mm -66.35 -38.85 82.71 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.126 0 N-CA-C 109.422 -0.584 . . . . 0.0 109.422 178.66 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 27.4 t -63.05 -38.92 93.11 Favored 'General case' 0 N--CA 1.453 -0.278 0 C-N-CA 119.657 -0.817 . . . . 0.0 109.887 177.332 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . 0.44 HD22 ' CE1' ' A' ' 7' ' ' PHE . 32.7 tp -72.03 -31.89 66.61 Favored 'General case' 0 N--CA 1.449 -0.52 0 N-CA-C 112.615 0.598 . . . . 0.0 112.615 -173.772 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 14.4 pt -70.82 -41.34 77.33 Favored 'Isoleucine or valine' 0 C--N 1.34 0.169 0 CA-C-N 118.785 0.72 . . . . 0.0 110.099 175.996 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 42.4 pt -71.38 -37.74 66.24 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.171 0 C-N-CA 119.875 -0.73 . . . . 0.0 110.85 179.664 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 84.5 m-20 -65.37 -44.99 85.88 Favored 'General case' 0 C--O 1.233 0.214 0 CA-C-N 117.927 0.331 . . . . 0.0 111.307 177.849 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 53' ' ' TYR . . . . . 0.513 ' CE1' ' HG2' ' A' ' 18' ' ' LYS . 9.3 t80 -60.64 -42.94 97.94 Favored 'General case' 0 C--N 1.34 0.189 0 N-CA-C 108.893 -0.78 . . . . 0.0 108.893 176.365 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 25.0 m -69.21 -26.93 65.06 Favored 'General case' 0 N--CA 1.453 -0.319 0 C-N-CA 122.197 0.199 . . . . 0.0 111.479 -177.899 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 51.9 tpt85 -75.78 -35.13 60.21 Favored 'General case' 0 N--CA 1.455 -0.194 0 O-C-N 121.985 -0.447 . . . . 0.0 111.336 -178.697 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 32.4 mt -89.08 -43.17 11.27 Favored 'General case' 0 N--CA 1.457 -0.113 0 N-CA-C 112.772 0.656 . . . . 0.0 112.772 -177.548 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 57' ' ' CYS . . . . . 0.44 ' HB2' ' CB ' ' A' ' 61' ' ' HIS . 3.4 p -65.89 157.86 78.08 Favored Pre-proline 0 CA--C 1.536 0.422 0 N-CA-C 114.981 1.474 . . . . 0.0 114.981 -169.715 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 58' ' ' PRO . . . . . 0.415 ' HD2' ' HB2' ' A' ' 57' ' ' CYS . 51.5 Cg_endo -78.12 -166.92 0.43 Allowed 'Trans proline' 0 N--CA 1.456 -0.677 1 C-N-CA 125.72 4.28 . . . . 0.0 111.243 175.29 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 29.9 p-10 -61.7 -52.26 65.05 Favored 'General case' 0 CA--C 1.53 0.2 0 C-N-CA 125.131 1.372 . . . . 0.0 113.793 -172.15 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 40.3 m -67.73 -34.25 76.47 Favored 'General case' 0 N--CA 1.455 -0.198 0 CA-C-O 120.709 0.29 . . . . 0.0 110.615 -174.234 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 61' ' ' HIS . . . . . 0.44 ' CB ' ' HB2' ' A' ' 57' ' ' CYS . 55.3 m170 -74.33 -23.29 59.03 Favored 'General case' 0 N--CA 1.452 -0.33 0 N-CA-C 109.901 -0.407 . . . . 0.0 109.901 176.132 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 4.4 tppt? -67.36 -39.8 85.73 Favored 'General case' 0 N--CA 1.455 -0.215 0 N-CA-C 108.978 -0.749 . . . . 0.0 108.978 176.558 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -67.49 -42.41 82.96 Favored 'General case' 0 N--CA 1.454 -0.254 0 N-CA-C 108.875 -0.787 . . . . 0.0 108.875 177.221 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -66.14 -31.0 77.94 Favored Glycine 0 C--N 1.339 0.738 0 N-CA-C 111.116 -0.794 . . . . 0.0 111.116 179.533 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 50.5 m -67.29 -43.04 82.75 Favored 'General case' 0 N--CA 1.455 -0.189 0 N-CA-C 109.808 -0.442 . . . . 0.0 109.808 177.571 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 61.3 mt -68.51 -25.98 65.22 Favored 'General case' 0 N--CA 1.453 -0.311 0 CA-C-O 119.554 -0.26 . . . . 0.0 110.79 179.384 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 1.4 m-85 -70.94 -37.81 72.87 Favored 'General case' 0 N--CA 1.455 -0.215 0 CA-C-N 117.778 0.263 . . . . 0.0 110.721 175.473 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 68' ' ' ILE . . . . . 0.536 HD11 ' CD1' ' A' ' 17' ' ' PHE . 14.7 mt -67.69 -46.9 81.78 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.472 0 N-CA-C 108.859 -0.793 . . . . 0.0 108.859 176.401 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 95.7 mt -57.39 -37.5 57.69 Favored 'Isoleucine or valine' 0 C--N 1.339 0.128 0 C-N-CA 123.49 0.716 . . . . 0.0 111.071 176.641 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 17.6 t70 -69.42 -43.6 73.07 Favored 'General case' 0 N--CA 1.455 -0.19 0 CA-C-N 118.161 0.437 . . . . 0.0 110.291 178.421 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 29.4 t -66.63 -57.33 7.42 Favored 'General case' 0 N--CA 1.451 -0.385 0 C-N-CA 122.733 0.413 . . . . 0.0 110.988 -176.993 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -75.57 -32.32 24.71 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.408 0 N-CA-C 109.868 -0.419 . . . . 0.0 109.868 -176.733 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -64.84 -50.55 57.77 Favored Glycine 0 C--N 1.337 0.606 0 N-CA-C 111.385 -0.686 . . . . 0.0 111.385 -175.587 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 37.1 mtm105 -71.88 -39.13 69.84 Favored 'General case' 0 N--CA 1.451 -0.383 0 CA-C-N 117.481 0.64 . . . . 0.0 110.134 178.81 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -62.16 -33.94 75.46 Favored 'General case' 0 N--CA 1.452 -0.357 0 C-N-CA 120.54 -0.464 . . . . 0.0 110.751 -179.122 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 1.4 m-30 -69.79 -49.85 48.8 Favored 'General case' 0 CA--C 1.52 -0.204 0 CA-C-N 118.419 0.554 . . . . 0.0 111.023 175.764 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 2.5 tm? -67.93 -35.85 79.14 Favored 'General case' 0 N--CA 1.45 -0.443 0 C-N-CA 118.689 -1.204 . . . . 0.0 109.092 -175.024 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 92.6 m-20 -65.79 -46.9 76.96 Favored 'General case' 0 C--O 1.231 0.116 0 N-CA-C 112.488 0.551 . . . . 0.0 112.488 177.166 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 13.6 tm-20 -65.02 -47.77 76.25 Favored 'General case' 0 N--CA 1.448 -0.573 0 C-N-CA 121.096 -0.241 . . . . 0.0 110.55 -179.027 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 80' ' ' THR . . . . . 0.568 HG21 ' HB3' ' A' ' 94' ' ' CYS . 68.4 p -67.27 -28.33 67.94 Favored 'General case' 0 N--CA 1.45 -0.463 0 CA-C-O 119.502 -0.285 . . . . 0.0 110.913 179.727 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 36.8 ttp-105 -69.93 -26.88 64.35 Favored 'General case' 0 C--N 1.338 0.088 0 CA-C-N 118.544 0.611 . . . . 0.0 110.182 173.401 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 22.5 m . . . . . 0 N--CA 1.454 -0.242 0 N-CA-C 112.965 0.728 . . . . 0.0 112.965 -177.669 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_exo . . . . . 0 N--CA 1.453 -0.875 0 CA-C-O 120.769 0.237 . . . . 0.0 111.707 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 89.31 17.17 56.07 Favored Glycine 0 CA--C 1.528 0.851 0 CA-C-O 119.525 -0.597 . . . . 0.0 113.238 176.427 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -156.21 165.37 36.58 Favored 'General case' 0 N--CA 1.457 -0.076 0 CA-C-N 117.904 0.852 . . . . 0.0 109.557 178.724 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 94' ' ' CYS . . . . . 0.568 ' HB3' HG21 ' A' ' 80' ' ' THR . 31.5 p -55.55 -23.08 24.75 Favored 'General case' 0 N--CA 1.453 -0.317 0 C-N-CA 123.611 0.764 . . . . 0.0 110.813 178.729 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -60.18 -60.35 3.96 Favored 'General case' 0 N--CA 1.445 -0.681 0 N-CA-C 110.098 -0.334 . . . . 0.0 110.098 -176.076 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 75.0 t60 -72.71 -31.45 65.02 Favored 'General case' 0 N--CA 1.451 -0.386 0 O-C-N 122.052 -0.405 . . . . 0.0 110.728 179.417 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -64.33 -53.67 45.04 Favored 'General case' 0 N--CA 1.452 -0.348 0 CA-C-O 119.686 -0.197 . . . . 0.0 111.366 -178.36 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 98' ' ' ILE . . . . . 0.424 HD13 ' HB2' ' A' ' 94' ' ' CYS . 1.9 mp -70.91 -34.31 55.33 Favored 'Isoleucine or valine' 0 C--N 1.339 0.109 0 CA-C-N 118.074 0.397 . . . . 0.0 110.244 -179.757 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 73.0 m-20 -62.56 -42.28 99.44 Favored 'General case' 0 N--CA 1.456 -0.165 0 CA-C-N 118.159 0.436 . . . . 0.0 110.883 177.719 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 92.2 m -74.54 -31.78 62.23 Favored 'General case' 0 N--CA 1.455 -0.178 0 N-CA-C 110.443 -0.206 . . . . 0.0 110.443 -178.705 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -70.82 -41.11 71.98 Favored 'General case' 0 N--CA 1.452 -0.359 0 C-N-CA 122.632 0.373 . . . . 0.0 110.742 -179.01 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -62.47 -20.74 61.6 Favored Glycine 0 CA--C 1.529 0.928 0 CA-C-O 119.63 -0.539 . . . . 0.0 113.741 -173.767 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 55.9 mm-40 -85.58 -36.06 20.66 Favored 'General case' 0 N--CA 1.455 -0.21 0 CA-C-N 118.362 1.081 . . . . 0.0 112.666 -179.837 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 59.0 t -92.14 -26.57 4.89 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.155 0 O-C-N 123.26 0.35 . . . . 0.0 111.765 -176.985 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 105' ' ' ILE . . . . . . . . . . . . . 10.5 tp -62.45 -26.0 39.32 Favored 'Isoleucine or valine' 0 C--N 1.338 0.075 0 O-C-N 122.111 -0.368 . . . . 0.0 111.672 -174.126 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 24.0 pt20 -69.73 -40.69 76.04 Favored 'General case' 0 N--CA 1.451 -0.404 0 C-N-CA 120.96 -0.296 . . . . 0.0 110.695 -178.765 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 76.8 mm-40 -80.89 -26.15 37.05 Favored 'General case' 0 N--CA 1.454 -0.252 0 CA-C-N 118.367 0.531 . . . . 0.0 110.743 176.696 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 6.8 tt -67.69 -42.59 81.81 Favored 'General case' 0 N--CA 1.454 -0.248 0 N-CA-C 108.891 -0.781 . . . . 0.0 108.891 176.277 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 69.2 mt -68.9 -45.42 70.95 Favored 'General case' 0 N--CA 1.449 -0.475 0 N-CA-C 109.192 -0.67 . . . . 0.0 109.192 173.921 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 43.2 t -47.4 -52.07 17.91 Favored 'General case' 0 C--O 1.234 0.264 0 CA-C-N 118.041 0.382 . . . . 0.0 111.087 178.471 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 40.7 t0 -62.09 -43.8 98.05 Favored 'General case' 0 N--CA 1.455 -0.175 0 N-CA-C 109.135 -0.691 . . . . 0.0 109.135 179.362 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -65.08 -39.69 93.56 Favored 'General case' 0 N--CA 1.45 -0.472 0 N-CA-C 112.237 0.458 . . . . 0.0 112.237 -176.424 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 113' ' ' ILE . . . . . . . . . . . . . 26.8 mm -69.08 -39.44 79.53 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.502 0 CA-C-N 119.133 0.879 . . . . 0.0 109.756 -176.714 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -74.95 -43.83 51.87 Favored 'General case' 0 N--CA 1.453 -0.291 0 C-N-CA 120.624 -0.431 . . . . 0.0 111.878 178.935 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 33.3 ttmt -80.0 -30.74 39.7 Favored 'General case' 0 C--O 1.227 -0.11 0 N-CA-C 113.892 1.071 . . . . 0.0 113.892 -173.159 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 116' ' ' SER . . . . . 0.457 ' HB2' ' CB ' ' A' ' 120' ' ' HIS . 50.6 p -80.0 157.28 26.84 Favored 'General case' 0 CA--C 1.529 0.166 0 N-CA-C 111.974 0.361 . . . . 0.0 111.974 -174.139 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 53.1 t30 -76.21 166.5 23.37 Favored 'General case' 0 N--CA 1.454 -0.226 0 C-N-CA 123.323 0.649 . . . . 0.0 110.269 -179.056 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 118' ' ' GLN . . . . . . . . . . . . . 21.2 mm100 -55.11 -38.46 68.19 Favored 'General case' 0 CA--C 1.528 0.13 0 N-CA-C 112.778 0.658 . . . . 0.0 112.778 -172.426 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 8.0 p30 -69.4 -37.77 77.66 Favored 'General case' 0 N--CA 1.457 -0.084 0 N-CA-C 109.667 -0.494 . . . . 0.0 109.667 178.617 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 120' ' ' HIS . . . . . 0.457 ' CB ' ' HB2' ' A' ' 116' ' ' SER . 31.0 m170 -65.47 -42.11 92.61 Favored 'General case' 0 N--CA 1.45 -0.451 0 N-CA-C 109.445 -0.576 . . . . 0.0 109.445 176.798 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 52.8 mttm -56.74 -38.69 72.75 Favored 'General case' 0 C--N 1.341 0.234 0 N-CA-C 109.299 -0.63 . . . . 0.0 109.299 178.147 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 3.5 tm-20 -68.18 -48.93 63.95 Favored 'General case' 0 N--CA 1.456 -0.142 0 CA-C-O 119.47 -0.3 . . . . 0.0 111.71 179.179 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 40.9 mmtm -58.67 -33.65 70.36 Favored 'General case' 0 N--CA 1.456 -0.133 0 CA-C-N 118.112 0.414 . . . . 0.0 111.05 178.31 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 124' ' ' ILE . . . . . . . . . . . . . 57.1 mt -74.17 -37.41 46.18 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.291 0 N-CA-C 109.606 -0.516 . . . . 0.0 109.606 178.122 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 5.9 tpt180 -68.09 -36.68 80.2 Favored 'General case' 0 N--CA 1.45 -0.451 0 O-C-N 122.07 -0.394 . . . . 0.0 111.066 -176.84 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 126' ' ' MET . . . . . . . . . . . . . 5.6 ppp? -75.05 -27.03 59.86 Favored 'General case' 0 C--O 1.226 -0.139 0 N-CA-C 109.913 -0.402 . . . . 0.0 109.913 176.255 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 1.1 mp -62.11 -39.34 92.18 Favored 'General case' 0 CA--C 1.528 0.119 0 CA-C-N 117.928 0.331 . . . . 0.0 110.269 172.066 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -69.44 -37.81 77.53 Favored 'General case' 0 N--CA 1.457 -0.085 0 CA-C-N 118.162 0.437 . . . . 0.0 109.96 178.158 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 18.6 t70 -59.05 -45.03 91.8 Favored 'General case' 0 N--CA 1.452 -0.337 0 N-CA-C 109.27 -0.641 . . . . 0.0 109.27 175.666 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 55.0 mt -60.14 -35.68 63.19 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.24 0 N-CA-C 110.407 -0.22 . . . . 0.0 110.407 179.909 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 131' ' ' TRP . . . . . . . . . . . . . 46.2 m0 . . . . . 0 N--CA 1.453 -0.305 0 N-CA-C 112.937 0.717 . . . . 0.0 112.937 -178.589 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 23.5 p-10 . . . . . 0 N--CA 1.451 -0.408 0 N-CA-C 107.003 -1.48 . . . . 0.0 107.003 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 7' ' ' PHE . . . . . 0.494 ' CD1' ' HD3' ' A' ' 45' ' ' LYS . 1.5 t80 -54.58 -34.45 61.95 Favored 'General case' 0 N--CA 1.45 -0.447 0 CA-C-N 114.839 -1.073 . . . . 0.0 109.311 175.006 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 50.9 tp60 -51.82 -35.64 45.06 Favored 'General case' 0 N--CA 1.454 -0.234 0 C-N-CA 124.564 1.145 . . . . 0.0 111.802 -178.157 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 30.3 m-80 -73.0 -34.13 66.21 Favored 'General case' 0 N--CA 1.455 -0.196 0 N-CA-C 109.826 -0.435 . . . . 0.0 109.826 -179.762 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 10' ' ' PHE . . . . . 0.451 ' CE2' ' HB2' ' A' ' 32' ' ' LEU . 5.1 t80 -69.54 -38.95 77.69 Favored 'General case' 0 N--CA 1.447 -0.59 0 C-N-CA 123.57 0.748 . . . . 0.0 109.166 175.774 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 93.3 t -65.47 -53.18 42.52 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.426 0 N-CA-C 109.167 -0.679 . . . . 0.0 109.167 178.548 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -57.59 -29.18 64.26 Favored 'General case' 0 N--CA 1.454 -0.246 0 C-N-CA 122.554 0.341 . . . . 0.0 111.359 178.884 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 87.2 m -72.31 -39.1 68.5 Favored 'General case' 0 N--CA 1.456 -0.16 0 N-CA-C 109.345 -0.613 . . . . 0.0 109.345 176.263 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -64.74 -45.61 85.73 Favored 'General case' 0 N--CA 1.454 -0.236 0 N-CA-C 109.457 -0.572 . . . . 0.0 109.457 178.356 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 57.5 mm-40 -63.83 -32.12 73.53 Favored 'General case' 0 N--CA 1.453 -0.302 0 N-CA-C 109.357 -0.609 . . . . 0.0 109.357 178.37 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 69.7 m -66.25 -34.13 77.32 Favored 'General case' 0 N--CA 1.45 -0.473 0 CA-C-O 118.722 -0.656 . . . . 0.0 110.188 177.456 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 17' ' ' PHE . . . . . 0.435 ' CD1' HD11 ' A' ' 68' ' ' ILE . 42.8 m-85 -67.77 -39.33 84.13 Favored 'General case' 0 C--N 1.343 0.296 0 CA-C-N 119.036 0.835 . . . . 0.0 110.152 176.274 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . 0.425 ' HG2' ' CE1' ' A' ' 53' ' ' TYR . 46.0 mttt -60.14 -31.2 69.86 Favored 'General case' 0 C--N 1.341 0.208 0 CA-C-N 118.285 0.493 . . . . 0.0 109.844 -179.715 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 45.8 t0 -74.71 -16.78 60.74 Favored 'General case' 0 CA--C 1.534 0.359 0 CA-C-N 115.33 -0.85 . . . . 0.0 112.36 -179.676 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . 0.4 HD11 ' HB2' ' A' ' 25' ' ' SER . 81.8 mt -73.29 158.72 34.59 Favored 'General case' 0 N--CA 1.456 -0.138 0 O-C-N 121.528 -0.732 . . . . 0.0 112.07 -176.796 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 1.5 mppt? -98.3 -2.97 38.24 Favored 'General case' 0 CA--C 1.533 0.317 0 CA-C-N 115.106 -0.952 . . . . 0.0 109.7 176.087 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 87.0 p -120.65 -20.08 7.2 Favored 'General case' 0 C--N 1.34 0.168 0 C-N-CA 123.885 0.874 . . . . 0.0 111.031 179.428 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 77.03 -28.71 1.63 Allowed Glycine 0 CA--C 1.53 0.986 0 C-N-CA 124.093 0.854 . . . . 0.0 111.952 179.424 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 92.8 mt -85.89 150.21 3.98 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.341 0 N-CA-C 108.889 -0.782 . . . . 0.0 108.889 175.181 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . 0.4 ' HB2' HD11 ' A' ' 20' ' ' LEU . 29.7 t -161.56 94.96 0.99 Allowed 'General case' 0 CA--C 1.513 -0.47 0 N-CA-C 109.159 -0.682 . . . . 0.0 109.159 170.006 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -55.56 -34.56 60.36 Favored Glycine 0 N--CA 1.445 -0.722 0 N-CA-C 110.881 -0.887 . . . . 0.0 110.881 -177.646 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 15.8 t -65.28 -54.44 29.24 Favored 'General case' 0 N--CA 1.455 -0.218 0 CA-C-N 118.334 1.067 . . . . 0.0 109.905 179.327 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 17.4 mmt85 -68.19 -38.06 81.61 Favored 'General case' 0 N--CA 1.455 -0.217 0 C-N-CA 122.3 0.24 . . . . 0.0 110.69 -176.523 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 75.6 mt -59.71 -43.49 91.55 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.634 0 N-CA-C 108.615 -0.883 . . . . 0.0 108.615 176.109 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 31.6 mtmm -67.02 -27.61 67.55 Favored 'General case' 0 C--N 1.34 0.19 0 CA-C-O 118.928 -0.558 . . . . 0.0 111.466 178.108 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.55 -58.61 5.38 Favored 'General case' 0 C--N 1.343 0.291 0 CA-C-N 118.848 0.749 . . . . 0.0 110.028 -179.969 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.548 HD12 ' N ' ' A' ' 33' ' ' THR . 2.3 pp -75.31 -19.23 59.77 Favored 'General case' 0 CA--C 1.529 0.144 0 C-N-CA 119.887 -0.725 . . . . 0.0 111.589 -175.964 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . 0.548 ' N ' HD12 ' A' ' 32' ' ' LEU . 37.9 m -71.61 -40.93 69.49 Favored 'General case' 0 N--CA 1.456 -0.158 0 N-CA-C 107.8 -1.185 . . . . 0.0 107.8 176.517 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 92.6 m -68.21 -37.24 80.67 Favored 'General case' 0 N--CA 1.453 -0.323 0 C-N-CA 121.078 -0.249 . . . . 0.0 110.384 -178.563 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 24.1 t80 -63.06 -37.62 87.93 Favored 'General case' 0 N--CA 1.456 -0.135 0 N-CA-C 109.992 -0.373 . . . . 0.0 109.992 175.749 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -73.52 -36.5 65.73 Favored 'General case' 0 N--CA 1.45 -0.434 0 C-N-CA 122.471 0.309 . . . . 0.0 110.761 -179.026 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -71.32 -34.58 70.69 Favored 'General case' 0 N--CA 1.455 -0.183 0 C-N-CA 122.568 0.347 . . . . 0.0 110.547 179.363 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 43.5 t0 -69.72 -22.81 63.36 Favored 'General case' 0 CA--C 1.534 0.344 0 C-N-CA 122.544 0.338 . . . . 0.0 110.745 176.462 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 39' ' ' HIS . . . . . 0.401 ' HB2' HD11 ' A' ' 42' ' ' ILE . 96.5 m-70 -151.68 101.23 2.76 Favored 'General case' 0 N--CA 1.454 -0.24 0 N-CA-C 111.914 0.338 . . . . 0.0 111.914 -175.461 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 40' ' ' ILE . . . . . 0.58 ' H ' HD13 ' A' ' 40' ' ' ILE . 0.0 OUTLIER -78.67 -12.78 13.57 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.294 0 N-CA-C 109.728 -0.471 . . . . 0.0 109.728 174.187 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 17.2 m-20 -57.87 -19.43 29.28 Favored 'General case' 0 N--CA 1.454 -0.235 0 C-N-CA 123.774 0.83 . . . . 0.0 112.655 -176.817 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . 0.401 HD11 ' HB2' ' A' ' 39' ' ' HIS . 0.0 OUTLIER -112.29 19.82 6.79 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.245 0 C-N-CA 123.31 0.644 . . . . 0.0 111.388 178.091 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 3.1 pp20? -52.89 -28.1 21.64 Favored 'General case' 0 CA--C 1.532 0.255 0 O-C-N 121.856 -0.528 . . . . 0.0 111.728 178.055 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 36.6 t -64.97 -48.42 74.11 Favored 'General case' 0 CA--C 1.532 0.269 0 N-CA-C 111.634 0.235 . . . . 0.0 111.634 -177.26 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . 0.494 ' HD3' ' CD1' ' A' ' 7' ' ' PHE . 17.6 ptpt -73.35 -23.6 60.24 Favored 'General case' 0 C--N 1.341 0.2 0 CA-C-N 117.95 0.341 . . . . 0.0 110.398 179.275 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 67.1 mt -72.58 -51.19 29.63 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.318 0 C-N-CA 122.999 0.52 . . . . 0.0 110.278 -178.835 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 36.6 mm -66.78 -38.35 81.33 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.352 0 N-CA-C 109.996 -0.372 . . . . 0.0 109.996 -179.716 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 33.3 t -67.85 -34.98 77.74 Favored 'General case' 0 N--CA 1.454 -0.272 0 C-N-CA 120.778 -0.369 . . . . 0.0 111.378 -179.046 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 39.7 tp -77.79 -33.67 52.5 Favored 'General case' 0 N--CA 1.451 -0.395 0 O-C-N 121.652 -0.655 . . . . 0.0 112.407 -176.46 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . 0.426 HD12 HG12 ' A' ' 69' ' ' ILE . 4.2 pt -70.28 -43.08 78.83 Favored 'Isoleucine or valine' 0 C--N 1.34 0.173 0 CA-C-N 118.832 0.742 . . . . 0.0 110.378 177.55 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 51' ' ' ILE . . . . . 0.404 ' HA ' HD21 ' A' ' 108' ' ' LEU . 32.3 pt -63.12 -37.32 79.09 Favored 'Isoleucine or valine' 0 N--CA 1.461 0.101 0 C-N-CA 119.444 -0.903 . . . . 0.0 110.766 177.949 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 92.6 m-20 -68.51 -41.5 79.87 Favored 'General case' 0 N--CA 1.452 -0.346 0 O-C-N 121.937 -0.477 . . . . 0.0 111.571 178.409 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 53' ' ' TYR . . . . . 0.425 ' CE1' ' HG2' ' A' ' 18' ' ' LYS . 11.2 t80 -64.15 -42.75 96.66 Favored 'General case' 0 CA--C 1.523 -0.078 0 CA-C-N 118.891 0.769 . . . . 0.0 109.227 177.027 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 24.1 t -68.75 -24.72 64.48 Favored 'General case' 0 N--CA 1.453 -0.323 0 N-CA-C 112.105 0.409 . . . . 0.0 112.105 -176.665 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 73.4 mtm180 -86.18 -31.72 21.62 Favored 'General case' 0 N--CA 1.457 -0.094 0 CA-C-N 118.7 0.682 . . . . 0.0 111.823 179.946 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 47.4 mt -84.86 -43.6 13.98 Favored 'General case' 0 CA--C 1.528 0.118 0 N-CA-C 113.02 0.748 . . . . 0.0 113.02 -179.22 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 16.7 p -60.65 155.26 51.76 Favored Pre-proline 0 CA--C 1.538 0.493 0 N-CA-C 113.705 1.002 . . . . 0.0 113.705 -173.322 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 72.3 Cg_endo -75.67 -177.76 3.82 Favored 'Trans proline' 0 N--CA 1.457 -0.619 0 C-N-CA 124.848 3.698 . . . . 0.0 111.545 177.188 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -55.02 -50.91 67.87 Favored 'General case' 0 CA--C 1.53 0.201 0 N-CA-C 114.908 1.447 . . . . 0.0 114.908 -171.913 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 45.3 m -66.99 -39.34 87.12 Favored 'General case' 0 C--N 1.331 -0.199 0 O-C-N 121.743 -0.598 . . . . 0.0 109.964 -176.609 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 71.2 m80 -75.43 -17.47 60.16 Favored 'General case' 0 N--CA 1.45 -0.437 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.526 177.378 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . 0.4 ' HE2' ' HB2' ' A' ' 62' ' ' LYS . 10.9 tppt? -66.95 -45.08 78.88 Favored 'General case' 0 N--CA 1.457 -0.086 0 N-CA-C 109.065 -0.716 . . . . 0.0 109.065 174.081 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -63.91 -42.76 97.32 Favored 'General case' 0 N--CA 1.454 -0.267 0 N-CA-C 108.32 -0.993 . . . . 0.0 108.32 177.789 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -66.15 -33.84 86.47 Favored Glycine 0 CA--C 1.53 0.98 0 N-CA-C 111.95 -0.46 . . . . 0.0 111.95 178.331 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 63.2 m -64.74 -42.16 95.39 Favored 'General case' 0 N--CA 1.456 -0.141 0 CA-C-N 117.927 0.864 . . . . 0.0 110.342 177.601 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 80.0 mt -68.71 -27.23 65.76 Favored 'General case' 0 N--CA 1.455 -0.224 0 N-CA-C 110.277 -0.268 . . . . 0.0 110.277 179.421 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 1.0 OUTLIER -68.42 -38.73 81.48 Favored 'General case' 0 N--CA 1.455 -0.203 0 CA-C-N 117.736 0.244 . . . . 0.0 111.413 175.739 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 68' ' ' ILE . . . . . 0.435 HD11 ' CD1' ' A' ' 17' ' ' PHE . 14.7 mt -66.42 -53.64 34.09 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.445 0 N-CA-C 109.178 -0.675 . . . . 0.0 109.178 176.679 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 69' ' ' ILE . . . . . 0.426 HG12 HD12 ' A' ' 50' ' ' ILE . 81.3 mt -50.27 -37.11 13.79 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.19 0 C-N-CA 124.233 1.013 . . . . 0.0 111.678 174.413 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 12.8 t70 -69.05 -46.2 68.47 Favored 'General case' 0 N--CA 1.455 -0.195 0 CA-C-N 118.292 0.496 . . . . 0.0 111.109 179.915 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 30.7 t -64.06 -55.51 21.64 Favored 'General case' 0 N--CA 1.45 -0.464 0 CA-C-N 116.58 -0.282 . . . . 0.0 110.646 -175.968 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -74.36 -32.9 32.25 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.246 0 N-CA-C 110.192 -0.299 . . . . 0.0 110.192 -177.18 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -66.7 -55.26 18.14 Favored Glycine 0 C--N 1.34 0.777 0 N-CA-C 111.589 -0.604 . . . . 0.0 111.589 -174.555 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 33.9 mtm105 -68.7 -37.52 79.58 Favored 'General case' 0 N--CA 1.455 -0.182 0 C-N-CA 120.099 -0.64 . . . . 0.0 110.088 179.158 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -64.7 -29.95 70.96 Favored 'General case' 0 N--CA 1.452 -0.368 0 C-N-CA 120.1 -0.64 . . . . 0.0 110.624 -179.624 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 1.3 m-30 -69.73 -46.0 66.89 Favored 'General case' 0 N--CA 1.454 -0.274 0 CA-C-N 118.401 0.546 . . . . 0.0 110.494 175.832 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -65.01 -49.09 71.57 Favored 'General case' 0 N--CA 1.449 -0.475 0 C-N-CA 118.788 -1.165 . . . . 0.0 108.047 -179.634 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 89.2 m-20 -55.92 -44.34 78.21 Favored 'General case' 0 CA--C 1.53 0.176 0 N-CA-C 112.725 0.639 . . . . 0.0 112.725 -179.689 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 8.3 tm-20 -63.42 -51.85 64.02 Favored 'General case' 0 N--CA 1.45 -0.438 0 CA-C-N 118.548 0.613 . . . . 0.0 111.32 -178.808 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 80' ' ' THR . . . . . 0.557 HG21 ' HB3' ' A' ' 94' ' ' CYS . 59.2 p -65.47 -26.24 67.84 Favored 'General case' 0 N--CA 1.454 -0.237 0 CA-C-N 117.83 0.286 . . . . 0.0 110.567 -179.957 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 35.5 ttp180 -75.62 -20.07 58.79 Favored 'General case' 0 N--CA 1.448 -0.542 0 C-N-CA 123.937 0.895 . . . . 0.0 111.051 174.349 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 27.5 m . . . . . 0 CA--C 1.53 0.198 0 C-N-CA 122.924 0.49 . . . . 0.0 111.82 179.476 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 67.2 Cg_endo . . . . . 0 N--CA 1.453 -0.899 0 N-CA-C 109.193 -1.118 . . . . 0.0 109.193 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 85.55 16.25 64.43 Favored Glycine 0 CA--C 1.525 0.674 0 N-CA-C 110.788 -0.925 . . . . 0.0 110.788 -176.272 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -155.8 167.15 31.33 Favored 'General case' 0 N--CA 1.454 -0.255 0 C-N-CA 123.7 0.8 . . . . 0.0 109.333 -179.218 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 94' ' ' CYS . . . . . 0.557 ' HB3' HG21 ' A' ' 80' ' ' THR . 30.1 p -58.15 -20.01 37.32 Favored 'General case' 0 N--CA 1.453 -0.307 0 C-N-CA 122.703 0.401 . . . . 0.0 110.807 179.087 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -58.53 -60.47 3.74 Favored 'General case' 0 N--CA 1.447 -0.577 0 C-N-CA 122.34 0.256 . . . . 0.0 110.702 -176.514 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 75.3 t60 -74.01 -32.65 63.48 Favored 'General case' 0 N--CA 1.451 -0.407 0 C-N-CA 121.003 -0.279 . . . . 0.0 110.496 -179.86 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -64.46 -53.44 48.15 Favored 'General case' 0 N--CA 1.451 -0.402 0 C-N-CA 122.407 0.283 . . . . 0.0 111.124 -176.26 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 1.7 mp -72.42 -33.12 44.6 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.291 0 N-CA-C 110.056 -0.35 . . . . 0.0 110.056 -178.737 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 1.4 m120 -66.42 -41.25 89.49 Favored 'General case' 0 C--O 1.225 -0.199 0 CA-C-N 118.27 0.486 . . . . 0.0 111.1 177.976 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 96.7 m -73.5 -32.59 64.35 Favored 'General case' 0 N--CA 1.457 -0.122 0 CA-C-N 118.242 0.474 . . . . 0.0 110.894 -177.675 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 60.5 tp -73.2 -39.6 65.44 Favored 'General case' 0 N--CA 1.45 -0.463 0 N-CA-C 111.528 0.196 . . . . 0.0 111.528 -177.268 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -69.31 -16.9 71.74 Favored Glycine 0 CA--C 1.529 0.944 0 CA-C-O 119.713 -0.493 . . . . 0.0 114.031 -173.828 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 6.2 mm-40 -87.76 -32.08 19.31 Favored 'General case' 0 CA--C 1.52 -0.173 0 CA-C-N 118.322 1.061 . . . . 0.0 111.538 178.92 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 81.7 t -93.69 -20.68 6.23 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.09 0 C-N-CA 122.759 0.424 . . . . 0.0 112.119 -177.499 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 105' ' ' ILE . . . . . 0.403 HD12 ' HA ' ' A' ' 105' ' ' ILE . 10.7 tp -60.54 -22.5 25.9 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.224 0 O-C-N 121.571 -0.706 . . . . 0.0 112.099 -175.167 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 26.4 pt20 -67.77 -25.67 65.73 Favored 'General case' 0 CA--C 1.53 0.201 0 O-C-N 121.982 -0.448 . . . . 0.0 110.511 177.236 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 72.2 mt-10 -74.3 -43.04 58.43 Favored 'General case' 0 N--CA 1.454 -0.254 0 N-CA-C 109.474 -0.565 . . . . 0.0 109.474 176.816 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 108' ' ' LEU . . . . . 0.404 HD21 ' HA ' ' A' ' 51' ' ' ILE . 10.4 mp -67.4 -45.11 77.14 Favored 'General case' 0 N--CA 1.452 -0.364 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.239 -177.847 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 3.0 mp -65.94 -53.33 40.59 Favored 'General case' 0 N--CA 1.451 -0.379 0 CA-C-O 119.146 -0.454 . . . . 0.0 110.584 -178.219 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 15.4 m -54.39 -47.22 72.94 Favored 'General case' 0 C--O 1.233 0.198 0 CA-C-N 118.139 0.427 . . . . 0.0 110.501 -178.262 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 40.5 t0 -62.21 -43.37 98.98 Favored 'General case' 0 N--CA 1.452 -0.365 0 N-CA-C 109.309 -0.626 . . . . 0.0 109.309 178.117 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 112' ' ' ALA . . . . . 0.4 ' HA ' ' HG2' ' A' ' 62' ' ' LYS . . . -67.87 -36.89 81.05 Favored 'General case' 0 N--CA 1.447 -0.619 0 CA-C-O 119.135 -0.46 . . . . 0.0 111.438 -175.148 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 113' ' ' ILE . . . . . 0.456 ' O ' ' HE2' ' A' ' 121' ' ' LYS . 19.9 mm -68.79 -40.85 81.94 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.426 0 C-N-CA 118.805 -1.158 . . . . 0.0 110.1 -179.434 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -75.56 -39.09 58.7 Favored 'General case' 0 N--CA 1.454 -0.237 0 N-CA-C 112.837 0.68 . . . . 0.0 112.837 179.836 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 115' ' ' LYS . . . . . 0.61 ' HE2' ' HA ' ' A' ' 115' ' ' LYS . 0.6 OUTLIER -78.85 -38.41 38.0 Favored 'General case' 0 N--CA 1.456 -0.165 0 N-CA-C 113.342 0.867 . . . . 0.0 113.342 -177.711 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 116' ' ' SER . . . . . 0.453 ' HB2' ' CB ' ' A' ' 120' ' ' HIS . 52.6 p -74.56 157.23 35.82 Favored 'General case' 0 CA--C 1.529 0.146 0 CA-C-N 117.918 0.326 . . . . 0.0 111.744 -172.628 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 56.5 t30 -79.57 166.21 22.15 Favored 'General case' 0 CA--C 1.531 0.23 0 C-N-CA 122.877 0.471 . . . . 0.0 110.61 -178.997 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 118' ' ' GLN . . . . . . . . . . . . . 3.4 pt20 -49.1 -46.27 44.51 Favored 'General case' 0 CA--C 1.532 0.25 0 N-CA-C 112.823 0.675 . . . . 0.0 112.823 -174.34 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 6.8 p30 -65.42 -35.85 82.18 Favored 'General case' 0 N--CA 1.456 -0.149 0 C-N-CA 123.059 0.544 . . . . 0.0 111.358 179.122 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 120' ' ' HIS . . . . . 0.453 ' CB ' ' HB2' ' A' ' 116' ' ' SER . 32.3 m170 -68.12 -43.91 77.3 Favored 'General case' 0 N--CA 1.448 -0.544 0 N-CA-C 110.145 -0.317 . . . . 0.0 110.145 176.666 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 121' ' ' LYS . . . . . 0.456 ' HE2' ' O ' ' A' ' 113' ' ' ILE . 76.0 mttt -57.0 -38.99 73.85 Favored 'General case' 0 C--N 1.342 0.254 0 N-CA-C 109.514 -0.55 . . . . 0.0 109.514 179.896 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 2.8 tm-20 -65.43 -47.61 75.61 Favored 'General case' 0 N--CA 1.456 -0.172 0 C-N-CA 122.402 0.281 . . . . 0.0 110.614 178.905 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 62.4 mttp -65.95 -28.92 69.27 Favored 'General case' 0 N--CA 1.454 -0.233 0 CA-C-O 119.836 -0.126 . . . . 0.0 111.075 -179.558 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 124' ' ' ILE . . . . . . . . . . . . . 59.2 mt -70.73 -42.97 77.7 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.297 0 N-CA-C 109.436 -0.579 . . . . 0.0 109.436 176.071 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 125' ' ' ARG . . . . . 0.468 ' HA ' HH11 ' A' ' 125' ' ' ARG . 7.3 mmm180 -59.27 -46.39 88.67 Favored 'General case' 0 N--CA 1.451 -0.383 0 CA-C-O 118.982 -0.532 . . . . 0.0 111.236 -179.503 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 126' ' ' MET . . . . . . . . . . . . . 27.6 ptm -65.47 -33.47 76.0 Favored 'General case' 0 N--CA 1.451 -0.401 0 C-N-CA 119.278 -0.969 . . . . 0.0 109.66 178.814 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 18.7 tp -69.61 -31.72 70.01 Favored 'General case' 0 CA--C 1.533 0.307 0 CA-C-N 118.025 0.375 . . . . 0.0 111.617 179.654 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 92.9 mt -75.76 -38.06 58.73 Favored 'General case' 0 N--CA 1.456 -0.167 0 O-C-N 121.909 -0.494 . . . . 0.0 110.531 177.378 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 54.7 m-20 -60.29 -38.23 82.97 Favored 'General case' 0 N--CA 1.454 -0.226 0 N-CA-C 109.117 -0.698 . . . . 0.0 109.117 176.031 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 36.5 mt -63.15 -40.7 90.02 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.359 0 C-N-CA 124.32 1.048 . . . . 0.0 110.816 176.08 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 131' ' ' TRP . . . . . . . . . . . . . 48.7 m0 . . . . . 0 N--CA 1.452 -0.349 0 C-N-CA 120.009 -0.677 . . . . 0.0 111.178 176.949 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 29.7 p-10 . . . . . 0 N--CA 1.451 -0.389 0 N-CA-C 107.786 -1.19 . . . . 0.0 107.786 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 7' ' ' PHE . . . . . 0.511 ' CD1' ' HD3' ' A' ' 45' ' ' LYS . 1.3 t80 -59.14 -33.99 71.54 Favored 'General case' 0 N--CA 1.446 -0.67 0 C-N-CA 125.416 1.487 . . . . 0.0 109.981 -179.978 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 51.2 tp60 -49.76 -37.24 28.84 Favored 'General case' 0 N--CA 1.451 -0.395 0 C-N-CA 124.347 1.059 . . . . 0.0 111.609 -179.006 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 25.5 m-80 -73.94 -33.27 63.86 Favored 'General case' 0 N--CA 1.452 -0.356 0 O-C-N 122.202 -0.311 . . . . 0.0 110.397 -179.478 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 10' ' ' PHE . . . . . 0.417 ' CE2' ' HB2' ' A' ' 32' ' ' LEU . 6.5 t80 -71.23 -40.36 71.12 Favored 'General case' 0 N--CA 1.449 -0.515 0 C-N-CA 123.311 0.645 . . . . 0.0 109.499 177.511 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 89.1 t -63.6 -53.46 44.71 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.417 0 N-CA-C 108.407 -0.96 . . . . 0.0 108.407 179.071 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -59.54 -29.34 67.83 Favored 'General case' 0 N--CA 1.455 -0.221 0 C-N-CA 122.748 0.419 . . . . 0.0 111.774 -179.659 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 92.3 m -71.73 -37.12 70.64 Favored 'General case' 0 CA--C 1.531 0.216 0 N-CA-C 108.901 -0.777 . . . . 0.0 108.901 176.206 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.466 HD21 ' HB2' ' A' ' 53' ' ' TYR . 5.6 tp -69.03 -41.05 78.22 Favored 'General case' 0 N--CA 1.452 -0.352 0 CA-C-O 120.981 0.42 . . . . 0.0 110.379 178.751 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 64.1 mm-40 -64.88 -30.98 72.0 Favored 'General case' 0 N--CA 1.45 -0.447 0 N-CA-C 108.378 -0.971 . . . . 0.0 108.378 176.668 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 23.1 t -73.48 -20.45 60.68 Favored 'General case' 0 N--CA 1.453 -0.288 0 CA-C-N 115.844 -0.616 . . . . 0.0 109.894 178.375 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 17' ' ' PHE . . . . . 0.453 ' CD1' ' HA ' ' A' ' 14' ' ' LEU . 22.9 m-85 -75.43 -35.66 60.92 Favored 'General case' 0 N--CA 1.455 -0.188 0 C-N-CA 120.181 -0.607 . . . . 0.0 110.512 168.62 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 68.2 mttt -62.0 -28.79 69.82 Favored 'General case' 0 C--N 1.339 0.127 0 CA-C-N 118.37 0.532 . . . . 0.0 109.776 179.066 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 19.7 t0 -64.31 -20.89 66.38 Favored 'General case' 0 CA--C 1.533 0.323 0 CA-C-N 115.706 -0.679 . . . . 0.0 111.885 176.86 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 43.3 mt -70.79 155.17 41.12 Favored 'General case' 0 N--CA 1.457 -0.082 0 O-C-N 121.476 -0.765 . . . . 0.0 111.885 -175.192 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 1.4 mppt? -100.99 -3.72 28.88 Favored 'General case' 0 CA--C 1.528 0.116 0 N-CA-C 109.06 -0.719 . . . . 0.0 109.06 173.168 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 82.9 p -121.83 -20.4 6.42 Favored 'General case' 0 CA--C 1.528 0.096 0 C-N-CA 124.507 1.123 . . . . 0.0 111.091 -178.924 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 82.7 -16.8 24.04 Favored Glycine 0 CA--C 1.53 0.995 0 C-N-CA 124.153 0.882 . . . . 0.0 113.499 176.213 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 81.5 mt -101.43 148.5 7.24 Favored 'Isoleucine or valine' 0 CA--C 1.528 0.113 0 CA-C-N 118.452 1.126 . . . . 0.0 110.73 -179.671 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 41.9 t -162.54 85.59 0.56 Allowed 'General case' 0 CA--C 1.519 -0.23 0 N-CA-C 110.04 -0.356 . . . . 0.0 110.04 178.82 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . 0.428 ' O ' ' HE2' ' A' ' 30' ' ' LYS . . . -51.15 -39.72 42.68 Favored Glycine 0 CA--C 1.523 0.551 0 CA-C-O 119.168 -0.795 . . . . 0.0 112.236 -175.635 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 91.4 p -66.0 -48.03 72.54 Favored 'General case' 0 N--CA 1.454 -0.243 0 CA-C-N 118.999 1.399 . . . . 0.0 110.952 -176.807 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 54.5 mtm180 -73.15 -34.57 66.14 Favored 'General case' 0 CA--C 1.527 0.09 0 CA-C-N 118.014 0.37 . . . . 0.0 110.57 -179.351 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 65.1 mt -59.05 -48.45 86.67 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.487 0 N-CA-C 109.057 -0.72 . . . . 0.0 109.057 173.584 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . 0.428 ' HE2' ' O ' ' A' ' 26' ' ' GLY . 49.2 mtmt -68.75 -23.18 64.3 Favored 'General case' 0 N--CA 1.456 -0.173 0 CA-C-O 119.012 -0.518 . . . . 0.0 111.505 -179.564 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . 0.445 ' HA ' ' HE2' ' A' ' 31' ' ' LYS . 4.1 mmpt? -66.35 -57.14 8.1 Favored 'General case' 0 C--N 1.341 0.213 0 CA-C-N 118.693 0.679 . . . . 0.0 110.443 176.255 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.489 HD12 ' N ' ' A' ' 33' ' ' THR . 2.3 pp -75.43 -18.85 59.79 Favored 'General case' 0 CA--C 1.531 0.247 0 C-N-CA 119.615 -0.834 . . . . 0.0 111.505 -178.105 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . 0.489 ' N ' HD12 ' A' ' 32' ' ' LEU . 60.1 m -72.88 -38.42 66.99 Favored 'General case' 0 N--CA 1.455 -0.222 0 N-CA-C 109.077 -0.712 . . . . 0.0 109.077 175.678 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 57.9 m -69.08 -35.59 76.67 Favored 'General case' 0 N--CA 1.453 -0.312 0 N-CA-C 110.001 -0.37 . . . . 0.0 110.001 179.918 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 9.1 t80 -62.17 -39.51 92.91 Favored 'General case' 0 C--O 1.231 0.122 0 N-CA-C 109.626 -0.509 . . . . 0.0 109.626 174.446 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -71.61 -36.79 70.92 Favored 'General case' 0 N--CA 1.448 -0.526 0 CA-C-O 119.564 -0.255 . . . . 0.0 111.685 -179.644 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -70.0 -34.07 72.85 Favored 'General case' 0 N--CA 1.456 -0.168 0 CA-C-N 117.915 0.325 . . . . 0.0 111.045 -179.825 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 43.9 t0 -68.91 -23.93 64.24 Favored 'General case' 0 CA--C 1.533 0.325 0 C-N-CA 122.132 0.173 . . . . 0.0 110.633 176.934 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 39' ' ' HIS . . . . . 0.41 ' HB2' HD11 ' A' ' 42' ' ' ILE . 97.8 m-70 -151.93 104.6 3.01 Favored 'General case' 0 N--CA 1.456 -0.167 0 N-CA-C 112.199 0.444 . . . . 0.0 112.199 -174.517 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 40' ' ' ILE . . . . . 0.581 ' H ' HD13 ' A' ' 40' ' ' ILE . 0.0 OUTLIER -79.0 -12.03 13.25 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.302 0 C-N-CA 122.736 0.414 . . . . 0.0 110.149 174.165 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 16.0 m-20 -59.44 -11.73 4.95 Favored 'General case' 0 CA--C 1.53 0.176 0 C-N-CA 123.418 0.687 . . . . 0.0 112.787 -176.794 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . 0.41 HD11 ' HB2' ' A' ' 39' ' ' HIS . 0.0 OUTLIER -119.46 18.06 6.58 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.198 0 C-N-CA 124.068 0.947 . . . . 0.0 111.667 177.799 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 3.0 pp20? -53.88 -28.91 39.19 Favored 'General case' 0 CA--C 1.53 0.193 0 O-C-N 121.379 -0.825 . . . . 0.0 111.296 178.092 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 47.1 t -65.21 -44.24 88.94 Favored 'General case' 0 CA--C 1.533 0.289 0 N-CA-C 111.899 0.333 . . . . 0.0 111.899 -177.878 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . 0.511 ' HD3' ' CD1' ' A' ' 7' ' ' PHE . 15.0 ptpt -74.87 -25.67 59.13 Favored 'General case' 0 CA--C 1.53 0.185 0 CA-C-N 118.385 0.539 . . . . 0.0 109.816 179.012 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 67.2 mt -72.72 -51.68 26.61 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.251 0 C-N-CA 123.076 0.55 . . . . 0.0 110.314 -177.476 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 38.8 mm -67.11 -39.95 84.27 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.112 0 N-CA-C 110.119 -0.326 . . . . 0.0 110.119 -179.768 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 48.0 t -66.72 -33.59 75.98 Favored 'General case' 0 N--CA 1.453 -0.313 0 C-N-CA 120.745 -0.382 . . . . 0.0 111.201 -178.841 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . 0.41 ' HG ' HD22 ' A' ' 14' ' ' LEU . 44.4 tp -78.68 -37.55 41.5 Favored 'General case' 0 N--CA 1.451 -0.397 0 N-CA-C 112.749 0.648 . . . . 0.0 112.749 -177.474 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . 0.487 HD12 HG12 ' A' ' 69' ' ' ILE . 3.6 pt -67.4 -44.01 87.3 Favored 'Isoleucine or valine' 0 C--N 1.34 0.162 0 CA-C-N 118.924 0.784 . . . . 0.0 110.172 178.933 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 16.9 pt -65.48 -38.05 81.53 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.203 0 C-N-CA 119.858 -0.737 . . . . 0.0 111.477 178.758 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 47.6 t0 -60.86 -53.63 54.95 Favored 'General case' 0 CA--C 1.528 0.104 0 CA-C-N 118.484 0.584 . . . . 0.0 110.21 177.469 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 53' ' ' TYR . . . . . 0.466 ' HB2' HD21 ' A' ' 14' ' ' LEU . 3.5 t80 -61.16 -32.49 72.22 Favored 'General case' 0 C--O 1.225 -0.21 0 CA-C-O 118.813 -0.613 . . . . 0.0 109.839 179.173 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 17.2 p -63.46 -35.99 82.26 Favored 'General case' 0 N--CA 1.456 -0.16 0 CA-C-N 118.693 0.679 . . . . 0.0 110.859 -179.89 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 1.9 tpp180 -79.49 -39.69 31.52 Favored 'General case' 0 N--CA 1.455 -0.195 0 C-N-CA 122.146 0.178 . . . . 0.0 111.181 -177.57 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 79.6 mt -77.75 -45.28 25.11 Favored 'General case' 0 N--CA 1.455 -0.215 0 C-N-CA 123.764 0.825 . . . . 0.0 113.196 -176.468 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 13.6 p -64.38 159.64 57.3 Favored Pre-proline 0 CA--C 1.533 0.3 0 N-CA-C 113.882 1.067 . . . . 0.0 113.882 -171.628 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 33.4 Cg_exo -58.03 175.65 0.45 Allowed 'Trans proline' 0 N--CA 1.454 -0.796 0 C-N-CA 125.012 3.808 . . . . 0.0 112.827 173.884 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 35.8 p-10 -63.6 -42.19 98.28 Favored 'General case' 0 CA--C 1.53 0.189 0 C-N-CA 123.916 0.886 . . . . 0.0 112.171 -174.945 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 20.0 m -72.57 -35.48 67.97 Favored 'General case' 0 N--CA 1.452 -0.362 0 C-N-CA 122.702 0.401 . . . . 0.0 110.015 -178.203 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 51.3 m80 -75.17 -23.72 57.78 Favored 'General case' 0 N--CA 1.452 -0.337 0 C-N-CA 122.814 0.446 . . . . 0.0 110.252 177.817 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 22.3 ttmm -71.94 -35.41 69.61 Favored 'General case' 0 N--CA 1.455 -0.184 0 N-CA-C 109.327 -0.619 . . . . 0.0 109.327 174.527 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -62.76 -44.29 96.58 Favored 'General case' 0 CA--C 1.532 0.269 0 N-CA-C 107.155 -1.424 . . . . 0.0 107.155 172.078 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -65.59 -29.69 75.73 Favored Glycine 0 CA--C 1.526 0.736 0 N-CA-C 111.474 -0.65 . . . . 0.0 111.474 179.99 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 35.3 t -65.56 -41.52 92.86 Favored 'General case' 0 N--CA 1.452 -0.351 0 CA-C-N 117.469 0.635 . . . . 0.0 109.449 176.814 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 81.4 mt -67.74 -27.44 66.79 Favored 'General case' 0 N--CA 1.453 -0.276 0 N-CA-C 110.473 -0.195 . . . . 0.0 110.473 178.157 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 67' ' ' TYR . . . . . 0.414 ' CD2' HD11 ' A' ' 127' ' ' LEU . 2.4 m-85 -70.09 -37.99 75.58 Favored 'General case' 0 C--N 1.34 0.153 0 CA-C-N 117.983 0.356 . . . . 0.0 110.731 174.873 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 68' ' ' ILE . . . . . 0.446 HD11 ' CE1' ' A' ' 17' ' ' PHE . 13.9 mt -69.95 -54.2 20.19 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.451 0 N-CA-C 109.259 -0.645 . . . . 0.0 109.259 178.297 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 69' ' ' ILE . . . . . 0.487 HG12 HD12 ' A' ' 50' ' ' ILE . 68.5 mt -48.11 -37.39 6.9 Favored 'Isoleucine or valine' 0 C--N 1.34 0.154 0 C-N-CA 124.141 0.976 . . . . 0.0 111.478 173.834 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 23.9 t70 -69.18 -43.89 73.31 Favored 'General case' 0 CA--C 1.52 -0.196 0 CA-C-N 118.912 0.778 . . . . 0.0 110.909 179.386 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 25.3 m -66.96 -56.01 12.05 Favored 'General case' 0 N--CA 1.449 -0.523 0 O-C-N 123.416 0.448 . . . . 0.0 110.024 -174.506 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -74.68 -32.97 30.26 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.386 0 N-CA-C 109.948 -0.39 . . . . 0.0 109.948 -176.944 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -65.57 -58.46 9.26 Favored Glycine 0 C--N 1.339 0.71 0 N-CA-C 111.388 -0.685 . . . . 0.0 111.388 -175.412 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 46.4 mtm105 -69.26 -36.41 77.1 Favored 'General case' 0 N--CA 1.456 -0.166 0 CA-C-N 117.455 0.628 . . . . 0.0 110.542 -178.972 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -64.23 -29.38 70.48 Favored 'General case' 0 N--CA 1.45 -0.433 0 C-N-CA 119.645 -0.822 . . . . 0.0 110.707 179.658 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 1.6 m-30 -71.27 -45.98 61.94 Favored 'General case' 0 C--N 1.342 0.244 0 CA-C-N 118.594 0.634 . . . . 0.0 110.637 175.399 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -64.58 -45.11 88.39 Favored 'General case' 0 N--CA 1.45 -0.452 0 N-CA-C 108.027 -1.101 . . . . 0.0 108.027 -178.123 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 92.2 m-20 -55.92 -46.85 78.34 Favored 'General case' 0 C--O 1.231 0.082 0 N-CA-C 113.463 0.912 . . . . 0.0 113.463 173.927 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 12.4 tm-20 -64.13 -47.44 79.92 Favored 'General case' 0 N--CA 1.449 -0.48 0 CA-C-N 118.604 0.638 . . . . 0.0 111.054 -178.341 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 80' ' ' THR . . . . . 0.563 HG21 ' HB3' ' A' ' 94' ' ' CYS . 75.7 p -69.34 -27.23 65.17 Favored 'General case' 0 N--CA 1.453 -0.304 0 CA-C-O 119.692 -0.194 . . . . 0.0 110.685 -179.409 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 36.4 ttp-105 -70.34 -27.69 64.56 Favored 'General case' 0 N--CA 1.451 -0.395 0 CA-C-N 118.096 0.407 . . . . 0.0 110.189 172.618 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 32.2 m . . . . . 0 N--CA 1.453 -0.276 0 N-CA-C 113.025 0.75 . . . . 0.0 113.025 -176.417 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 56.3 Cg_endo . . . . . 0 N--CA 1.45 -1.047 0 N-CA-C 108.467 -1.397 . . . . 0.0 108.467 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 90.23 17.06 54.49 Favored Glycine 0 CA--C 1.524 0.628 0 CA-C-O 119.417 -0.657 . . . . 0.0 112.277 -177.289 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 38.5 p -151.61 172.5 15.95 Favored 'General case' 0 C--N 1.341 0.201 0 CA-C-N 117.946 0.873 . . . . 0.0 110.203 176.739 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 94' ' ' CYS . . . . . 0.563 ' HB3' HG21 ' A' ' 80' ' ' THR . 26.2 p -59.98 -20.99 60.61 Favored 'General case' 0 N--CA 1.449 -0.493 0 CA-C-N 115.621 -0.718 . . . . 0.0 109.936 175.682 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -60.29 -55.26 35.84 Favored 'General case' 0 N--CA 1.448 -0.53 0 N-CA-C 109.398 -0.593 . . . . 0.0 109.398 -177.261 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 69.3 t60 -75.46 -34.74 60.95 Favored 'General case' 0 N--CA 1.448 -0.546 0 CA-C-N 116.736 -0.211 . . . . 0.0 110.906 179.68 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -66.18 -49.41 67.45 Favored 'General case' 0 N--CA 1.451 -0.413 0 O-C-N 123.09 0.244 . . . . 0.0 111.126 -176.17 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 98' ' ' ILE . . . . . 0.434 HD13 ' HB2' ' A' ' 94' ' ' CYS . 1.7 mp -72.79 -34.62 47.4 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.251 0 CA-C-O 119.234 -0.413 . . . . 0.0 109.986 179.699 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 1.4 m120 -66.14 -40.23 90.47 Favored 'General case' 0 N--CA 1.453 -0.289 0 CA-C-N 118.612 0.642 . . . . 0.0 111.293 178.715 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 92.6 m -75.19 -34.85 61.56 Favored 'General case' 0 N--CA 1.454 -0.256 0 CA-C-N 118.008 0.367 . . . . 0.0 110.838 -178.471 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 58.8 tp -75.65 -38.77 58.58 Favored 'General case' 0 N--CA 1.451 -0.417 0 C-N-CA 122.886 0.474 . . . . 0.0 111.013 -178.589 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -67.18 -23.58 73.15 Favored Glycine 0 CA--C 1.528 0.856 0 CA-C-O 119.542 -0.588 . . . . 0.0 113.441 -173.479 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 16.3 mm-40 -74.63 -35.77 62.91 Favored 'General case' 0 CA--C 1.52 -0.188 0 CA-C-N 118.158 0.979 . . . . 0.0 111.179 179.41 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 25.9 m -101.77 -13.43 8.41 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.138 0 N-CA-C 113.379 0.881 . . . . 0.0 113.379 -176.114 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 105' ' ' ILE . . . . . . . . . . . . . 11.0 tp -61.84 -27.24 41.89 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.161 0 CA-C-N 119.18 0.9 . . . . 0.0 111.564 -175.282 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 19.8 pt20 -67.0 -29.86 69.8 Favored 'General case' 0 N--CA 1.453 -0.277 0 N-CA-C 109.994 -0.373 . . . . 0.0 109.994 176.704 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 86.1 mt-10 -75.75 -41.31 53.63 Favored 'General case' 0 N--CA 1.454 -0.265 0 N-CA-C 109.918 -0.401 . . . . 0.0 109.918 175.806 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 9.9 mp -64.66 -41.97 95.72 Favored 'General case' 0 C--N 1.34 0.164 0 N-CA-C 110.361 -0.237 . . . . 0.0 110.361 -178.472 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 72.3 mt -66.85 -50.78 61.44 Favored 'General case' 0 N--CA 1.453 -0.284 0 N-CA-C 109.833 -0.432 . . . . 0.0 109.833 178.952 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 16.8 m -59.51 -45.79 90.71 Favored 'General case' 0 C--O 1.232 0.155 0 CA-C-N 117.724 0.238 . . . . 0.0 111.022 -178.744 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 44.7 t0 -62.83 -38.44 90.77 Favored 'General case' 0 N--CA 1.454 -0.234 0 N-CA-C 108.932 -0.766 . . . . 0.0 108.932 179.258 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -68.03 -31.65 71.47 Favored 'General case' 0 N--CA 1.446 -0.645 0 CA-C-O 119.352 -0.356 . . . . 0.0 111.611 -176.531 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 113' ' ' ILE . . . . . . . . . . . . . 31.2 mm -70.38 -44.1 77.68 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.269 0 C-N-CA 118.856 -1.137 . . . . 0.0 109.362 178.011 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -72.91 -33.92 66.29 Favored 'General case' 0 N--CA 1.452 -0.334 0 N-CA-C 113.033 0.753 . . . . 0.0 113.033 -178.483 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -79.45 -37.01 37.94 Favored 'General case' 0 C--N 1.34 0.174 0 CA-C-N 118.293 0.497 . . . . 0.0 111.805 -179.186 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 116' ' ' SER . . . . . 0.496 ' HB2' ' CB ' ' A' ' 120' ' ' HIS . 21.0 p -85.45 164.6 17.78 Favored 'General case' 0 N--CA 1.449 -0.488 0 CA-C-O 120.93 0.395 . . . . 0.0 112.019 -171.431 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 20.4 m-80 -78.43 -100.19 0.02 OUTLIER 'General case' 0 N--CA 1.455 -0.204 0 N-CA-C 113.557 0.947 . . . . 0.0 113.557 -171.095 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 118' ' ' GLN . . . . . 0.482 ' HA ' ' HE2' ' A' ' 121' ' ' LYS . 14.8 mm100 -136.84 -49.84 0.64 Allowed 'General case' 0 CA--C 1.52 -0.174 0 CA-C-O 120.862 0.363 . . . . 0.0 110.355 -179.005 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 119' ' ' ASP . . . . . 0.407 ' N ' ' OD1' ' A' ' 119' ' ' ASP . 10.3 p-10 -62.9 -39.17 93.72 Favored 'General case' 0 N--CA 1.453 -0.3 0 N-CA-C 108.471 -0.937 . . . . 0.0 108.471 175.206 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 120' ' ' HIS . . . . . 0.496 ' CB ' ' HB2' ' A' ' 116' ' ' SER . 39.9 m170 -66.04 -40.91 91.36 Favored 'General case' 0 N--CA 1.45 -0.457 0 CA-C-N 115.687 -0.688 . . . . 0.0 110.881 176.477 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 121' ' ' LYS . . . . . 0.482 ' HE2' ' HA ' ' A' ' 118' ' ' GLN . 38.2 mtmt -63.67 -34.85 78.77 Favored 'General case' 0 N--CA 1.455 -0.213 0 N-CA-C 109.795 -0.446 . . . . 0.0 109.795 179.443 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 4.8 tm-20 -64.41 -48.66 74.55 Favored 'General case' 0 N--CA 1.456 -0.131 0 CA-C-N 117.705 0.23 . . . . 0.0 110.418 178.239 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 69.7 mmtt -59.8 -30.82 69.16 Favored 'General case' 0 N--CA 1.455 -0.214 0 CA-C-N 116.786 -0.188 . . . . 0.0 111.459 179.222 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 124' ' ' ILE . . . . . . . . . . . . . 51.3 mt -74.75 -34.34 33.7 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.293 0 O-C-N 121.882 -0.511 . . . . 0.0 110.183 178.681 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 24.1 mmt180 -68.46 -35.83 78.12 Favored 'General case' 0 N--CA 1.455 -0.189 0 CA-C-O 119.361 -0.352 . . . . 0.0 111.244 178.394 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 126' ' ' MET . . . . . . . . . . . . . 27.8 ptm -71.91 -33.48 68.32 Favored 'General case' 0 C--N 1.34 0.154 0 C-N-CA 119.333 -0.947 . . . . 0.0 109.514 177.659 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 127' ' ' LEU . . . . . 0.414 HD11 ' CD2' ' A' ' 67' ' ' TYR . 65.2 mt -70.7 -25.7 63.08 Favored 'General case' 0 C--N 1.341 0.2 0 CA-C-N 118.109 0.413 . . . . 0.0 110.167 175.882 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 55.3 tp -68.99 -42.97 75.82 Favored 'General case' 0 N--CA 1.452 -0.327 0 N-CA-C 109.793 -0.447 . . . . 0.0 109.793 177.875 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 12.9 t70 -61.46 -46.2 91.04 Favored 'General case' 0 N--CA 1.456 -0.133 0 N-CA-C 109.576 -0.528 . . . . 0.0 109.576 175.641 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 72.9 mt -59.86 -40.42 82.7 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.392 0 CA-C-N 116.362 -0.381 . . . . 0.0 110.991 -177.42 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 131' ' ' TRP . . . . . . . . . . . . . 46.1 m0 . . . . . 0 N--CA 1.453 -0.306 0 N-CA-C 112.754 0.65 . . . . 0.0 112.754 178.535 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 24.1 p-10 . . . . . 0 N--CA 1.451 -0.385 0 N-CA-C 106.98 -1.489 . . . . 0.0 106.98 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 7' ' ' PHE . . . . . 0.471 ' CD1' ' HD3' ' A' ' 45' ' ' LYS . 1.2 t80 -56.51 -34.37 66.92 Favored 'General case' 0 N--CA 1.449 -0.509 0 C-N-CA 125.144 1.378 . . . . 0.0 109.248 176.49 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 51.7 tp60 -49.77 -37.49 30.04 Favored 'General case' 0 N--CA 1.453 -0.308 0 C-N-CA 124.452 1.101 . . . . 0.0 111.861 -178.606 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 23.9 m-80 -73.02 -34.54 66.43 Favored 'General case' 0 N--CA 1.454 -0.232 0 CA-C-O 120.871 0.367 . . . . 0.0 110.23 -179.487 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 10' ' ' PHE . . . . . 0.458 ' CD2' ' HB2' ' A' ' 32' ' ' LEU . 9.1 t80 -70.05 -39.18 75.87 Favored 'General case' 0 N--CA 1.449 -0.498 0 C-N-CA 123.442 0.697 . . . . 0.0 109.454 176.777 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 98.7 t -64.56 -51.44 67.65 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.299 0 N-CA-C 108.757 -0.831 . . . . 0.0 108.757 178.978 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -59.21 -31.41 69.01 Favored 'General case' 0 N--CA 1.455 -0.175 0 CA-C-N 117.639 0.2 . . . . 0.0 111.529 179.737 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 46.8 m -71.17 -41.51 70.25 Favored 'General case' 0 N--CA 1.457 -0.111 0 N-CA-C 109.075 -0.713 . . . . 0.0 109.075 176.56 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -62.47 -41.61 98.9 Favored 'General case' 0 N--CA 1.451 -0.421 0 N-CA-C 109.482 -0.562 . . . . 0.0 109.482 177.929 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 61.4 mm-40 -66.38 -27.81 68.16 Favored 'General case' 0 N--CA 1.453 -0.314 0 C-N-CA 123.491 0.716 . . . . 0.0 110.137 179.312 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 16.0 p -70.9 -30.65 67.05 Favored 'General case' 0 N--CA 1.455 -0.19 0 N-CA-C 110.08 -0.341 . . . . 0.0 110.08 177.068 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 17' ' ' PHE . . . . . 0.48 ' CD1' HD11 ' A' ' 68' ' ' ILE . 24.4 m-85 -71.45 -32.03 67.86 Favored 'General case' 0 N--CA 1.457 -0.123 0 C-N-CA 120.675 -0.41 . . . . 0.0 110.764 173.672 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 76.4 mttt -67.21 -28.1 67.79 Favored 'General case' 0 C--O 1.232 0.171 0 CA-C-O 121.276 0.56 . . . . 0.0 109.939 172.1 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 41.0 t0 -76.09 -38.97 56.33 Favored 'General case' 0 CA--C 1.531 0.217 0 CA-C-N 115.861 -0.609 . . . . 0.0 110.676 -179.252 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 74.5 mt -74.89 128.74 36.29 Favored 'General case' 0 N--CA 1.454 -0.245 0 N-CA-C 109.187 -0.671 . . . . 0.0 109.187 175.05 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . 0.529 ' HA ' ' HE3' ' A' ' 21' ' ' LYS . 0.4 OUTLIER -73.8 -12.48 60.71 Favored 'General case' 0 CA--C 1.53 0.177 0 O-C-N 121.857 -0.527 . . . . 0.0 110.485 176.946 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 80.7 p -88.04 -23.88 23.64 Favored 'General case' 0 N--CA 1.457 -0.105 0 C-N-CA 123.176 0.59 . . . . 0.0 110.388 174.395 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 70.63 -12.31 2.04 Favored Glycine 0 CA--C 1.531 1.051 0 C-N-CA 124.698 1.142 . . . . 0.0 113.582 177.763 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 74.4 mt -106.22 148.91 10.1 Favored 'Isoleucine or valine' 0 C--N 1.334 -0.092 0 CA-C-N 118.073 0.936 . . . . 0.0 110.858 -179.47 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 31.2 t -166.91 100.48 0.55 Allowed 'General case' 0 CA--C 1.519 -0.24 0 N-CA-C 108.755 -0.831 . . . . 0.0 108.755 174.979 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -50.38 -41.44 40.44 Favored Glycine 0 CA--C 1.523 0.586 0 CA-C-O 119.375 -0.681 . . . . 0.0 111.431 -176.85 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 29.5 t -62.89 -52.17 64.13 Favored 'General case' 0 N--CA 1.454 -0.268 0 CA-C-N 118.484 1.142 . . . . 0.0 110.895 -178.084 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 72.3 mtt180 -70.8 -35.65 72.62 Favored 'General case' 0 CA--C 1.522 -0.122 0 C-N-CA 122.82 0.448 . . . . 0.0 110.499 -176.719 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 61.3 mt -58.09 -46.73 88.13 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.575 0 N-CA-C 108.114 -1.069 . . . . 0.0 108.114 174.719 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 63.9 mttt -65.6 -28.12 68.9 Favored 'General case' 0 C--N 1.341 0.211 0 CA-C-O 118.692 -0.671 . . . . 0.0 111.858 178.433 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.3 -57.33 10.74 Favored 'General case' 0 C--N 1.342 0.264 0 CA-C-N 118.935 0.789 . . . . 0.0 109.783 179.694 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.546 HD12 ' N ' ' A' ' 33' ' ' THR . 1.6 pp -75.63 -19.09 59.44 Favored 'General case' 0 N--CA 1.453 -0.279 0 C-N-CA 119.427 -0.909 . . . . 0.0 111.911 -177.356 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . 0.546 ' N ' HD12 ' A' ' 32' ' ' LEU . 52.2 m -72.46 -36.44 68.5 Favored 'General case' 0 N--CA 1.454 -0.24 0 N-CA-C 108.455 -0.942 . . . . 0.0 108.455 176.925 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 96.0 m -72.5 -36.41 68.38 Favored 'General case' 0 N--CA 1.451 -0.387 0 CA-C-N 116.613 -0.267 . . . . 0.0 110.432 -179.942 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 12.2 t80 -61.21 -40.2 93.08 Favored 'General case' 0 N--CA 1.456 -0.16 0 N-CA-C 109.608 -0.516 . . . . 0.0 109.608 174.779 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -70.1 -34.67 73.41 Favored 'General case' 0 N--CA 1.448 -0.555 0 CA-C-N 116.072 -0.513 . . . . 0.0 111.135 -179.475 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 22.1 mt -71.1 -39.97 71.8 Favored 'General case' 0 N--CA 1.453 -0.313 0 C-N-CA 122.315 0.246 . . . . 0.0 111.22 179.776 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 44.4 t0 -64.69 -24.46 67.58 Favored 'General case' 0 N--CA 1.453 -0.285 0 C-N-CA 122.447 0.299 . . . . 0.0 110.784 176.864 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 39' ' ' HIS . . . . . 0.433 ' HB2' HD11 ' A' ' 42' ' ' ILE . 97.9 m-70 -149.82 102.06 3.11 Favored 'General case' 0 N--CA 1.454 -0.267 0 C-N-CA 122.499 0.319 . . . . 0.0 111.716 -176.082 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 40' ' ' ILE . . . . . 0.546 ' H ' HD13 ' A' ' 40' ' ' ILE . 0.0 OUTLIER -81.0 -15.49 12.58 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.279 0 C-N-CA 123.038 0.535 . . . . 0.0 110.872 177.009 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 2.9 m-20 -58.9 -20.12 48.55 Favored 'General case' 0 N--CA 1.454 -0.263 0 N-CA-C 112.546 0.572 . . . . 0.0 112.546 -177.128 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . 0.433 HD11 ' HB2' ' A' ' 39' ' ' HIS . 0.0 OUTLIER -104.35 17.65 5.14 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.258 0 C-N-CA 123.277 0.631 . . . . 0.0 111.792 176.497 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 3.0 pp20? -54.57 -27.99 42.72 Favored 'General case' 0 CA--C 1.529 0.16 0 O-C-N 121.75 -0.594 . . . . 0.0 111.281 178.299 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 32.8 t -63.93 -48.32 77.01 Favored 'General case' 0 N--CA 1.454 -0.234 0 N-CA-C 111.788 0.292 . . . . 0.0 111.788 -178.708 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . 0.471 ' HD3' ' CD1' ' A' ' 7' ' ' PHE . 18.2 ptpt -73.77 -23.18 59.68 Favored 'General case' 0 C--N 1.339 0.152 0 CA-C-N 118.541 0.609 . . . . 0.0 110.121 179.765 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 59.2 mt -72.85 -52.51 22.31 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.343 0 C-N-CA 122.698 0.399 . . . . 0.0 110.603 -178.999 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 39.2 mm -66.52 -36.39 77.19 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.245 0 N-CA-C 109.745 -0.465 . . . . 0.0 109.745 179.546 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 31.9 m -68.66 -40.35 80.21 Favored 'General case' 0 N--CA 1.454 -0.225 0 C-N-CA 121.114 -0.234 . . . . 0.0 111.162 -178.797 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 37.2 tp -75.97 -31.65 59.12 Favored 'General case' 0 N--CA 1.45 -0.463 0 N-CA-C 112.743 0.646 . . . . 0.0 112.743 -175.971 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . 0.505 HD12 HG12 ' A' ' 69' ' ' ILE . 3.3 pt -71.49 -43.87 71.69 Favored 'Isoleucine or valine' 0 C--N 1.34 0.163 0 CA-C-N 118.923 0.783 . . . . 0.0 110.596 177.165 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 25.1 pt -66.09 -38.14 81.34 Favored 'Isoleucine or valine' 0 C--N 1.339 0.136 0 C-N-CA 119.469 -0.892 . . . . 0.0 110.598 176.941 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 94.9 m-20 -68.87 -31.35 70.23 Favored 'General case' 0 N--CA 1.454 -0.232 0 CA-C-N 118.248 0.476 . . . . 0.0 111.34 177.471 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 7.8 t80 -60.0 -48.76 80.39 Favored 'General case' 0 N--CA 1.451 -0.376 0 N-CA-C 107.684 -1.228 . . . . 0.0 107.684 173.832 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 46.3 t -67.24 -27.76 67.49 Favored 'General case' 0 C--N 1.34 0.174 0 CA-C-N 117.82 0.282 . . . . 0.0 111.73 -179.404 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 55.2 ttp85 -75.16 -29.67 60.53 Favored 'General case' 0 N--CA 1.453 -0.309 0 N-CA-C 112.161 0.43 . . . . 0.0 112.161 -177.222 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 36.3 mt -99.37 -43.07 6.71 Favored 'General case' 0 N--CA 1.457 -0.101 0 N-CA-C 112.378 0.51 . . . . 0.0 112.378 -179.078 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 57' ' ' CYS . . . . . 0.478 ' HB2' ' HD2' ' A' ' 58' ' ' PRO . 9.0 p -67.75 161.36 67.11 Favored Pre-proline 0 CA--C 1.534 0.351 0 N-CA-C 113.226 0.824 . . . . 0.0 113.226 -173.084 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 58' ' ' PRO . . . . . 0.478 ' HD2' ' HB2' ' A' ' 57' ' ' CYS . 66.6 Cg_endo -78.5 178.47 7.53 Favored 'Trans proline' 0 N--CA 1.453 -0.871 0 C-N-CA 124.859 3.706 . . . . 0.0 111.743 178.119 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -44.49 -55.53 5.01 Favored 'General case' 0 CA--C 1.531 0.229 0 C-N-CA 126.016 1.726 . . . . 0.0 114.557 -171.182 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 47.8 m -68.93 -30.18 68.59 Favored 'General case' 0 N--CA 1.455 -0.213 0 O-C-N 122.126 -0.359 . . . . 0.0 110.827 -173.441 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 67.6 m170 -75.69 -28.5 58.68 Favored 'General case' 0 N--CA 1.451 -0.42 0 CA-C-O 119.554 -0.26 . . . . 0.0 110.412 176.795 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 61.3 mttm -65.57 -34.29 77.91 Favored 'General case' 0 C--N 1.34 0.177 0 N-CA-C 108.975 -0.75 . . . . 0.0 108.975 173.205 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . 0.515 HD11 ' HE3' ' A' ' 123' ' ' LYS . 0.2 OUTLIER -62.97 -47.54 82.73 Favored 'General case' 0 C--N 1.34 0.173 0 N-CA-C 109.088 -0.708 . . . . 0.0 109.088 175.609 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -66.42 -34.43 87.8 Favored Glycine 0 CA--C 1.524 0.6 0 CA-C-O 119.752 -0.471 . . . . 0.0 111.946 -178.287 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 27.3 t -61.3 -45.13 95.75 Favored 'General case' 0 N--CA 1.453 -0.31 0 CA-C-N 117.582 0.691 . . . . 0.0 109.543 177.452 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 80.8 mt -66.96 -27.17 67.24 Favored 'General case' 0 N--CA 1.455 -0.201 0 O-C-N 123.04 0.213 . . . . 0.0 110.517 179.363 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -71.5 -37.58 71.24 Favored 'General case' 0 C--O 1.234 0.249 0 CA-C-O 120.638 0.256 . . . . 0.0 110.964 178.198 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 68' ' ' ILE . . . . . 0.48 HD11 ' CD1' ' A' ' 17' ' ' PHE . 10.1 mt -71.5 -50.08 42.48 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.403 0 N-CA-C 109.286 -0.635 . . . . 0.0 109.286 174.498 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 69' ' ' ILE . . . . . 0.505 HG12 HD12 ' A' ' 50' ' ' ILE . 52.4 mt -48.8 -41.29 12.64 Favored 'Isoleucine or valine' 0 C--O 1.227 -0.113 0 C-N-CA 123.635 0.774 . . . . 0.0 110.78 174.977 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 10.0 t70 -67.07 -44.89 78.95 Favored 'General case' 0 N--CA 1.455 -0.218 0 CA-C-O 120.698 0.285 . . . . 0.0 110.684 179.044 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 19.6 m -69.21 -49.84 52.8 Favored 'General case' 0 N--CA 1.449 -0.483 0 CA-C-N 116.374 -0.375 . . . . 0.0 111.388 -173.762 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -75.53 -31.06 22.78 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.269 0 N-CA-C 109.678 -0.49 . . . . 0.0 109.678 -179.863 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -66.0 -49.61 57.32 Favored Glycine 0 CA--C 1.526 0.737 0 N-CA-C 111.143 -0.783 . . . . 0.0 111.143 -177.14 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 37.9 mtm105 -66.83 -43.86 82.64 Favored 'General case' 0 N--CA 1.453 -0.309 0 N-CA-C 109.585 -0.524 . . . . 0.0 109.585 177.413 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -61.77 -33.35 73.93 Favored 'General case' 0 N--CA 1.45 -0.443 0 CA-C-O 119.513 -0.28 . . . . 0.0 111.112 -176.902 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 1.5 m-30 -70.93 -46.66 62.08 Favored 'General case' 0 N--CA 1.453 -0.302 0 CA-C-N 118.162 0.437 . . . . 0.0 111.114 177.966 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -68.56 -38.49 80.79 Favored 'General case' 0 N--CA 1.45 -0.434 0 C-N-CA 117.584 -1.647 . . . . 0.0 108.057 -178.807 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 78' ' ' ASP . . . . . 0.428 ' HA ' ' HE ' ' A' ' 81' ' ' ARG . 93.8 m-20 -59.71 -48.31 82.17 Favored 'General case' 0 C--N 1.34 0.159 0 N-CA-C 112.147 0.425 . . . . 0.0 112.147 178.161 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 13.0 tm-20 -65.06 -46.74 79.95 Favored 'General case' 0 N--CA 1.446 -0.649 0 CA-C-N 117.91 0.323 . . . . 0.0 111.043 -177.425 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 80' ' ' THR . . . . . 0.503 HG21 ' HB3' ' A' ' 94' ' ' CYS . 70.5 p -68.65 -33.17 73.54 Favored 'General case' 0 N--CA 1.454 -0.241 0 CA-C-O 119.167 -0.444 . . . . 0.0 111.933 -178.257 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 81' ' ' ARG . . . . . 0.428 ' HE ' ' HA ' ' A' ' 78' ' ' ASP . 21.7 ptt180 -78.93 -23.91 44.38 Favored 'General case' 0 C--N 1.34 0.155 0 CA-C-N 118.771 0.714 . . . . 0.0 111.899 176.88 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 31.2 t . . . . . 0 N--CA 1.454 -0.234 0 C-N-CA 123.061 0.545 . . . . 0.0 112.209 179.191 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 63.7 Cg_endo . . . . . 0 N--CA 1.451 -0.996 0 N-CA-C 107.51 -1.765 . . . . 0.0 107.51 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 114.64 16.82 7.31 Favored Glycine 0 CA--C 1.525 0.696 0 CA-C-O 119.468 -0.629 . . . . 0.0 112.457 -172.978 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 26.9 p -151.59 170.58 19.33 Favored 'General case' 0 N--CA 1.456 -0.17 0 C-N-CA 123.825 0.85 . . . . 0.0 110.34 177.35 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 94' ' ' CYS . . . . . 0.503 ' HB3' HG21 ' A' ' 80' ' ' THR . 23.0 p -58.93 -23.86 61.83 Favored 'General case' 0 N--CA 1.451 -0.407 0 CA-C-N 115.891 -0.595 . . . . 0.0 109.469 175.582 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -60.13 -57.68 11.77 Favored 'General case' 0 N--CA 1.447 -0.606 0 N-CA-C 109.293 -0.632 . . . . 0.0 109.293 -177.178 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 52.4 t60 -75.55 -27.02 58.49 Favored 'General case' 0 N--CA 1.451 -0.419 0 C-N-CA 121.069 -0.252 . . . . 0.0 111.565 -179.893 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -69.51 -48.3 61.0 Favored 'General case' 0 N--CA 1.453 -0.307 0 CA-C-N 117.801 0.273 . . . . 0.0 110.693 -178.652 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 98' ' ' ILE . . . . . 0.43 HD13 ' HB2' ' A' ' 94' ' ' CYS . 2.0 mp -70.57 -30.94 44.62 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.226 0 N-CA-C 109.882 -0.414 . . . . 0.0 109.882 177.815 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 4.6 m120 -63.63 -49.79 71.91 Favored 'General case' 0 N--CA 1.454 -0.266 0 CA-C-N 118.337 0.517 . . . . 0.0 110.89 175.216 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 49.7 m -70.42 -24.47 62.92 Favored 'General case' 0 N--CA 1.457 -0.11 0 O-C-N 123.131 0.269 . . . . 0.0 111.085 -175.289 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 57.2 tp -83.28 -50.24 8.6 Favored 'General case' 0 N--CA 1.45 -0.467 0 C-N-CA 122.436 0.294 . . . . 0.0 110.696 179.685 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -69.53 -18.02 73.28 Favored Glycine 0 C--N 1.338 0.658 0 CA-C-O 119.507 -0.607 . . . . 0.0 112.786 -174.237 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 26.6 pt-20 -81.8 -7.44 59.6 Favored 'General case' 0 CA--C 1.533 0.29 0 CA-C-N 118.264 1.032 . . . . 0.0 112.373 -178.832 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 17.5 m -140.61 0.02 0.51 Allowed 'Isoleucine or valine' 0 N--CA 1.463 0.213 0 N-CA-C 113.315 0.858 . . . . 0.0 113.315 176.9 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 105' ' ' ILE . . . . . . . . . . . . . 9.3 tp -60.3 -28.22 41.39 Favored 'Isoleucine or valine' 0 CA--C 1.527 0.074 0 CA-C-N 119.197 0.908 . . . . 0.0 111.953 -174.521 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 10.6 pt20 -67.15 -26.89 66.89 Favored 'General case' 0 N--CA 1.453 -0.291 0 CA-C-N 118.002 0.365 . . . . 0.0 110.319 179.261 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 59.8 mm-40 -75.51 -42.02 53.76 Favored 'General case' 0 N--CA 1.456 -0.168 0 N-CA-C 110.117 -0.327 . . . . 0.0 110.117 179.897 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -72.53 -35.26 68.03 Favored 'General case' 0 N--CA 1.454 -0.265 0 N-CA-C 109.637 -0.505 . . . . 0.0 109.637 179.708 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 68.2 mt -67.01 -53.26 32.97 Favored 'General case' 0 N--CA 1.454 -0.273 0 N-CA-C 109.974 -0.38 . . . . 0.0 109.974 176.137 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 35.9 t -53.32 -42.64 66.9 Favored 'General case' 0 C--O 1.232 0.138 0 C-N-CA 122.533 0.333 . . . . 0.0 111.86 -177.247 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 47.4 t0 -66.0 -43.11 88.68 Favored 'General case' 0 N--CA 1.451 -0.378 0 N-CA-C 109.439 -0.578 . . . . 0.0 109.439 177.113 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -67.27 -35.52 79.66 Favored 'General case' 0 N--CA 1.449 -0.504 0 CA-C-O 119.557 -0.258 . . . . 0.0 111.164 -176.387 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 113' ' ' ILE . . . . . . . . . . . . . 22.0 mm -68.55 -37.29 77.49 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.326 0 CA-C-N 118.682 0.673 . . . . 0.0 109.242 178.455 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -73.64 -38.58 64.95 Favored 'General case' 0 N--CA 1.45 -0.443 0 N-CA-C 112.094 0.405 . . . . 0.0 112.094 178.553 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 115' ' ' LYS . . . . . 0.401 ' N ' ' HZ2' ' A' ' 115' ' ' LYS . 0.0 OUTLIER -81.23 -38.68 26.55 Favored 'General case' 0 C--N 1.339 0.115 0 N-CA-C 113.075 0.769 . . . . 0.0 113.075 -175.754 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 116' ' ' SER . . . . . 0.499 ' HB2' ' CB ' ' A' ' 120' ' ' HIS . 52.5 p -81.49 158.41 24.52 Favored 'General case' 0 N--CA 1.454 -0.27 0 N-CA-C 113.314 0.857 . . . . 0.0 113.314 -169.473 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 38.9 t30 -78.92 167.92 20.44 Favored 'General case' 0 CA--C 1.531 0.224 0 C-N-CA 123.241 0.617 . . . . 0.0 110.481 -178.851 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 118' ' ' GLN . . . . . . . . . . . . . 27.8 mt-30 -56.33 -36.08 68.33 Favored 'General case' 0 CA--C 1.529 0.171 0 N-CA-C 113.054 0.761 . . . . 0.0 113.054 -171.608 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 13.3 p-10 -69.35 -37.65 77.75 Favored 'General case' 0 N--CA 1.456 -0.133 0 CA-C-O 121.176 0.512 . . . . 0.0 109.849 178.528 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 120' ' ' HIS . . . . . 0.499 ' CB ' ' HB2' ' A' ' 116' ' ' SER . 32.7 m170 -67.22 -41.14 86.22 Favored 'General case' 0 N--CA 1.45 -0.454 0 CA-C-N 115.843 -0.617 . . . . 0.0 110.112 176.63 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 50.4 mttm -58.46 -40.33 82.36 Favored 'General case' 0 C--N 1.342 0.263 0 N-CA-C 109.001 -0.741 . . . . 0.0 109.001 178.226 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 45.9 tp10 -69.91 -38.21 76.19 Favored 'General case' 0 N--CA 1.453 -0.292 0 C-N-CA 122.166 0.186 . . . . 0.0 111.202 -176.8 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 123' ' ' LYS . . . . . 0.515 ' HE3' HD11 ' A' ' 63' ' ' LEU . 50.3 mtmt -69.0 -28.21 66.39 Favored 'General case' 0 N--CA 1.453 -0.301 0 O-C-N 121.803 -0.561 . . . . 0.0 110.182 177.801 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 124' ' ' ILE . . . . . . . . . . . . . 61.5 mt -73.39 -37.68 51.65 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.297 0 N-CA-C 109.041 -0.725 . . . . 0.0 109.041 174.318 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 125' ' ' ARG . . . . . 0.462 HH11 ' HA ' ' A' ' 125' ' ' ARG . 5.7 mmm180 -60.53 -46.57 89.65 Favored 'General case' 0 N--CA 1.452 -0.331 0 CA-C-O 118.95 -0.547 . . . . 0.0 110.866 178.174 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 126' ' ' MET . . . . . . . . . . . . . 28.3 ptm -62.83 -35.75 80.95 Favored 'General case' 0 N--CA 1.452 -0.339 0 C-N-CA 118.593 -1.243 . . . . 0.0 108.736 178.12 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 2.8 mp -61.48 -35.64 78.22 Favored 'General case' 0 CA--C 1.534 0.335 0 CA-C-N 118.927 0.785 . . . . 0.0 112.033 178.59 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -70.9 -41.76 70.83 Favored 'General case' 0 CA--C 1.527 0.092 0 CA-C-N 118.858 0.754 . . . . 0.0 109.718 178.46 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 19.4 m-20 -68.05 -30.64 69.9 Favored 'General case' 0 N--CA 1.453 -0.286 0 N-CA-C 109.704 -0.48 . . . . 0.0 109.704 179.119 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 42.2 mt -64.24 -39.79 86.76 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.302 0 C-N-CA 122.745 0.418 . . . . 0.0 109.893 174.942 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 131' ' ' TRP . . . . . . . . . . . . . 47.4 m0 . . . . . 0 N--CA 1.45 -0.455 0 C-N-CA 119.783 -0.767 . . . . 0.0 111.744 177.669 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 41.8 t0 . . . . . 0 N--CA 1.45 -0.468 0 N-CA-C 107.873 -1.158 . . . . 0.0 107.873 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 7' ' ' PHE . . . . . 0.557 ' CD1' ' HD3' ' A' ' 45' ' ' LYS . 1.5 t80 -55.35 -35.3 65.08 Favored 'General case' 0 N--CA 1.451 -0.404 0 N-CA-C 108.525 -0.917 . . . . 0.0 108.525 175.996 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 51.8 tp60 -51.7 -34.0 36.79 Favored 'General case' 0 N--CA 1.452 -0.326 0 C-N-CA 124.937 1.295 . . . . 0.0 111.969 -178.778 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 79.9 m-20 -74.6 -36.14 62.98 Favored 'General case' 0 N--CA 1.453 -0.282 0 N-CA-C 109.906 -0.405 . . . . 0.0 109.906 -179.932 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 10' ' ' PHE . . . . . 0.486 ' CZ ' HG12 ' A' ' 46' ' ' ILE . 2.0 t80 -68.32 -36.43 79.28 Favored 'General case' 0 N--CA 1.449 -0.503 0 C-N-CA 123.086 0.554 . . . . 0.0 109.638 174.673 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 96.0 t -69.1 -52.79 30.24 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.234 0 N-CA-C 109.606 -0.516 . . . . 0.0 109.606 178.385 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -58.9 -28.47 66.21 Favored 'General case' 0 N--CA 1.454 -0.232 0 CA-C-N 117.747 0.248 . . . . 0.0 111.478 -179.154 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 86.7 m -72.64 -39.01 67.51 Favored 'General case' 0 N--CA 1.454 -0.242 0 N-CA-C 109.099 -0.704 . . . . 0.0 109.099 175.602 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -64.39 -43.26 95.02 Favored 'General case' 0 N--CA 1.451 -0.422 0 N-CA-C 109.018 -0.734 . . . . 0.0 109.018 177.773 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 67.6 mm-40 -65.42 -26.49 68.0 Favored 'General case' 0 N--CA 1.455 -0.22 0 C-N-CA 123.85 0.86 . . . . 0.0 110.011 178.425 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 68.1 m -70.53 -30.17 66.84 Favored 'General case' 0 N--CA 1.455 -0.183 0 N-CA-C 110.015 -0.365 . . . . 0.0 110.015 176.901 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 17' ' ' PHE . . . . . 0.536 ' CD1' HD11 ' A' ' 68' ' ' ILE . 35.9 m-85 -71.98 -32.8 67.6 Favored 'General case' 0 C--N 1.338 0.088 0 C-N-CA 119.943 -0.703 . . . . 0.0 110.76 172.41 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 72.9 mttt -66.76 -25.36 66.46 Favored 'General case' 0 CA--C 1.531 0.235 0 N-CA-C 110.037 -0.357 . . . . 0.0 110.037 174.541 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 42.6 t0 -76.56 -48.74 18.32 Favored 'General case' 0 CA--C 1.529 0.15 0 N-CA-C 110.306 -0.257 . . . . 0.0 110.306 175.439 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 16.2 mt -56.23 125.26 21.01 Favored 'General case' 0 N--CA 1.457 -0.098 0 CA-C-O 120.714 0.293 . . . . 0.0 110.467 -177.64 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . 0.487 ' H ' ' HE2' ' A' ' 21' ' ' LYS . 1.0 OUTLIER -70.74 -22.57 62.4 Favored 'General case' 0 N--CA 1.456 -0.138 0 N-CA-C 109.819 -0.437 . . . . 0.0 109.819 -179.84 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 61.8 m -90.69 -13.34 34.37 Favored 'General case' 0 N--CA 1.457 -0.09 0 C-N-CA 122.901 0.48 . . . . 0.0 111.059 176.299 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 70.55 -16.83 0.92 Allowed Glycine 0 CA--C 1.529 0.923 0 C-N-CA 124.135 0.874 . . . . 0.0 112.983 -179.677 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 93.6 mt -100.41 147.67 7.53 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.135 0 CA-C-N 117.773 0.786 . . . . 0.0 111.121 -179.961 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 24.3 t -161.12 104.68 1.31 Allowed 'General case' 0 CA--C 1.517 -0.294 0 N-CA-C 108.273 -1.01 . . . . 0.0 108.273 170.808 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -59.93 -28.47 66.12 Favored Glycine 0 CA--C 1.525 0.657 0 C-N-CA 119.914 -1.136 . . . . 0.0 110.829 -176.697 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 86.3 p -72.75 -49.34 31.53 Favored 'General case' 0 N--CA 1.453 -0.303 0 CA-C-N 117.854 0.827 . . . . 0.0 110.683 -179.634 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 40.5 mtt-85 -72.55 -37.35 68.27 Favored 'General case' 0 N--CA 1.453 -0.311 0 CA-C-N 117.577 0.171 . . . . 0.0 110.632 -178.534 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 63.0 mt -60.03 -46.24 94.47 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.668 0 N-CA-C 108.704 -0.85 . . . . 0.0 108.704 175.838 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 28.8 mtmm -64.89 -29.03 69.96 Favored 'General case' 0 C--N 1.338 0.091 0 CA-C-O 119.168 -0.444 . . . . 0.0 111.284 178.747 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . 0.472 ' CE ' ' HA ' ' A' ' 31' ' ' LYS . 3.5 mmpt? -66.2 -59.21 3.97 Favored 'General case' 0 N--CA 1.456 -0.155 0 CA-C-N 118.739 0.699 . . . . 0.0 111.454 -179.15 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.493 HD12 ' N ' ' A' ' 33' ' ' THR . 0.8 OUTLIER -75.33 -16.76 60.38 Favored 'General case' 0 CA--C 1.531 0.212 0 C-N-CA 118.747 -1.181 . . . . 0.0 111.568 -179.249 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . 0.493 ' N ' HD12 ' A' ' 32' ' ' LEU . 40.5 m -71.04 -44.37 65.96 Favored 'General case' 0 N--CA 1.455 -0.194 0 N-CA-C 108.19 -1.041 . . . . 0.0 108.19 174.41 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 95.3 m -65.29 -42.74 92.79 Favored 'General case' 0 N--CA 1.453 -0.316 0 N-CA-C 109.601 -0.518 . . . . 0.0 109.601 -179.731 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 38.4 t80 -61.44 -34.31 75.2 Favored 'General case' 0 N--CA 1.453 -0.323 0 CA-C-O 120.731 0.3 . . . . 0.0 110.268 179.18 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -75.3 -25.51 57.96 Favored 'General case' 0 N--CA 1.45 -0.445 0 CA-C-O 119.378 -0.344 . . . . 0.0 111.767 177.977 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 2.2 mm? -82.93 -33.46 26.8 Favored 'General case' 0 N--CA 1.456 -0.149 0 N-CA-C 108.595 -0.891 . . . . 0.0 108.595 -178.127 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 82.7 m-20 -64.52 -28.42 69.64 Favored 'General case' 0 N--CA 1.444 -0.77 0 C-N-CA 123.595 0.758 . . . . 0.0 110.532 174.677 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 73.3 m80 -151.39 106.99 3.36 Favored 'General case' 0 N--CA 1.453 -0.286 0 C-N-CA 122.826 0.45 . . . . 0.0 111.902 -179.841 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 40' ' ' ILE . . . . . 0.62 ' H ' HD13 ' A' ' 40' ' ' ILE . 0.0 OUTLIER -78.61 -10.8 13.0 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.284 0 N-CA-C 109.593 -0.521 . . . . 0.0 109.593 172.699 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -54.85 -28.28 48.72 Favored 'General case' 0 N--CA 1.453 -0.301 0 C-N-CA 123.798 0.839 . . . . 0.0 111.75 -177.006 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -104.88 16.39 6.1 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.318 0 C-N-CA 123.47 0.708 . . . . 0.0 112.375 -179.94 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 3.1 pp20? -53.89 -31.44 49.93 Favored 'General case' 0 C--O 1.225 -0.235 0 O-C-N 121.51 -0.744 . . . . 0.0 110.375 179.66 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 37.6 t -59.42 -48.04 83.18 Favored 'General case' 0 CA--C 1.532 0.287 0 CA-C-O 119.703 -0.189 . . . . 0.0 111.32 -176.913 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . 0.557 ' HD3' ' CD1' ' A' ' 7' ' ' PHE . 18.7 ptpt -75.4 -25.48 57.62 Favored 'General case' 0 CA--C 1.531 0.23 0 CA-C-N 118.267 0.485 . . . . 0.0 110.49 179.541 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 46' ' ' ILE . . . . . 0.486 HG12 ' CZ ' ' A' ' 10' ' ' PHE . 94.5 mt -71.96 -46.45 59.88 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.254 0 N-CA-C 109.667 -0.494 . . . . 0.0 109.667 -179.339 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 39.6 mm -65.22 -34.0 67.52 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.531 0 N-CA-C 108.965 -0.754 . . . . 0.0 108.965 177.311 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 53.8 m -64.75 -35.1 79.96 Favored 'General case' 0 N--CA 1.453 -0.299 0 CA-C-O 119.649 -0.215 . . . . 0.0 111.117 178.068 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 16.1 mt -73.62 -40.58 63.7 Favored 'General case' 0 N--CA 1.452 -0.328 0 CA-C-O 118.753 -0.642 . . . . 0.0 112.528 179.516 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 9.0 pt -68.44 -40.25 81.94 Favored 'Isoleucine or valine' 0 C--N 1.339 0.124 0 CA-C-N 119.474 1.034 . . . . 0.0 111.051 -177.962 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 16.6 pt -68.99 -39.23 79.48 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.185 0 C-N-CA 120.136 -0.626 . . . . 0.0 110.709 179.333 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 50.7 t0 -64.81 -51.66 60.93 Favored 'General case' 0 N--CA 1.455 -0.194 0 N-CA-C 109.648 -0.501 . . . . 0.0 109.648 177.924 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 25.9 t80 -59.57 -53.29 59.81 Favored 'General case' 0 N--CA 1.45 -0.46 0 N-CA-C 109.543 -0.54 . . . . 0.0 109.543 -179.298 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 18.7 t -61.48 -29.53 70.03 Favored 'General case' 0 N--CA 1.452 -0.337 0 N-CA-C 111.974 0.361 . . . . 0.0 111.974 -174.344 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 5.1 tpm_? -75.5 -60.43 2.31 Favored 'General case' 0 CA--C 1.532 0.283 0 C-N-CA 122.5 0.32 . . . . 0.0 111.326 -179.5 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . 0.443 ' N ' HD12 ' A' ' 56' ' ' LEU . 9.1 mp -75.66 -28.66 58.82 Favored 'General case' 0 C--O 1.231 0.093 0 N-CA-C 114.14 1.163 . . . . 0.0 114.14 -174.966 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 57' ' ' CYS . . . . . 0.424 ' HB2' ' HD2' ' A' ' 58' ' ' PRO . 13.2 p -68.28 156.74 89.47 Favored Pre-proline 0 CA--C 1.536 0.428 0 N-CA-C 112.471 0.545 . . . . 0.0 112.471 -174.713 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 58' ' ' PRO . . . . . 0.424 ' HD2' ' HB2' ' A' ' 57' ' ' CYS . 94.0 Cg_endo -74.05 175.97 10.15 Favored 'Trans proline' 0 N--CA 1.454 -0.832 0 C-N-CA 125.046 3.83 . . . . 0.0 111.593 179.203 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 32.4 p-10 -52.66 -47.2 67.29 Favored 'General case' 0 CA--C 1.529 0.145 0 C-N-CA 124.533 1.133 . . . . 0.0 113.737 -170.847 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 40.2 t -65.23 -37.63 87.87 Favored 'General case' 0 N--CA 1.456 -0.145 0 CA-C-O 121.121 0.486 . . . . 0.0 110.462 -178.758 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 66.1 m170 -75.3 -26.36 58.64 Favored 'General case' 0 N--CA 1.452 -0.375 0 CA-C-N 116.521 -0.309 . . . . 0.0 110.232 179.836 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . 0.415 ' HE2' ' O ' ' A' ' 57' ' ' CYS . 68.7 mttm -65.93 -39.43 90.5 Favored 'General case' 0 C--N 1.342 0.249 0 N-CA-C 109.29 -0.633 . . . . 0.0 109.29 174.334 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -61.15 -48.38 81.86 Favored 'General case' 0 N--CA 1.454 -0.233 0 N-CA-C 108.313 -0.995 . . . . 0.0 108.313 176.541 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -63.99 -31.89 82.36 Favored Glycine 0 CA--C 1.524 0.642 0 N-CA-C 111.668 -0.573 . . . . 0.0 111.668 -179.21 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 37.4 p -65.85 -38.53 89.1 Favored 'General case' 0 N--CA 1.454 -0.271 0 CA-C-N 117.699 0.749 . . . . 0.0 109.887 179.011 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 82.3 mt -72.61 -25.54 61.35 Favored 'General case' 0 N--CA 1.451 -0.396 0 N-CA-C 110.026 -0.361 . . . . 0.0 110.026 178.914 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -72.45 -38.59 68.24 Favored 'General case' 0 N--CA 1.454 -0.268 0 N-CA-C 110.374 -0.232 . . . . 0.0 110.374 176.335 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 68' ' ' ILE . . . . . 0.536 HD11 ' CD1' ' A' ' 17' ' ' PHE . 18.2 mt -69.19 -46.82 77.06 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.237 0 N-CA-C 109.673 -0.491 . . . . 0.0 109.673 176.0 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 70.7 mt -56.55 -32.46 36.91 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.161 0 C-N-CA 123.031 0.532 . . . . 0.0 110.814 176.252 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 6.9 t70 -69.76 -50.08 46.83 Favored 'General case' 0 N--CA 1.452 -0.354 0 CA-C-O 119.383 -0.341 . . . . 0.0 111.132 179.38 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 99.2 p -67.5 -49.89 61.41 Favored 'General case' 0 N--CA 1.455 -0.219 0 C-N-CA 120.505 -0.478 . . . . 0.0 110.663 -175.757 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -74.89 -32.44 27.72 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.182 0 N-CA-C 109.931 -0.396 . . . . 0.0 109.931 -176.508 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -69.75 -58.53 6.27 Favored Glycine 0 C--N 1.336 0.566 0 N-CA-C 111.116 -0.794 . . . . 0.0 111.116 -176.975 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 28.7 mtp-105 -61.51 -40.95 96.46 Favored 'General case' 0 N--CA 1.45 -0.426 0 N-CA-C 109.808 -0.441 . . . . 0.0 109.808 -177.799 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -67.81 -28.23 67.41 Favored 'General case' 0 N--CA 1.451 -0.411 0 C-N-CA 120.771 -0.372 . . . . 0.0 111.331 179.993 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 1.3 m-30 -69.63 -46.23 66.68 Favored 'General case' 0 N--CA 1.455 -0.221 0 CA-C-N 118.648 0.658 . . . . 0.0 111.192 178.529 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 44.2 tp -73.51 -35.83 65.65 Favored 'General case' 0 N--CA 1.449 -0.477 0 C-N-CA 117.471 -1.691 . . . . 0.0 110.219 -179.995 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 89.0 m-20 -62.52 -46.22 89.39 Favored 'General case' 0 C--O 1.231 0.122 0 N-CA-C 112.393 0.516 . . . . 0.0 112.393 178.641 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 15.1 tm-20 -65.35 -47.75 75.39 Favored 'General case' 0 N--CA 1.444 -0.759 0 CA-C-N 118.017 0.371 . . . . 0.0 110.873 -179.026 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 76.7 p -68.23 -25.04 65.0 Favored 'General case' 0 N--CA 1.452 -0.328 0 CA-C-O 119.674 -0.203 . . . . 0.0 111.49 -179.172 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 35.4 ttp-105 -75.51 -34.05 60.79 Favored 'General case' 0 N--CA 1.457 -0.093 0 C-N-CA 122.711 0.404 . . . . 0.0 111.234 172.915 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 34.6 t . . . . . 0 N--CA 1.456 -0.157 0 C-N-CA 123.839 0.856 . . . . 0.0 113.249 -177.876 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 71.6 Cg_endo . . . . . 0 N--CA 1.455 -0.787 0 N-CA-C 110.246 -0.713 . . . . 0.0 110.246 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 84.9 19.13 60.02 Favored Glycine 0 CA--C 1.523 0.567 0 CA-C-O 119.483 -0.62 . . . . 0.0 112.344 179.303 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 25.1 p -153.76 172.82 16.71 Favored 'General case' 0 N--CA 1.455 -0.195 0 C-N-CA 123.533 0.733 . . . . 0.0 110.716 178.702 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 94' ' ' CYS . . . . . 0.426 ' HB2' HD13 ' A' ' 98' ' ' ILE . 30.6 p -59.93 -21.73 61.51 Favored 'General case' 0 N--CA 1.449 -0.522 0 CA-C-N 115.467 -0.788 . . . . 0.0 110.234 175.064 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -60.22 -56.8 17.14 Favored 'General case' 0 N--CA 1.447 -0.578 0 N-CA-C 109.722 -0.473 . . . . 0.0 109.722 -176.088 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 73.7 t60 -75.17 -37.12 61.4 Favored 'General case' 0 N--CA 1.45 -0.435 0 O-C-N 122.924 0.14 . . . . 0.0 111.014 179.191 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -62.58 -50.83 69.75 Favored 'General case' 0 N--CA 1.451 -0.379 0 N-CA-C 111.821 0.304 . . . . 0.0 111.821 -177.585 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 98' ' ' ILE . . . . . 0.426 HD13 ' HB2' ' A' ' 94' ' ' CYS . 1.8 mp -73.03 -33.14 41.98 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.165 0 CA-C-N 118.233 0.469 . . . . 0.0 110.068 -179.164 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 2.1 m120 -65.0 -40.65 95.26 Favored 'General case' 0 N--CA 1.452 -0.326 0 CA-C-N 118.547 0.612 . . . . 0.0 111.465 177.129 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 96.7 m -67.2 -42.7 83.71 Favored 'General case' 0 N--CA 1.452 -0.339 0 CA-C-O 120.514 0.197 . . . . 0.0 110.532 -178.011 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 75.7 mt -74.3 -28.49 61.2 Favored 'General case' 0 N--CA 1.45 -0.439 0 C-N-CA 120.805 -0.358 . . . . 0.0 110.871 179.997 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -59.19 -25.11 59.6 Favored Glycine 0 CA--C 1.527 0.803 0 N-CA-C 111.683 -0.567 . . . . 0.0 111.683 -177.868 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 17.4 mm-40 -84.49 -41.74 16.27 Favored 'General case' 0 N--CA 1.454 -0.272 0 CA-C-N 117.965 0.882 . . . . 0.0 112.309 179.588 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 16.5 m -104.5 -4.17 9.63 Favored 'Isoleucine or valine' 0 N--CA 1.461 0.095 0 N-CA-C 114.164 1.172 . . . . 0.0 114.164 -171.501 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 105' ' ' ILE . . . . . 0.414 HD12 ' HA ' ' A' ' 105' ' ' ILE . 11.1 tp -63.69 -33.42 61.63 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.244 0 CA-C-N 119.463 1.029 . . . . 0.0 110.913 -177.421 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 23.8 pt20 -67.15 -30.22 70.15 Favored 'General case' 0 CA--C 1.531 0.237 0 C-N-CA 122.948 0.499 . . . . 0.0 110.03 178.523 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 5.8 mm-40 -74.12 -46.67 41.22 Favored 'General case' 0 N--CA 1.454 -0.245 0 C-N-CA 123.135 0.574 . . . . 0.0 110.425 177.708 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 81.6 mt -68.66 -33.58 74.24 Favored 'General case' 0 N--CA 1.455 -0.217 0 N-CA-C 110.045 -0.354 . . . . 0.0 110.045 -178.77 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 36.4 mt -65.25 -62.13 1.72 Allowed 'General case' 0 N--CA 1.449 -0.49 0 N-CA-C 109.332 -0.618 . . . . 0.0 109.332 175.171 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 25.7 t -58.13 -35.55 71.65 Favored 'General case' 0 C--N 1.338 0.107 0 N-CA-C 112.005 0.372 . . . . 0.0 112.005 -173.463 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 62.1 t0 -61.85 -44.02 97.66 Favored 'General case' 0 N--CA 1.45 -0.47 0 N-CA-C 108.979 -0.748 . . . . 0.0 108.979 176.643 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -71.47 -37.67 71.3 Favored 'General case' 0 N--CA 1.446 -0.646 0 CA-C-N 116.434 -0.348 . . . . 0.0 110.802 -178.861 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 113' ' ' ILE . . . . . 0.474 ' O ' ' HE3' ' A' ' 121' ' ' LYS . 32.9 mm -61.25 -43.59 96.78 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.259 0 N-CA-C 109.356 -0.609 . . . . 0.0 109.356 -179.403 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -74.56 -38.83 62.6 Favored 'General case' 0 N--CA 1.451 -0.422 0 N-CA-C 112.039 0.385 . . . . 0.0 112.039 -176.701 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -77.42 -34.44 54.7 Favored 'General case' 0 C--N 1.338 0.099 0 N-CA-C 112.106 0.41 . . . . 0.0 112.106 -177.585 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 116' ' ' SER . . . . . 0.513 ' HB2' ' CB ' ' A' ' 120' ' ' HIS . 29.3 p -87.72 157.55 19.03 Favored 'General case' 0 N--CA 1.454 -0.257 0 N-CA-C 113.084 0.772 . . . . 0.0 113.084 -169.43 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 53.2 t30 -75.48 167.8 21.22 Favored 'General case' 0 C--O 1.224 -0.268 0 C-N-CA 123.874 0.869 . . . . 0.0 111.052 -178.293 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 118' ' ' GLN . . . . . . . . . . . . . 19.6 mm100 -57.6 -32.51 67.26 Favored 'General case' 0 CA--C 1.527 0.085 0 C-N-CA 123.17 0.588 . . . . 0.0 111.405 -176.062 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 36.6 t0 -65.51 -45.37 83.81 Favored 'General case' 0 N--CA 1.454 -0.24 0 CA-C-O 121.701 0.762 . . . . 0.0 108.967 175.639 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 120' ' ' HIS . . . . . 0.513 ' CB ' ' HB2' ' A' ' 116' ' ' SER . 33.5 m170 -68.14 -37.31 80.92 Favored 'General case' 0 N--CA 1.449 -0.477 0 N-CA-C 109.731 -0.47 . . . . 0.0 109.731 179.852 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 121' ' ' LYS . . . . . 0.474 ' HE3' ' O ' ' A' ' 113' ' ' ILE . 61.6 mttp -60.21 -36.96 78.86 Favored 'General case' 0 CA--C 1.521 -0.17 0 N-CA-C 108.675 -0.861 . . . . 0.0 108.675 176.394 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 28.1 tt0 -65.43 -44.41 87.43 Favored 'General case' 0 N--CA 1.452 -0.359 0 C-N-CA 122.379 0.272 . . . . 0.0 110.791 -178.03 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 14.4 mptt -67.34 -36.4 81.33 Favored 'General case' 0 C--O 1.226 -0.149 0 C-N-CA 120.63 -0.428 . . . . 0.0 110.115 -179.209 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 124' ' ' ILE . . . . . . . . . . . . . 54.4 mt -68.67 -32.88 56.86 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.329 0 N-CA-C 109.07 -0.715 . . . . 0.0 109.07 176.474 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 125' ' ' ARG . . . . . 0.474 ' HA ' ' HD2' ' A' ' 125' ' ' ARG . 17.4 tpt85 -69.64 -35.49 75.26 Favored 'General case' 0 N--CA 1.447 -0.599 0 CA-C-O 119.214 -0.422 . . . . 0.0 111.889 -174.806 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 126' ' ' MET . . . . . . . . . . . . . 26.8 ptm -73.88 -38.69 64.32 Favored 'General case' 0 N--CA 1.453 -0.284 0 N-CA-C 109.19 -0.67 . . . . 0.0 109.19 175.656 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 6.4 mp -61.26 -36.33 79.7 Favored 'General case' 0 CA--C 1.53 0.175 0 N-CA-C 109.434 -0.58 . . . . 0.0 109.434 174.811 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 43.6 tp -65.73 -44.33 86.33 Favored 'General case' 0 N--CA 1.454 -0.273 0 O-C-N 122.108 -0.37 . . . . 0.0 110.941 -179.128 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 89.2 m-20 -68.0 -36.4 79.93 Favored 'General case' 0 N--CA 1.456 -0.158 0 N-CA-C 110.366 -0.235 . . . . 0.0 110.366 176.245 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 54.4 mt -63.13 -38.4 81.96 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.436 0 N-CA-C 109.316 -0.624 . . . . 0.0 109.316 177.733 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 131' ' ' TRP . . . . . . . . . . . . . 41.0 m0 . . . . . 0 N--CA 1.454 -0.269 0 CA-C-O 119.481 -0.295 . . . . 0.0 111.481 179.403 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 24.9 p-10 . . . . . 0 N--CA 1.455 -0.21 0 N-CA-C 109.429 -0.582 . . . . 0.0 109.429 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 7' ' ' PHE . . . . . 0.513 ' CD1' ' HD3' ' A' ' 45' ' ' LYS . 1.5 t80 -58.07 -36.48 72.88 Favored 'General case' 0 N--CA 1.446 -0.672 0 C-N-CA 123.173 0.589 . . . . 0.0 111.403 -176.972 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 51.7 tp60 -57.92 -32.17 67.5 Favored 'General case' 0 N--CA 1.453 -0.312 0 C-N-CA 122.689 0.395 . . . . 0.0 111.473 -176.959 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 49.6 t30 -69.44 -33.97 73.74 Favored 'General case' 0 N--CA 1.454 -0.264 0 N-CA-C 109.663 -0.495 . . . . 0.0 109.663 177.826 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 10' ' ' PHE . . . . . 0.506 ' CE2' ' HB2' ' A' ' 32' ' ' LEU . 12.0 t80 -70.33 -40.89 73.87 Favored 'General case' 0 N--CA 1.45 -0.446 0 N-CA-C 109.479 -0.563 . . . . 0.0 109.479 177.427 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 91.3 t -63.0 -55.63 22.4 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.372 0 N-CA-C 108.394 -0.965 . . . . 0.0 108.394 179.544 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -57.79 -29.44 64.87 Favored 'General case' 0 N--CA 1.451 -0.384 0 C-N-CA 122.847 0.459 . . . . 0.0 112.072 179.737 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 95.2 m -72.33 -41.05 66.95 Favored 'General case' 0 CA--C 1.529 0.162 0 CA-C-N 118.864 0.756 . . . . 0.0 109.297 177.208 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.523 ' HA ' ' CD1' ' A' ' 17' ' ' PHE . 10.8 tp -65.84 -42.65 90.22 Favored 'General case' 0 N--CA 1.454 -0.244 0 CA-C-O 121.053 0.454 . . . . 0.0 109.847 178.743 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 77.3 mm-40 -63.65 -32.8 74.39 Favored 'General case' 0 N--CA 1.452 -0.364 0 C-N-CA 123.947 0.899 . . . . 0.0 109.488 177.02 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 70.7 m -69.36 -22.43 63.74 Favored 'General case' 0 N--CA 1.451 -0.421 0 CA-C-O 119.011 -0.518 . . . . 0.0 110.422 177.149 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 17' ' ' PHE . . . . . 0.523 ' CD1' ' HA ' ' A' ' 14' ' ' LEU . 17.0 m-85 -74.49 -38.14 62.95 Favored 'General case' 0 C--N 1.343 0.324 0 CA-C-N 118.572 0.624 . . . . 0.0 110.83 170.303 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . 0.436 ' HG2' ' CE1' ' A' ' 53' ' ' TYR . 61.5 mttt -63.72 -23.51 67.39 Favored 'General case' 0 C--N 1.34 0.194 0 CA-C-O 120.786 0.327 . . . . 0.0 110.443 178.924 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 32.0 t0 -75.74 -9.47 58.62 Favored 'General case' 0 CA--C 1.538 0.488 0 C-N-CA 123.397 0.679 . . . . 0.0 112.711 176.315 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . 0.486 ' CD1' ' HB2' ' A' ' 25' ' ' SER . 66.9 mt -88.87 171.65 9.76 Favored 'General case' 0 N--CA 1.455 -0.188 0 O-C-N 121.556 -0.715 . . . . 0.0 112.865 -176.443 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 2.1 mppt? -77.79 -25.77 49.21 Favored 'General case' 0 N--CA 1.453 -0.295 0 CA-C-N 115.661 -0.7 . . . . 0.0 110.694 178.725 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 9.4 t -147.58 9.51 0.92 Allowed 'General case' 0 CA--C 1.522 -0.105 0 N-CA-C 113.166 0.802 . . . . 0.0 113.166 -175.879 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 70.23 -13.94 1.37 Allowed Glycine 0 CA--C 1.528 0.856 0 C-N-CA 123.819 0.723 . . . . 0.0 113.234 176.374 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 83.8 mt -65.95 129.31 30.16 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.196 0 N-CA-C 107.282 -1.377 . . . . 0.0 107.282 175.546 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . 0.486 ' HB2' ' CD1' ' A' ' 20' ' ' LEU . 3.0 t -159.61 73.56 0.57 Allowed 'General case' 0 CA--C 1.518 -0.261 0 N-CA-C 110.198 -0.297 . . . . 0.0 110.198 -171.357 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -44.6 -51.14 8.09 Favored Glycine 0 CA--C 1.527 0.789 0 CA-C-O 118.838 -0.979 . . . . 0.0 114.126 -170.305 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . 0.432 ' HA ' ' HE3' ' A' ' 30' ' ' LYS . 37.1 p -70.34 -39.03 74.94 Favored 'General case' 0 N--CA 1.455 -0.184 0 CA-C-N 119.615 1.707 . . . . 0.0 111.072 -173.913 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 87.5 mtt180 -74.18 -39.83 62.94 Favored 'General case' 0 N--CA 1.454 -0.259 0 CA-C-N 117.812 0.278 . . . . 0.0 110.715 -179.36 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 61.7 mt -56.63 -46.09 82.67 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.634 0 N-CA-C 108.782 -0.822 . . . . 0.0 108.782 173.753 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . 0.432 ' HE3' ' HA ' ' A' ' 27' ' ' SER . 51.4 mtmt -66.75 -29.08 68.97 Favored 'General case' 0 C--N 1.34 0.168 0 CA-C-O 118.984 -0.532 . . . . 0.0 111.332 179.261 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . 0.468 ' CE ' ' HA ' ' A' ' 31' ' ' LYS . 3.3 mmpt? -66.13 -55.64 15.41 Favored 'General case' 0 N--CA 1.458 -0.073 0 CA-C-N 118.795 0.725 . . . . 0.0 111.014 -179.075 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.506 ' HB2' ' CE2' ' A' ' 10' ' ' PHE . 1.6 pp -76.12 -18.88 58.96 Favored 'General case' 0 CA--C 1.532 0.264 0 C-N-CA 119.427 -0.909 . . . . 0.0 111.702 -179.71 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . 0.468 ' N ' HD12 ' A' ' 32' ' ' LEU . 33.2 m -71.13 -40.69 71.24 Favored 'General case' 0 N--CA 1.456 -0.156 0 N-CA-C 108.746 -0.835 . . . . 0.0 108.746 174.834 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 97.9 m -66.75 -41.2 88.17 Favored 'General case' 0 N--CA 1.45 -0.444 0 N-CA-C 109.776 -0.453 . . . . 0.0 109.776 179.388 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 22.1 t80 -60.62 -34.97 75.03 Favored 'General case' 0 C--O 1.226 -0.145 0 N-CA-C 109.938 -0.393 . . . . 0.0 109.938 177.337 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -73.46 -28.45 61.95 Favored 'General case' 0 N--CA 1.449 -0.49 0 CA-C-O 119.25 -0.405 . . . . 0.0 111.522 178.817 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 2.6 mm? -82.38 -34.26 28.43 Favored 'General case' 0 CA--C 1.52 -0.193 0 N-CA-C 109.259 -0.645 . . . . 0.0 109.259 -177.564 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 83.0 m-20 -64.93 -26.74 68.44 Favored 'General case' 0 N--CA 1.442 -0.85 0 C-N-CA 123.829 0.852 . . . . 0.0 110.675 174.463 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 75.7 m80 -151.59 105.64 3.17 Favored 'General case' 0 N--CA 1.452 -0.329 0 C-N-CA 122.985 0.514 . . . . 0.0 111.264 -177.959 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 40' ' ' ILE . . . . . 0.6 ' H ' HD13 ' A' ' 40' ' ' ILE . 0.0 OUTLIER -81.22 -14.59 12.59 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.378 0 C-N-CA 123.323 0.649 . . . . 0.0 110.7 175.481 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 94.5 m-20 -61.35 -11.65 10.89 Favored 'General case' 0 CA--C 1.528 0.103 0 N-CA-C 112.924 0.713 . . . . 0.0 112.924 -178.366 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -111.12 16.15 8.08 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.163 0 C-N-CA 123.23 0.612 . . . . 0.0 111.33 176.17 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 3.0 pp20? -52.77 -32.56 44.23 Favored 'General case' 0 CA--C 1.531 0.228 0 O-C-N 121.649 -0.657 . . . . 0.0 110.668 177.236 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 40.7 t -58.71 -48.35 81.43 Favored 'General case' 0 C--O 1.234 0.267 0 N-CA-C 112.519 0.562 . . . . 0.0 112.519 -179.362 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . 0.513 ' HD3' ' CD1' ' A' ' 7' ' ' PHE . 18.7 ptpt -72.33 -25.9 61.72 Favored 'General case' 0 CA--C 1.53 0.187 0 CA-C-N 118.35 0.523 . . . . 0.0 110.193 179.69 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 70.4 mt -72.39 -48.8 46.2 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.257 0 N-CA-C 109.969 -0.382 . . . . 0.0 109.969 -178.236 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 39.6 mm -64.34 -35.67 74.89 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.232 0 N-CA-C 109.296 -0.631 . . . . 0.0 109.296 178.766 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 49.0 m -63.73 -38.93 92.95 Favored 'General case' 0 N--CA 1.453 -0.289 0 CA-C-N 116.836 -0.166 . . . . 0.0 111.1 179.993 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 35.7 mt -76.25 -32.81 59.08 Favored 'General case' 0 N--CA 1.45 -0.467 0 N-CA-C 113.545 0.943 . . . . 0.0 113.545 -178.917 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 15.5 pt -69.81 -40.62 79.23 Favored 'Isoleucine or valine' 0 CA--C 1.523 -0.089 0 CA-C-N 119.647 1.112 . . . . 0.0 110.298 179.294 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 25.8 pt -69.05 -38.53 78.45 Favored 'Isoleucine or valine' 0 CA--C 1.527 0.095 0 C-N-CA 120.068 -0.653 . . . . 0.0 110.528 178.838 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 95.9 m-20 -70.26 -39.36 75.02 Favored 'General case' 0 N--CA 1.456 -0.172 0 CA-C-O 119.281 -0.39 . . . . 0.0 112.007 177.848 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 53' ' ' TYR . . . . . 0.436 ' CE1' ' HG2' ' A' ' 18' ' ' LYS . 13.9 t80 -65.55 -46.61 78.86 Favored 'General case' 0 N--CA 1.453 -0.3 0 N-CA-C 108.707 -0.849 . . . . 0.0 108.707 177.384 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 23.1 m -61.71 -31.9 72.08 Favored 'General case' 0 N--CA 1.455 -0.218 0 O-C-N 123.096 0.248 . . . . 0.0 110.869 -178.327 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 56.2 ttp85 -75.43 -53.34 8.85 Favored 'General case' 0 N--CA 1.451 -0.381 0 C-N-CA 123.494 0.718 . . . . 0.0 112.023 -177.181 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 38.0 mt -76.1 -41.53 50.05 Favored 'General case' 0 N--CA 1.456 -0.158 0 N-CA-C 113.025 0.75 . . . . 0.0 113.025 -173.666 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 8.5 p -64.76 157.1 76.32 Favored Pre-proline 0 CA--C 1.535 0.37 0 N-CA-C 112.842 0.682 . . . . 0.0 112.842 -172.717 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 93.7 Cg_endo -74.66 175.85 10.56 Favored 'Trans proline' 0 N--CA 1.457 -0.664 0 C-N-CA 124.777 3.652 . . . . 0.0 111.131 178.945 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 23.1 p-10 -51.65 -50.06 61.09 Favored 'General case' 0 N--CA 1.456 -0.159 0 C-N-CA 124.31 1.044 . . . . 0.0 113.606 -172.061 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 81.9 p -64.92 -35.71 82.04 Favored 'General case' 0 N--CA 1.452 -0.351 0 C-N-CA 120.066 -0.654 . . . . 0.0 110.148 -177.299 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 48.3 m170 -74.04 -24.77 59.59 Favored 'General case' 0 N--CA 1.455 -0.18 0 CA-C-O 119.033 -0.508 . . . . 0.0 110.263 178.499 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 64.8 mttm -65.96 -34.74 78.8 Favored 'General case' 0 C--N 1.339 0.144 0 CA-C-N 118.791 0.723 . . . . 0.0 109.484 173.984 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -63.65 -48.68 76.27 Favored 'General case' 0 CA--C 1.531 0.248 0 N-CA-C 108.339 -0.985 . . . . 0.0 108.339 174.385 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -66.45 -26.88 72.82 Favored Glycine 0 CA--C 1.525 0.717 0 N-CA-C 111.732 -0.547 . . . . 0.0 111.732 -178.979 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 48.9 m -68.3 -40.35 81.77 Favored 'General case' 0 N--CA 1.452 -0.369 0 CA-C-N 117.654 0.727 . . . . 0.0 109.226 177.297 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 78.0 mt -70.05 -23.84 63.16 Favored 'General case' 0 N--CA 1.449 -0.51 0 CA-C-N 116.633 -0.258 . . . . 0.0 110.502 178.417 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 2.3 m-85 -69.54 -40.77 76.66 Favored 'General case' 0 N--CA 1.456 -0.149 0 CA-C-N 117.703 0.229 . . . . 0.0 111.23 173.041 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 68' ' ' ILE . . . . . 0.519 HD11 ' CD1' ' A' ' 17' ' ' PHE . 8.3 mt -67.43 -43.96 87.2 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.236 0 N-CA-C 109.123 -0.695 . . . . 0.0 109.123 178.772 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 88.9 mt -60.22 -30.69 46.54 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.251 0 C-N-CA 122.717 0.407 . . . . 0.0 111.059 175.887 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 19.4 t70 -70.09 -45.03 67.84 Favored 'General case' 0 N--CA 1.454 -0.262 0 CA-C-N 118.276 0.489 . . . . 0.0 111.603 179.346 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 95.0 p -70.88 -50.08 39.03 Favored 'General case' 0 N--CA 1.45 -0.444 0 C-N-CA 120.857 -0.337 . . . . 0.0 110.381 -176.404 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -75.72 -35.25 30.49 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.218 0 N-CA-C 110.234 -0.284 . . . . 0.0 110.234 -178.108 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -65.32 -51.78 46.21 Favored Glycine 0 C--N 1.335 0.476 0 N-CA-C 111.461 -0.656 . . . . 0.0 111.461 -175.132 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 36.8 mtm105 -71.26 -42.97 68.1 Favored 'General case' 0 N--CA 1.452 -0.351 0 C-N-CA 120.218 -0.593 . . . . 0.0 110.253 179.674 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -60.54 -28.26 68.29 Favored 'General case' 0 N--CA 1.45 -0.443 0 C-N-CA 120.024 -0.67 . . . . 0.0 110.193 -178.692 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 1.8 m-30 -70.36 -55.31 9.43 Favored 'General case' 0 N--CA 1.453 -0.275 0 CA-C-N 118.242 0.473 . . . . 0.0 110.865 174.993 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 6.9 tt -65.94 -43.67 87.33 Favored 'General case' 0 N--CA 1.451 -0.423 0 C-N-CA 117.661 -1.616 . . . . 0.0 109.331 -175.955 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 56.5 m-20 -55.82 -51.45 67.45 Favored 'General case' 0 CA--C 1.528 0.116 0 C-N-CA 122.471 0.308 . . . . 0.0 111.438 -179.028 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 15.2 tm-20 -66.23 -46.1 78.35 Favored 'General case' 0 N--CA 1.446 -0.666 0 N-CA-C 111.618 0.229 . . . . 0.0 111.618 -178.246 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 81.4 p -70.51 -21.51 62.74 Favored 'General case' 0 N--CA 1.451 -0.38 0 CA-C-O 119.711 -0.185 . . . . 0.0 111.341 -178.263 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -75.92 -33.21 59.86 Favored 'General case' 0 N--CA 1.453 -0.309 0 CA-C-N 117.858 0.299 . . . . 0.0 110.198 172.363 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 46.1 t . . . . . 0 N--CA 1.457 -0.118 0 N-CA-C 112.68 0.622 . . . . 0.0 112.68 -178.945 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 44.5 Cg_endo . . . . . 0 N--CA 1.45 -1.031 0 N-CA-C 106.35 -2.212 . . . . 0.0 106.35 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 92' ' ' GLY . . . . . 0.408 ' HA2' ' O ' ' A' ' 40' ' ' ILE . . . 156.9 19.51 0.04 OUTLIER Glycine 0 CA--C 1.529 0.932 0 CA-C-O 118.896 -0.947 . . . . 0.0 114.019 -170.803 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 1.3 p -155.2 165.49 36.51 Favored 'General case' 0 C--O 1.231 0.129 0 CA-C-N 118.617 1.209 . . . . 0.0 109.607 179.46 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 94' ' ' CYS . . . . . 0.512 ' SG ' HD13 ' A' ' 98' ' ' ILE . 2.3 t -51.46 -28.91 14.48 Favored 'General case' 0 N--CA 1.454 -0.233 0 C-N-CA 123.462 0.705 . . . . 0.0 110.722 175.372 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -54.56 -62.54 1.59 Allowed 'General case' 0 N--CA 1.451 -0.403 0 CA-C-N 117.821 0.282 . . . . 0.0 110.357 -179.001 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 66.2 t60 -71.54 -32.6 68.33 Favored 'General case' 0 N--CA 1.451 -0.38 0 O-C-N 122.29 -0.256 . . . . 0.0 110.65 -177.585 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -68.39 -51.74 40.69 Favored 'General case' 0 N--CA 1.451 -0.398 0 N-CA-C 111.579 0.214 . . . . 0.0 111.579 -175.528 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 98' ' ' ILE . . . . . 0.512 HD13 ' SG ' ' A' ' 94' ' ' CYS . 1.7 mp -69.43 -34.86 64.2 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.234 0 CA-C-O 119.35 -0.357 . . . . 0.0 110.116 -178.231 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 29.5 m-80 -70.89 -40.0 72.49 Favored 'General case' 0 N--CA 1.456 -0.131 0 C-N-CA 119.995 -0.682 . . . . 0.0 112.018 178.896 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 85.3 m -74.2 -25.02 59.45 Favored 'General case' 0 N--CA 1.457 -0.104 0 CA-C-N 118.348 0.522 . . . . 0.0 111.178 -177.151 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 64.6 tp -87.57 -40.73 13.99 Favored 'General case' 0 N--CA 1.451 -0.409 0 O-C-N 122.256 -0.278 . . . . 0.0 110.506 177.582 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -69.86 -20.29 75.91 Favored Glycine 0 CA--C 1.527 0.84 0 CA-C-O 119.579 -0.567 . . . . 0.0 112.52 -175.592 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 22.9 pt-20 -79.35 -4.66 51.96 Favored 'General case' 0 N--CA 1.453 -0.295 0 CA-C-N 118.168 0.984 . . . . 0.0 111.595 179.285 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 21.9 m -139.89 3.93 0.57 Allowed 'Isoleucine or valine' 0 N--CA 1.464 0.259 0 N-CA-C 112.538 0.57 . . . . 0.0 112.538 176.834 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 105' ' ' ILE . . . . . . . . . . . . . 10.9 tp -64.43 -31.04 51.9 Favored 'Isoleucine or valine' 0 C--O 1.227 -0.104 0 CA-C-N 118.912 0.778 . . . . 0.0 111.118 -175.352 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 11.7 pt20 -67.8 -28.69 67.81 Favored 'General case' 0 N--CA 1.454 -0.23 0 O-C-N 122.017 -0.427 . . . . 0.0 110.107 179.453 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 61.6 mm-40 -75.68 -42.22 51.71 Favored 'General case' 0 N--CA 1.454 -0.243 0 N-CA-C 109.791 -0.448 . . . . 0.0 109.791 -179.35 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 88.7 mt -71.37 -34.59 70.58 Favored 'General case' 0 N--CA 1.454 -0.226 0 CA-C-N 116.67 -0.241 . . . . 0.0 110.793 -178.993 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 77.2 mt -67.04 -49.44 65.19 Favored 'General case' 0 N--CA 1.452 -0.329 0 N-CA-C 109.682 -0.488 . . . . 0.0 109.682 174.967 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 47.8 m -53.67 -39.8 65.41 Favored 'General case' 0 C--O 1.232 0.173 0 C-N-CA 122.528 0.331 . . . . 0.0 110.98 -179.575 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 29.4 t0 -67.18 -41.39 86.01 Favored 'General case' 0 N--CA 1.451 -0.421 0 CA-C-O 120.916 0.389 . . . . 0.0 110.199 177.715 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -70.87 -36.96 73.04 Favored 'General case' 0 N--CA 1.449 -0.51 0 CA-C-N 116.287 -0.415 . . . . 0.0 111.316 -176.324 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 113' ' ' ILE . . . . . 0.44 ' O ' ' HE3' ' A' ' 121' ' ' LYS . 18.3 mm -68.99 -40.98 81.59 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.185 0 N-CA-C 109.441 -0.577 . . . . 0.0 109.441 179.898 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -69.63 -27.64 65.23 Favored 'General case' 0 N--CA 1.453 -0.282 0 N-CA-C 112.048 0.388 . . . . 0.0 112.048 -179.903 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -90.09 -38.17 13.73 Favored 'General case' 0 CA--C 1.529 0.139 0 N-CA-C 112.434 0.531 . . . . 0.0 112.434 -179.472 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 116' ' ' SER . . . . . 0.446 ' HB3' ' CB ' ' A' ' 120' ' ' HIS . 2.7 m -86.51 154.33 21.18 Favored 'General case' 0 CA--C 1.528 0.125 0 N-CA-C 112.227 0.454 . . . . 0.0 112.227 -170.307 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 49.1 t30 -77.72 170.56 16.38 Favored 'General case' 0 CA--C 1.531 0.229 0 C-N-CA 123.117 0.567 . . . . 0.0 111.302 -175.954 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 118' ' ' GLN . . . . . . . . . . . . . 20.8 mm100 -57.84 -34.05 69.3 Favored 'General case' 0 N--CA 1.457 -0.079 0 C-N-CA 123.237 0.615 . . . . 0.0 112.239 -173.631 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 9.5 p30 -70.39 -40.7 73.78 Favored 'General case' 0 N--CA 1.453 -0.29 0 N-CA-C 109.377 -0.601 . . . . 0.0 109.377 176.935 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 120' ' ' HIS . . . . . 0.446 ' CB ' ' HB3' ' A' ' 116' ' ' SER . 29.0 m170 -64.41 -39.47 93.91 Favored 'General case' 0 N--CA 1.45 -0.445 0 N-CA-C 109.746 -0.464 . . . . 0.0 109.746 176.486 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 121' ' ' LYS . . . . . 0.44 ' HE3' ' O ' ' A' ' 113' ' ' ILE . 64.5 mttp -59.73 -36.39 76.5 Favored 'General case' 0 C--N 1.342 0.257 0 N-CA-C 109.725 -0.472 . . . . 0.0 109.725 176.841 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 26.8 tt0 -65.74 -43.74 88.07 Favored 'General case' 0 N--CA 1.452 -0.341 0 C-N-CA 122.625 0.37 . . . . 0.0 110.651 -178.765 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 14.3 mptt -68.28 -30.02 68.94 Favored 'General case' 0 N--CA 1.457 -0.118 0 C-N-CA 120.486 -0.486 . . . . 0.0 110.221 -179.481 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 124' ' ' ILE . . . . . . . . . . . . . 67.6 mt -73.13 -39.64 57.12 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.365 0 N-CA-C 109.385 -0.598 . . . . 0.0 109.385 177.862 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 125' ' ' ARG . . . . . 0.426 ' HD2' ' HA ' ' A' ' 125' ' ' ARG . 8.1 mmm180 -61.54 -43.72 98.34 Favored 'General case' 0 N--CA 1.451 -0.416 0 CA-C-O 118.544 -0.741 . . . . 0.0 111.593 179.051 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 126' ' ' MET . . . . . . . . . . . . . 28.2 ptm -64.68 -38.93 92.67 Favored 'General case' 0 N--CA 1.454 -0.274 0 C-N-CA 118.77 -1.172 . . . . 0.0 108.897 177.816 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 4.2 mp -61.81 -44.08 97.57 Favored 'General case' 0 N--CA 1.455 -0.223 0 CA-C-N 118.076 0.398 . . . . 0.0 111.09 178.216 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 83.9 mt -65.36 -32.66 74.42 Favored 'General case' 0 N--CA 1.456 -0.145 0 CA-C-N 118.506 0.593 . . . . 0.0 111.465 -177.832 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 45.5 m-20 -75.63 -35.51 60.45 Favored 'General case' 0 N--CA 1.453 -0.31 0 CA-C-N 118.329 0.513 . . . . 0.0 109.863 177.011 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 66.9 mt -62.98 -33.3 59.84 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.25 0 N-CA-C 109.39 -0.596 . . . . 0.0 109.39 174.784 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 131' ' ' TRP . . . . . . . . . . . . . 43.0 m0 . . . . . 0 N--CA 1.452 -0.339 0 N-CA-C 112.164 0.431 . . . . 0.0 112.164 179.129 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 4.2 mpp? . . . . . 0 N--CA 1.475 0.786 0 CA-C-O 119.958 -0.067 . . . . 0.0 110.841 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 2.7 pm0 -136.17 -136.42 0.15 Allowed 'General case' 0 CA--C 1.532 0.263 0 N-CA-C 108.913 -0.773 . . . . 0.0 108.913 178.563 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 29.3 tp60 -75.96 45.25 0.34 Allowed 'General case' 0 CA--C 1.534 0.362 0 CA-C-O 121.262 0.553 . . . . 0.0 111.45 179.143 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 10.8 m-20 -83.86 -177.33 6.65 Favored 'General case' 0 N--CA 1.455 -0.192 0 C-N-CA 124.119 0.968 . . . . 0.0 110.603 177.696 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 29.8 p-10 -82.88 11.79 5.65 Favored 'General case' 0 N--CA 1.456 -0.136 0 CA-C-O 121.04 0.447 . . . . 0.0 110.48 174.999 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 30.6 p-10 -71.16 -28.92 64.6 Favored 'General case' 0 N--CA 1.453 -0.289 0 N-CA-C 108.762 -0.829 . . . . 0.0 108.762 179.248 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' PHE . . . . . 0.515 ' CD1' ' HD3' ' A' ' 45' ' ' LYS . 1.2 t80 -53.0 -36.37 60.38 Favored 'General case' 0 N--CA 1.447 -0.594 0 C-N-CA 124.982 1.313 . . . . 0.0 110.833 -178.263 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 51.5 tp60 -51.89 -35.27 44.67 Favored 'General case' 0 N--CA 1.454 -0.246 0 C-N-CA 123.978 0.911 . . . . 0.0 112.063 -176.947 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 31.1 m-80 -73.74 -33.48 64.34 Favored 'General case' 0 N--CA 1.453 -0.308 0 N-CA-C 110.076 -0.342 . . . . 0.0 110.076 -179.106 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' PHE . . . . . 0.426 ' CZ ' HG12 ' A' ' 46' ' ' ILE . 2.2 t80 -72.24 -36.45 69.1 Favored 'General case' 0 N--CA 1.452 -0.362 0 N-CA-C 108.896 -0.779 . . . . 0.0 108.896 177.298 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 95.7 t -68.0 -54.64 20.96 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.251 0 N-CA-C 108.81 -0.811 . . . . 0.0 108.81 178.157 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -58.67 -28.87 66.14 Favored 'General case' 0 N--CA 1.452 -0.329 0 N-CA-C 112.196 0.443 . . . . 0.0 112.196 -178.961 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 96.1 m -72.29 -41.99 66.02 Favored 'General case' 0 CA--C 1.532 0.268 0 N-CA-C 109.445 -0.576 . . . . 0.0 109.445 176.188 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.487 ' HA ' ' CD1' ' A' ' 17' ' ' PHE . 12.6 tp -62.98 -44.82 94.99 Favored 'General case' 0 N--CA 1.452 -0.329 0 N-CA-C 109.811 -0.44 . . . . 0.0 109.811 178.035 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 76.0 mm-40 -62.37 -32.1 72.84 Favored 'General case' 0 N--CA 1.45 -0.431 0 C-N-CA 124.588 1.155 . . . . 0.0 109.969 178.446 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 70.2 m -67.03 -29.58 69.43 Favored 'General case' 0 N--CA 1.453 -0.276 0 N-CA-C 109.726 -0.472 . . . . 0.0 109.726 177.473 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' PHE . . . . . 0.487 ' CD1' ' HA ' ' A' ' 14' ' ' LEU . 14.0 m-85 -69.11 -42.31 76.25 Favored 'General case' 0 N--CA 1.457 -0.109 0 C-N-CA 120.126 -0.629 . . . . 0.0 110.492 172.31 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 71.3 mttt -61.16 -27.6 68.52 Favored 'General case' 0 C--N 1.339 0.146 0 CA-C-O 120.583 0.23 . . . . 0.0 110.654 -177.389 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 42.3 t0 -73.56 -23.69 60.0 Favored 'General case' 0 CA--C 1.531 0.23 0 CA-C-N 115.866 -0.606 . . . . 0.0 112.245 -178.722 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . 0.404 ' C ' ' HE3' ' A' ' 21' ' ' LYS . 94.8 mt -79.16 159.86 27.23 Favored 'General case' 0 CA--C 1.528 0.126 0 O-C-N 121.836 -0.54 . . . . 0.0 110.858 -178.789 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . 0.49 ' H ' ' CG ' ' B' 2052 ' ' ASP . 0.0 OUTLIER -84.47 -34.95 23.3 Favored 'General case' 0 C--N 1.34 0.163 0 N-CA-C 109.415 -0.587 . . . . 0.0 109.415 176.027 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 83.9 p -82.02 -22.17 36.62 Favored 'General case' 0 C--N 1.34 0.187 0 C-N-CA 122.788 0.435 . . . . 0.0 111.017 177.937 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 71.59 -8.54 5.54 Favored Glycine 0 CA--C 1.529 0.921 0 C-N-CA 123.804 0.716 . . . . 0.0 112.889 179.282 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 44.9 mt -93.22 148.42 4.78 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.177 0 CA-C-N 117.751 0.776 . . . . 0.0 110.36 176.641 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 8.6 t -162.22 83.03 0.56 Allowed 'General case' 0 C--N 1.339 0.131 0 N-CA-C 109.543 -0.54 . . . . 0.0 109.543 -179.004 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -50.79 -44.9 49.13 Favored Glycine 0 CA--C 1.524 0.645 0 CA-C-O 118.725 -1.041 . . . . 0.0 115.067 -169.466 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 31.7 t -71.35 -42.05 68.98 Favored 'General case' 0 N--CA 1.455 -0.211 0 CA-C-N 119.945 1.872 . . . . 0.0 110.529 -177.469 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 80.4 mtt85 -66.68 -39.87 88.33 Favored 'General case' 0 N--CA 1.455 -0.208 0 N-CA-C 110.203 -0.295 . . . . 0.0 110.203 179.496 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 40.8 mt -55.98 -47.13 80.54 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.505 0 N-CA-C 108.254 -1.017 . . . . 0.0 108.254 174.815 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 78.8 mttt -65.7 -24.86 67.09 Favored 'General case' 0 C--N 1.34 0.172 0 CA-C-O 118.474 -0.774 . . . . 0.0 112.584 177.055 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . 0.528 ' HE3' ' HA ' ' A' ' 31' ' ' LYS . 0.0 OUTLIER -67.7 -56.1 10.61 Favored 'General case' 0 C--N 1.343 0.298 0 CA-C-N 119.704 1.138 . . . . 0.0 110.015 -179.915 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.454 HD12 ' N ' ' A' ' 33' ' ' THR . 2.4 pp -74.69 -19.18 60.36 Favored 'General case' 0 N--CA 1.455 -0.208 0 C-N-CA 119.201 -0.999 . . . . 0.0 111.101 -178.233 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . 0.454 ' N ' HD12 ' A' ' 32' ' ' LEU . 46.2 m -72.74 -37.38 67.74 Favored 'General case' 0 N--CA 1.456 -0.163 0 N-CA-C 109.239 -0.652 . . . . 0.0 109.239 176.404 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 96.0 m -74.69 -37.8 62.55 Favored 'General case' 0 N--CA 1.452 -0.344 0 CA-C-N 116.784 -0.189 . . . . 0.0 110.53 -178.398 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 57.7 t80 -69.93 -30.93 68.44 Favored 'General case' 0 N--CA 1.456 -0.162 0 C-N-CA 120.458 -0.497 . . . . 0.0 109.886 177.927 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -69.67 -33.26 72.32 Favored 'General case' 0 N--CA 1.45 -0.434 0 N-CA-C 110.097 -0.334 . . . . 0.0 110.097 176.293 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 20.6 mt -73.55 -40.77 63.7 Favored 'General case' 0 CA--C 1.52 -0.19 0 C-N-CA 122.743 0.417 . . . . 0.0 110.657 177.685 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 42.4 t0 -63.08 -24.54 67.95 Favored 'General case' 0 N--CA 1.455 -0.202 0 C-N-CA 122.814 0.446 . . . . 0.0 110.64 176.825 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 39' ' ' HIS . . . . . 0.408 ' HB2' HD11 ' A' ' 42' ' ' ILE . 94.8 m-70 -149.75 95.63 2.35 Favored 'General case' 0 N--CA 1.454 -0.239 0 C-N-CA 122.896 0.479 . . . . 0.0 111.622 -177.52 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 40' ' ' ILE . . . . . 0.63 ' H ' HD13 ' A' ' 40' ' ' ILE . 0.0 OUTLIER -72.21 -13.44 16.62 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.345 0 N-CA-C 109.958 -0.386 . . . . 0.0 109.958 174.25 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 18.6 m-20 -58.45 -19.94 40.93 Favored 'General case' 0 CA--C 1.529 0.172 0 C-N-CA 123.24 0.616 . . . . 0.0 112.409 -176.316 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . 0.408 HD11 ' HB2' ' A' ' 39' ' ' HIS . 0.0 OUTLIER -107.57 15.07 7.8 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.186 0 N-CA-C 112.109 0.411 . . . . 0.0 112.109 176.78 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 3.0 pp20? -51.46 -33.38 30.79 Favored 'General case' 0 C--O 1.224 -0.241 0 CA-C-N 118.864 0.757 . . . . 0.0 110.69 178.479 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 29.8 t -58.11 -50.28 74.02 Favored 'General case' 0 CA--C 1.534 0.357 0 O-C-N 122.366 -0.209 . . . . 0.0 111.257 -177.245 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . 0.515 ' HD3' ' CD1' ' A' ' 7' ' ' PHE . 18.6 ptpt -73.81 -27.87 61.34 Favored 'General case' 0 C--N 1.34 0.161 0 O-C-N 122.034 -0.416 . . . . 0.0 110.658 -179.906 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 46' ' ' ILE . . . . . 0.426 HG12 ' CZ ' ' A' ' 10' ' ' PHE . 86.5 mt -69.55 -48.13 67.82 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.377 0 C-N-CA 122.48 0.312 . . . . 0.0 110.181 -178.85 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 40.6 mm -64.14 -34.69 70.41 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.385 0 N-CA-C 108.95 -0.759 . . . . 0.0 108.95 179.18 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 28.4 t -63.73 -36.65 84.56 Favored 'General case' 0 N--CA 1.451 -0.401 0 C-N-CA 120.397 -0.521 . . . . 0.0 111.085 177.98 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 16.0 mt -73.4 -36.1 65.98 Favored 'General case' 0 N--CA 1.451 -0.387 0 N-CA-C 113.11 0.781 . . . . 0.0 113.11 -179.416 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . 0.432 HD12 HG12 ' A' ' 69' ' ' ILE . 7.7 pt -71.0 -41.25 76.87 Favored 'Isoleucine or valine' 0 C--O 1.226 -0.152 0 CA-C-N 119.311 0.96 . . . . 0.0 110.68 -178.244 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 20.0 pt -68.71 -38.67 79.21 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.191 0 C-N-CA 120.155 -0.618 . . . . 0.0 110.374 179.403 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 92.0 m-20 -72.26 -39.14 68.63 Favored 'General case' 0 N--CA 1.454 -0.245 0 O-C-N 121.944 -0.472 . . . . 0.0 111.586 178.893 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 29.0 t80 -65.32 -51.18 62.34 Favored 'General case' 0 N--CA 1.454 -0.253 0 N-CA-C 108.844 -0.798 . . . . 0.0 108.844 176.533 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 24.0 t -62.29 -31.92 72.57 Favored 'General case' 0 N--CA 1.455 -0.214 0 C-N-CA 122.427 0.291 . . . . 0.0 111.731 -173.988 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 74.3 mtm180 -79.93 -43.56 21.92 Favored 'General case' 0 N--CA 1.453 -0.297 0 O-C-N 121.92 -0.488 . . . . 0.0 112.197 -178.703 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 56.4 mt -81.93 -42.77 19.01 Favored 'General case' 0 N--CA 1.461 0.08 0 N-CA-C 113.163 0.801 . . . . 0.0 113.163 -175.159 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 57' ' ' CYS . . . . . 0.459 ' O ' ' HE2' ' A' ' 62' ' ' LYS . 14.0 p -60.48 159.19 25.32 Favored Pre-proline 0 CA--C 1.534 0.358 0 N-CA-C 114.064 1.135 . . . . 0.0 114.064 -172.529 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 31.3 Cg_exo -59.7 172.77 1.94 Allowed 'Trans proline' 0 N--CA 1.456 -0.709 1 C-N-CA 125.56 4.174 . . . . 0.0 113.198 175.751 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 27.6 p-10 -60.85 -42.37 97.67 Favored 'General case' 0 C--N 1.329 -0.305 0 C-N-CA 124.068 0.947 . . . . 0.0 112.535 -173.039 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 95.1 p -70.06 -36.44 74.99 Favored 'General case' 0 N--CA 1.455 -0.22 0 N-CA-C 109.541 -0.54 . . . . 0.0 109.541 179.345 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 71.4 m80 -69.98 -28.03 65.2 Favored 'General case' 0 N--CA 1.451 -0.413 0 N-CA-C 110.114 -0.328 . . . . 0.0 110.114 177.707 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . 0.459 ' HE2' ' O ' ' A' ' 57' ' ' CYS . 64.6 mttm -64.39 -41.51 96.62 Favored 'General case' 0 C--N 1.339 0.142 0 N-CA-C 109.151 -0.685 . . . . 0.0 109.151 173.069 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -59.68 -45.41 92.15 Favored 'General case' 0 CA--C 1.533 0.319 0 N-CA-C 108.693 -0.854 . . . . 0.0 108.693 176.423 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -69.09 -28.29 73.03 Favored Glycine 0 C--N 1.337 0.635 0 N-CA-C 111.755 -0.538 . . . . 0.0 111.755 -179.425 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 38.0 p -67.15 -36.27 81.46 Favored 'General case' 0 N--CA 1.453 -0.324 0 CA-C-N 117.837 0.819 . . . . 0.0 109.151 177.672 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 81.6 mt -75.42 -26.54 58.43 Favored 'General case' 0 N--CA 1.45 -0.464 0 CA-C-O 119.398 -0.334 . . . . 0.0 110.756 -179.242 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 6.9 m-30 -67.39 -39.14 85.59 Favored 'General case' 0 C--O 1.233 0.189 0 CA-C-N 118.055 0.389 . . . . 0.0 110.686 172.098 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 68' ' ' ILE . . . . . 0.434 HD11 ' CE1' ' A' ' 17' ' ' PHE . 19.7 mt -68.32 -50.85 53.51 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.643 0 N-CA-C 108.761 -0.829 . . . . 0.0 108.761 179.474 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 69' ' ' ILE . . . . . 0.432 HG12 HD12 ' A' ' 50' ' ' ILE . 88.5 mt -56.93 -34.87 45.37 Favored 'Isoleucine or valine' 0 C--N 1.34 0.156 0 C-N-CA 124.103 0.961 . . . . 0.0 111.328 178.223 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 11.9 t70 -69.44 -41.5 76.21 Favored 'General case' 0 N--CA 1.451 -0.407 0 CA-C-N 118.146 0.43 . . . . 0.0 110.588 177.377 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 19.4 m -71.65 -52.88 15.67 Favored 'General case' 0 N--CA 1.452 -0.356 0 CA-C-N 116.603 -0.271 . . . . 0.0 110.423 -175.893 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -75.17 -31.61 24.87 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.244 0 N-CA-C 110.165 -0.309 . . . . 0.0 110.165 -178.136 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -68.74 -56.01 10.34 Favored Glycine 0 C--N 1.336 0.565 0 N-CA-C 110.811 -0.916 . . . . 0.0 110.811 -176.379 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 39.6 mtm105 -65.62 -42.87 91.06 Favored 'General case' 0 N--CA 1.449 -0.511 0 C-N-CA 120.345 -0.542 . . . . 0.0 110.154 -179.475 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -64.17 -28.8 70.0 Favored 'General case' 0 N--CA 1.449 -0.484 0 C-N-CA 119.969 -0.692 . . . . 0.0 110.614 -177.139 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 2.0 m-30 -68.89 -47.31 66.18 Favored 'General case' 0 CA--C 1.518 -0.253 0 CA-C-N 118.738 0.699 . . . . 0.0 110.523 175.527 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 7.3 tt -67.29 -44.61 78.86 Favored 'General case' 0 N--CA 1.449 -0.491 0 C-N-CA 118.041 -1.464 . . . . 0.0 108.726 -179.336 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 72.3 m-20 -57.86 -48.51 79.59 Favored 'General case' 0 CA--C 1.53 0.177 0 N-CA-C 112.353 0.501 . . . . 0.0 112.353 178.922 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 15.4 tm-20 -62.98 -47.02 84.96 Favored 'General case' 0 N--CA 1.452 -0.353 0 CA-C-N 118.343 0.52 . . . . 0.0 110.886 -178.368 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 80' ' ' THR . . . . . 0.493 HG21 ' HB3' ' A' ' 94' ' ' CYS . 69.7 p -67.72 -32.78 73.65 Favored 'General case' 0 N--CA 1.454 -0.23 0 N-CA-C 110.152 -0.314 . . . . 0.0 110.152 179.523 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 33.9 ttp180 -66.56 -24.0 66.29 Favored 'General case' 0 N--CA 1.45 -0.447 0 C-N-CA 123.434 0.694 . . . . 0.0 110.939 174.891 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 35.1 t -98.85 -6.11 29.72 Favored 'General case' 0 CA--C 1.53 0.179 0 C-N-CA 123.63 0.772 . . . . 0.0 113.015 179.089 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 24.7 t-20 -141.55 170.94 14.77 Favored 'General case' 0 CA--C 1.531 0.246 0 CA-C-O 121.364 0.602 . . . . 0.0 112.42 -170.355 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 39.0 t -71.11 -0.6 9.99 Favored 'General case' 0 N--CA 1.456 -0.163 0 C-N-CA 123.257 0.623 . . . . 0.0 111.956 -179.518 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 78.3 m-20 -70.45 -6.5 36.29 Favored 'General case' 0 N--CA 1.452 -0.341 0 O-C-N 122.078 -0.389 . . . . 0.0 111.135 178.565 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 47.7 p -88.82 2.67 53.2 Favored 'General case' 0 CA--C 1.53 0.185 0 C-N-CA 122.901 0.48 . . . . 0.0 111.074 174.135 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 96.2 p -139.59 65.01 1.44 Allowed 'General case' 0 N--CA 1.454 -0.24 0 N-CA-C 109.692 -0.484 . . . . 0.0 109.692 179.244 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 34.1 t -148.11 -171.8 3.92 Favored 'General case' 0 CA--C 1.531 0.248 0 C-N-CA 123.659 0.784 . . . . 0.0 109.536 -178.024 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -53.96 148.82 9.94 Favored 'General case' 0 CA--C 1.529 0.148 0 C-N-CA 122.804 0.442 . . . . 0.0 111.438 -178.615 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 64.4 tttp -58.94 -65.03 2.24 Favored Pre-proline 0 CA--C 1.531 0.249 0 CA-C-O 118.156 -0.926 . . . . 0.0 111.17 -174.869 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 73.1 Cg_endo -69.63 146.35 60.68 Favored 'Trans proline' 0 N--CA 1.449 -1.143 0 N-CA-C 107.716 -1.686 . . . . 0.0 107.716 174.259 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 90.46 21.39 37.82 Favored Glycine 0 CA--C 1.523 0.563 0 CA-C-O 119.57 -0.572 . . . . 0.0 111.795 -179.091 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 41.5 p -151.62 173.84 14.18 Favored 'General case' 0 N--CA 1.454 -0.259 0 C-N-CA 123.884 0.873 . . . . 0.0 110.112 176.632 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 94' ' ' CYS . . . . . 0.493 ' HB3' HG21 ' A' ' 80' ' ' THR . 17.4 p -62.81 -21.65 66.06 Favored 'General case' 0 N--CA 1.448 -0.559 0 CA-C-N 115.741 -0.663 . . . . 0.0 109.526 175.737 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -59.92 -58.59 7.87 Favored 'General case' 0 N--CA 1.447 -0.596 0 N-CA-C 109.373 -0.603 . . . . 0.0 109.373 -176.916 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 75.0 t60 -74.58 -28.05 60.75 Favored 'General case' 0 N--CA 1.45 -0.451 0 N-CA-C 111.583 0.216 . . . . 0.0 111.583 -179.405 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -68.45 -52.52 31.63 Favored 'General case' 0 N--CA 1.452 -0.339 0 CA-C-N 116.662 -0.245 . . . . 0.0 110.785 -178.154 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 98' ' ' ILE . . . . . 0.454 HD13 ' HB2' ' A' ' 94' ' ' CYS . 2.3 mp -69.49 -27.64 34.89 Favored 'Isoleucine or valine' 0 C--N 1.339 0.141 0 C-N-CA 120.266 -0.573 . . . . 0.0 109.889 177.749 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 99' ' ' ASN . . . . . 0.409 HD22 ' C ' ' A' ' 99' ' ' ASN . 0.3 OUTLIER -65.99 -42.81 89.32 Favored 'General case' 0 N--CA 1.452 -0.347 0 CA-C-N 118.03 0.377 . . . . 0.0 110.822 176.554 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 86.5 m -66.53 -43.72 84.42 Favored 'General case' 0 CA--C 1.518 -0.272 0 N-CA-C 110.16 -0.311 . . . . 0.0 110.16 -176.818 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 90.6 mt -69.24 -30.6 68.77 Favored 'General case' 0 N--CA 1.45 -0.431 0 C-N-CA 120.903 -0.319 . . . . 0.0 110.408 179.293 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -61.46 -14.82 43.59 Favored Glycine 0 CA--C 1.528 0.852 0 CA-C-O 119.132 -0.816 . . . . 0.0 112.749 -177.31 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 22.8 mt-10 -107.65 -12.78 15.18 Favored 'General case' 0 C--N 1.339 0.145 0 CA-C-N 118.359 1.079 . . . . 0.0 112.701 -177.981 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 13.2 m -130.03 -4.0 2.72 Favored 'Isoleucine or valine' 0 N--CA 1.461 0.118 0 N-CA-C 113.203 0.816 . . . . 0.0 113.203 -175.311 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 105' ' ' ILE . . . . . . . . . . . . . 10.5 tp -59.14 -23.44 24.59 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.173 0 CA-C-N 119.159 0.89 . . . . 0.0 109.991 178.828 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 25.4 pt20 -65.96 -30.74 71.36 Favored 'General case' 0 N--CA 1.453 -0.3 0 C-N-CA 123.059 0.543 . . . . 0.0 110.27 177.088 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 69.7 mt-10 -75.03 -44.65 46.69 Favored 'General case' 0 N--CA 1.451 -0.403 0 N-CA-C 109.638 -0.505 . . . . 0.0 109.638 -179.563 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 8.3 mp -66.36 -49.53 66.58 Favored 'General case' 0 N--CA 1.452 -0.353 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.624 -176.438 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 8.8 mp -70.13 -54.23 13.85 Favored 'General case' 0 N--CA 1.45 -0.459 0 CA-C-O 119.22 -0.419 . . . . 0.0 110.595 -176.741 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 32.3 t -55.9 -41.84 75.1 Favored 'General case' 0 N--CA 1.455 -0.192 0 CA-C-N 118.461 0.573 . . . . 0.0 111.464 -175.626 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 45.8 t0 -68.58 -41.02 80.27 Favored 'General case' 0 N--CA 1.451 -0.396 0 N-CA-C 109.495 -0.557 . . . . 0.0 109.495 178.013 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -65.33 -35.02 79.71 Favored 'General case' 0 N--CA 1.446 -0.634 0 CA-C-O 119.345 -0.36 . . . . 0.0 110.849 -177.298 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 113' ' ' ILE . . . . . 0.451 ' O ' ' HE3' ' A' ' 121' ' ' LYS . 21.1 mm -68.4 -43.13 84.34 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.32 0 CA-C-N 118.714 0.688 . . . . 0.0 109.17 177.81 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -69.07 -32.76 72.45 Favored 'General case' 0 N--CA 1.451 -0.388 0 N-CA-C 112.178 0.436 . . . . 0.0 112.178 -179.845 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 115' ' ' LYS . . . . . 0.495 ' HZ2' ' N ' ' A' ' 115' ' ' LYS . 0.0 OUTLIER -85.12 -39.6 17.72 Favored 'General case' 0 C--N 1.34 0.153 0 N-CA-C 112.619 0.6 . . . . 0.0 112.619 -178.258 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 116' ' ' SER . . . . . 0.452 ' HB2' ' CB ' ' A' ' 120' ' ' HIS . 49.5 p -85.31 157.16 20.63 Favored 'General case' 0 N--CA 1.455 -0.221 0 N-CA-C 112.257 0.466 . . . . 0.0 112.257 -171.556 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 50.8 t30 -79.97 170.69 16.11 Favored 'General case' 0 N--CA 1.454 -0.237 0 C-N-CA 123.243 0.617 . . . . 0.0 111.102 -178.226 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 118' ' ' GLN . . . . . . . . . . . . . 16.0 mm100 -56.92 -35.98 69.66 Favored 'General case' 0 CA--C 1.527 0.064 0 C-N-CA 123.199 0.6 . . . . 0.0 112.542 -173.634 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 10.0 p-10 -68.93 -40.1 79.22 Favored 'General case' 0 N--CA 1.454 -0.242 0 N-CA-C 109.358 -0.608 . . . . 0.0 109.358 178.299 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 120' ' ' HIS . . . . . 0.452 ' CB ' ' HB2' ' A' ' 116' ' ' SER . 27.8 m170 -66.47 -39.38 88.76 Favored 'General case' 0 N--CA 1.452 -0.352 0 CA-C-N 116.376 -0.375 . . . . 0.0 110.091 176.819 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 121' ' ' LYS . . . . . 0.451 ' HE3' ' O ' ' A' ' 113' ' ' ILE . 64.6 mttp -57.88 -36.18 72.03 Favored 'General case' 0 C--N 1.34 0.158 0 N-CA-C 109.537 -0.542 . . . . 0.0 109.537 176.795 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 40.3 tp10 -72.63 -36.56 68.05 Favored 'General case' 0 N--CA 1.452 -0.349 0 CA-C-O 119.746 -0.168 . . . . 0.0 111.448 -179.902 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 35.6 mmtp -63.43 -39.42 94.43 Favored 'General case' 0 N--CA 1.457 -0.103 0 N-CA-C 109.23 -0.656 . . . . 0.0 109.23 177.738 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 124' ' ' ILE . . . . . . . . . . . . . 65.7 mt -66.9 -34.93 73.18 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.37 0 N-CA-C 108.62 -0.881 . . . . 0.0 108.62 178.211 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 125' ' ' ARG . . . . . 0.462 ' HD2' ' HA ' ' A' ' 125' ' ' ARG . 20.5 tpt85 -68.18 -41.76 80.95 Favored 'General case' 0 N--CA 1.441 -0.877 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.988 -174.993 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 126' ' ' MET . . . . . . . . . . . . . 26.8 ptm -66.7 -32.4 73.68 Favored 'General case' 0 N--CA 1.453 -0.291 0 N-CA-C 108.811 -0.811 . . . . 0.0 108.811 174.809 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 4.7 mp -63.13 -33.83 76.32 Favored 'General case' 0 CA--C 1.531 0.239 0 CA-C-O 118.75 -0.643 . . . . 0.0 110.683 174.852 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 39.5 mt -68.77 -40.94 79.44 Favored 'General case' 0 C--N 1.34 0.162 0 CA-C-N 119.507 1.048 . . . . 0.0 110.148 179.007 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 51.9 m-20 -63.7 -39.2 93.73 Favored 'General case' 0 CA--C 1.522 -0.116 0 C-N-CA 120.353 -0.539 . . . . 0.0 109.911 176.322 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 58.3 mt -64.24 -33.31 61.72 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.256 0 C-N-CA 123.029 0.531 . . . . 0.0 109.959 178.178 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 131' ' ' TRP . . . . . . . . . . . . . 45.9 m0 -75.35 -29.47 59.94 Favored 'General case' 0 N--CA 1.455 -0.188 0 N-CA-C 112.055 0.391 . . . . 0.0 112.055 176.379 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 71.5 m-20 -74.98 -24.08 58.38 Favored 'General case' 0 C--N 1.333 -0.121 0 CA-C-N 118.126 0.421 . . . . 0.0 110.547 176.043 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 3.7 mtt180 -75.44 -38.34 59.81 Favored 'General case' 0 N--CA 1.453 -0.315 0 C-N-CA 123.129 0.572 . . . . 0.0 110.325 173.919 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 34.1 t -75.74 -31.9 59.78 Favored 'General case' 0 N--CA 1.456 -0.154 0 C-N-CA 122.312 0.245 . . . . 0.0 111.377 178.651 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 135' ' ' GLY . . . . . . . . . . . . . . . 91.98 16.92 49.6 Favored Glycine 0 CA--C 1.529 0.949 0 CA-C-O 119.353 -0.693 . . . . 0.0 112.85 178.882 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 136' ' ' LEU . . . . . . . . . . . . . 33.3 mt -56.59 133.18 53.43 Favored 'General case' 0 C--N 1.339 0.122 0 CA-C-N 118.401 1.1 . . . . 0.0 109.498 177.02 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 137' ' ' PHE . . . . . . . . . . . . . 81.4 t80 -76.33 -6.79 53.09 Favored 'General case' 0 CA--C 1.533 0.292 0 N-CA-C 113.286 0.847 . . . . 0.0 113.286 -173.979 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 138' ' ' GLN . . . . . . . . . . . . . 16.7 pt20 -73.39 32.67 0.07 Allowed 'General case' 0 CA--C 1.537 0.457 0 C-N-CA 123.013 0.525 . . . . 0.0 112.24 -177.422 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 139' ' ' LYS . . . . . . . . . . . . . 49.0 mttm -78.35 46.8 0.65 Allowed 'General case' 0 C--N 1.338 0.101 0 C-N-CA 124.079 0.952 . . . . 0.0 112.46 -176.598 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 140' ' ' SER . . . . . . . . . . . . . 43.5 t -73.8 51.24 0.37 Allowed 'General case' 0 CA--C 1.533 0.3 0 C-N-CA 123.495 0.718 . . . . 0.0 110.199 177.251 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 141' ' ' TYR . . . . . . . . . . . . . 16.5 m-30 -72.47 45.21 0.13 Allowed 'General case' 0 CA--C 1.531 0.237 0 C-N-CA 125.571 1.549 . . . . 0.0 112.538 -175.918 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 142' ' ' LEU . . . . . . . . . . . . . 80.9 mt -66.9 172.61 4.24 Favored 'General case' 0 N--CA 1.455 -0.194 0 C-N-CA 123.836 0.854 . . . . 0.0 110.446 177.243 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 14.6 p30 -63.25 -19.29 64.42 Favored 'General case' 0 CA--C 1.533 0.29 0 O-C-N 122.106 -0.371 . . . . 0.0 111.379 -178.101 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . -63.92 -30.02 71.14 Favored 'General case' 0 N--CA 1.453 -0.313 0 N-CA-C 109.654 -0.498 . . . . 0.0 109.654 177.605 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 145' ' ' ILE . . . . . . . . . . . . . 33.3 mm -72.71 -25.73 22.84 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.406 0 C-N-CA 122.565 0.346 . . . . 0.0 110.37 177.398 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 146' ' ' ARG . . . . . . . . . . . . . 42.9 mmt-85 -73.59 -28.9 62.07 Favored 'General case' 0 N--CA 1.457 -0.105 0 N-CA-C 109.103 -0.703 . . . . 0.0 109.103 176.968 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 147' ' ' SER . . . . . . . . . . . . . 43.4 t 53.25 30.38 9.91 Favored 'General case' 0 C--N 1.34 0.188 0 C-N-CA 123.264 0.626 . . . . 0.0 112.254 173.64 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.58 -17.08 29.93 Favored 'General case' 0 CA--C 1.533 0.304 0 C-N-CA 123.404 0.682 . . . . 0.0 112.651 -177.994 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 149' ' ' CYS . . . . . . . . . . . . . 61.3 m -69.23 -51.15 40.54 Favored 'General case' 0 N--CA 1.456 -0.143 0 N-CA-C 109.38 -0.6 . . . . 0.0 109.38 179.014 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 150' ' ' PHE . . . . . . . . . . . . . 95.9 m-85 -70.43 -16.55 62.95 Favored 'General case' 0 N--CA 1.451 -0.416 0 N-CA-C 110.673 -0.121 . . . . 0.0 110.673 -179.988 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 151' ' ' ALA . . . . . . . . . . . . . . . -75.27 -36.49 61.22 Favored 'General case' 0 N--CA 1.452 -0.373 0 N-CA-C 109.839 -0.43 . . . . 0.0 109.839 174.777 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 152' ' ' MET . . . . . . . . . . . . . 71.6 mtm -75.81 -22.88 55.91 Favored 'General case' 0 CA--C 1.53 0.179 0 CA-C-N 117.562 0.165 . . . . 0.0 111.177 176.043 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 153' ' ' ASP . . . . . . . . . . . . . 62.1 m-20 -73.94 -4.79 37.27 Favored 'General case' 0 CA--C 1.529 0.162 0 C-N-CA 122.77 0.428 . . . . 0.0 111.945 176.492 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 154' ' ' LEU . . . . . . . . . . . . . 75.9 mt -130.72 161.65 31.2 Favored 'General case' 0 N--CA 1.455 -0.198 0 C-N-CA 123.023 0.529 . . . . 0.0 110.695 -177.721 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 155' ' ' GLU . . . . . . . . . . . . . 79.5 mm-40 -73.0 151.11 41.92 Favored 'General case' 0 N--CA 1.454 -0.231 0 CA-C-O 120.843 0.354 . . . . 0.0 110.693 178.333 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 156' ' ' HIS . . . . . . . . . . . . . 79.6 t60 -158.88 156.24 29.22 Favored 'General case' 0 N--CA 1.453 -0.282 0 C-N-CA 122.851 0.46 . . . . 0.0 109.86 179.272 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 157' ' ' HIS . . . . . . . . . . . . . 70.6 t60 -155.84 145.2 20.87 Favored 'General case' 0 N--CA 1.451 -0.412 0 N-CA-C 109.622 -0.51 . . . . 0.0 109.622 176.616 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 158' ' ' HIS . . . . . . . . . . . . . 0.9 OUTLIER -159.17 28.64 0.21 Allowed 'General case' 0 CA--C 1.53 0.179 0 C-N-CA 122.359 0.264 . . . . 0.0 110.826 -179.771 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 159' ' ' HIS . . . . . . . . . . . . . 42.2 p-80 . . . . . 0 C--O 1.25 1.131 0 CA-C-O 116.928 -1.511 . . . . 0.0 110.438 -175.752 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' B' B 2052 ' ' ASP . . . . . 0.49 ' CG ' ' H ' ' A' ' 21' ' ' LYS . 0.2 OUTLIER . . . . . 0 N--CA 1.475 0.81 0 N-CA-C 109.552 -0.536 . . . . 0.0 109.552 . . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B 2053 ' ' ASP . . . . . . . . . . . . . 32.3 t0 -83.46 175.29 9.92 Favored 'General case' 0 N--CA 1.453 -0.309 0 C-N-CA 124.795 1.238 . . . . 0.0 109.513 175.046 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B 2054 ' ' ASP . . . . . . . . . . . . . 43.6 t0 61.8 -173.3 0.14 Allowed 'General case' 0 CA--C 1.533 0.319 0 C-N-CA 123.571 0.748 . . . . 0.0 112.672 174.91 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B 2055 ' ' GLU . . . . . . . . . . . . . 93.9 mt-10 -66.14 68.1 0.05 Allowed 'General case' 0 N--CA 1.452 -0.347 0 C-N-CA 125.489 1.515 . . . . 0.0 109.267 173.0 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B 2056 ' ' ASP . . . . . . . . . . . . . 31.4 t0 -61.15 151.31 31.65 Favored 'General case' 0 N--CA 1.451 -0.386 0 C-N-CA 122.919 0.488 . . . . 0.0 110.141 178.788 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B 2057 ' ' ASP . . . . . . . . . . . . . 38.9 t0 48.76 51.55 15.59 Favored 'General case' 0 N--CA 1.454 -0.271 0 C-N-CA 123.766 0.826 . . . . 0.0 112.594 -174.609 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B 2058 ' ' TYR . . . . . . . . . . . . . 7.6 t80 -50.55 152.25 2.01 Favored 'General case' 0 CA--C 1.534 0.354 0 C-N-CA 123.813 0.845 . . . . 0.0 110.599 173.593 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B 2059 ' ' THR . . . . . . . . . . . . . 68.0 p -138.11 110.45 8.45 Favored Pre-proline 0 C--O 1.232 0.182 0 O-C-N 122.111 -0.368 . . . . 0.0 111.292 -177.979 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B 2060 ' ' PRO . . . . . . . . . . . . . 97.3 Cg_endo -74.52 161.18 40.4 Favored 'Trans proline' 0 N--CA 1.452 -0.953 0 C-N-CA 123.106 2.537 . . . . 0.0 108.937 169.82 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B 2061 ' ' SER . . . . . . . . . . . . . 97.8 p -158.62 154.49 26.59 Favored 'General case' 0 N--CA 1.455 -0.221 0 O-C-N 122.044 -0.41 . . . . 0.0 111.063 179.807 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B 2062 ' ' ILE . . . . . . . . . . . . . 56.1 mt -151.53 148.1 14.92 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.364 0 C-N-CA 124.995 1.318 . . . . 0.0 107.769 177.789 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B 2063 ' ' SER . . . . . . . . . . . . . 90.5 p . . . . . 0 C--O 1.252 1.19 0 CA-C-O 117.048 -1.453 . . . . 0.0 109.377 173.789 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 89.9 mmm . . . . . 0 N--CA 1.474 0.732 0 CA-C-O 120.471 0.177 . . . . 0.0 110.61 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 22.7 mp0 -144.71 -170.86 3.49 Favored 'General case' 0 CA--C 1.531 0.238 0 N-CA-C 108.693 -0.854 . . . . 0.0 108.693 -178.219 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 59.3 tt0 -60.87 -21.2 63.03 Favored 'General case' 0 CA--C 1.528 0.128 0 N-CA-C 109.718 -0.475 . . . . 0.0 109.718 175.198 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 8.8 p30 -150.15 125.07 9.88 Favored 'General case' 0 N--CA 1.448 -0.527 0 C-N-CA 124.728 1.211 . . . . 0.0 108.347 173.819 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 85.1 m-20 -81.97 17.98 1.44 Allowed 'General case' 0 N--CA 1.455 -0.176 0 N-CA-C 114.019 1.118 . . . . 0.0 114.019 -173.538 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 16.0 p-10 -80.94 -34.03 33.57 Favored 'General case' 0 C--N 1.331 -0.219 0 N-CA-C 106.692 -1.596 . . . . 0.0 106.692 171.467 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' PHE . . . . . 0.503 ' CD1' ' HD3' ' A' ' 45' ' ' LYS . 1.1 t80 -63.01 -32.45 73.82 Favored 'General case' 0 N--CA 1.444 -0.764 0 C-N-CA 125.063 1.345 . . . . 0.0 110.141 -179.662 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 58.2 tp60 -48.38 -39.49 22.52 Favored 'General case' 0 N--CA 1.454 -0.229 0 C-N-CA 124.322 1.049 . . . . 0.0 111.765 -177.948 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 16.2 m-80 -71.75 -35.17 70.02 Favored 'General case' 0 N--CA 1.455 -0.177 0 N-CA-C 110.145 -0.317 . . . . 0.0 110.145 -178.261 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 1.7 t80 -72.29 -38.97 68.64 Favored 'General case' 0 N--CA 1.449 -0.483 0 C-N-CA 123.731 0.812 . . . . 0.0 109.514 178.148 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 93.0 t -66.24 -52.1 51.52 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.271 0 N-CA-C 108.608 -0.886 . . . . 0.0 108.608 178.601 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -60.36 -29.27 68.8 Favored 'General case' 0 N--CA 1.452 -0.367 0 C-N-CA 122.665 0.386 . . . . 0.0 111.848 179.902 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 59.8 m -73.96 -36.62 64.61 Favored 'General case' 0 CA--C 1.53 0.207 0 N-CA-C 109.055 -0.72 . . . . 0.0 109.055 176.484 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.529 ' HA ' ' CD1' ' A' ' 17' ' ' PHE . 4.8 tp -66.57 -46.53 75.71 Favored 'General case' 0 N--CA 1.453 -0.287 0 CA-C-O 121.284 0.564 . . . . 0.0 109.776 177.899 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 67.8 mm-40 -62.01 -28.09 69.33 Favored 'General case' 0 N--CA 1.447 -0.579 0 C-N-CA 124.167 0.987 . . . . 0.0 109.189 178.485 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 48.2 t -70.99 -28.5 64.48 Favored 'General case' 0 N--CA 1.449 -0.517 0 CA-C-N 116.109 -0.496 . . . . 0.0 109.856 177.31 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' PHE . . . . . 0.529 ' CD1' ' HA ' ' A' ' 14' ' ' LEU . 19.4 m-85 -72.42 -35.55 68.39 Favored 'General case' 0 N--CA 1.455 -0.19 0 CA-C-N 118.584 0.629 . . . . 0.0 110.951 171.161 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . 0.464 ' HA ' ' CE1' ' A' ' 61' ' ' HIS . 84.7 mttt -62.93 -26.47 68.83 Favored 'General case' 0 C--N 1.339 0.132 0 N-CA-C 109.643 -0.503 . . . . 0.0 109.643 177.521 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 43.6 t0 -76.71 -15.28 59.82 Favored 'General case' 0 CA--C 1.537 0.478 0 CA-C-N 115.17 -0.923 . . . . 0.0 111.837 176.348 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 87.8 mt -86.06 144.68 27.43 Favored 'General case' 0 N--CA 1.45 -0.432 0 O-C-N 121.243 -0.91 . . . . 0.0 111.276 -179.143 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . 0.582 ' H ' ' HE2' ' A' ' 21' ' ' LYS . 1.6 mppt? -83.51 15.04 3.29 Favored 'General case' 0 CA--C 1.531 0.219 0 CA-C-N 115.116 -0.947 . . . . 0.0 108.849 177.316 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 86.0 p -141.73 -26.05 0.68 Allowed 'General case' 0 N--CA 1.454 -0.263 0 C-N-CA 124.735 1.214 . . . . 0.0 111.796 -175.416 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 75.83 -15.46 4.98 Favored Glycine 0 CA--C 1.526 0.731 0 C-N-CA 123.804 0.716 . . . . 0.0 113.141 175.965 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 81.5 mt -97.07 147.07 6.63 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.383 0 C-N-CA 123.395 0.678 . . . . 0.0 109.904 176.948 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 41.4 t -166.03 99.1 0.64 Allowed 'General case' 0 N--CA 1.455 -0.213 0 N-CA-C 109.055 -0.721 . . . . 0.0 109.055 171.296 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -55.2 -48.71 66.93 Favored Glycine 0 CA--C 1.523 0.544 0 CA-C-O 119.428 -0.651 . . . . 0.0 112.591 -172.65 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . 0.434 ' HA ' ' HE3' ' A' ' 30' ' ' LYS . 16.5 m -63.05 -43.17 99.37 Favored 'General case' 0 N--CA 1.454 -0.251 0 CA-C-N 118.546 1.173 . . . . 0.0 111.08 -177.346 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 81.2 mtt180 -69.55 -42.31 74.77 Favored 'General case' 0 N--CA 1.457 -0.11 0 C-N-CA 122.509 0.324 . . . . 0.0 110.507 -179.888 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 62.6 mt -58.11 -41.78 81.47 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.616 0 N-CA-C 108.467 -0.938 . . . . 0.0 108.467 175.29 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . 0.434 ' HE3' ' HA ' ' A' ' 27' ' ' SER . 46.9 mtmt -69.37 -22.11 63.75 Favored 'General case' 0 N--CA 1.456 -0.171 0 CA-C-O 118.427 -0.797 . . . . 0.0 111.979 177.853 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . 0.574 ' HA ' ' HE2' ' A' ' 31' ' ' LYS . 8.3 mmpt? -67.1 -56.6 9.34 Favored 'General case' 0 C--N 1.34 0.172 0 CA-C-N 119.621 1.1 . . . . 0.0 109.295 175.352 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 4.6 pp -70.88 -25.73 62.92 Favored 'General case' 0 CA--C 1.528 0.107 0 C-N-CA 120.121 -0.632 . . . . 0.0 110.914 -177.603 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 60.4 m -71.72 -35.61 70.24 Favored 'General case' 0 N--CA 1.457 -0.103 0 N-CA-C 109.94 -0.392 . . . . 0.0 109.94 178.855 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 76.2 m -73.41 -37.33 65.97 Favored 'General case' 0 N--CA 1.454 -0.236 0 N-CA-C 110.414 -0.217 . . . . 0.0 110.414 -178.251 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 42.8 t80 -68.43 -33.22 73.81 Favored 'General case' 0 N--CA 1.457 -0.089 0 C-N-CA 119.852 -0.739 . . . . 0.0 110.087 176.619 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -69.4 -33.6 73.25 Favored 'General case' 0 N--CA 1.448 -0.567 0 CA-C-O 119.775 -0.155 . . . . 0.0 110.617 177.951 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 16.7 mt -73.14 -39.48 65.66 Favored 'General case' 0 N--CA 1.455 -0.209 0 C-N-CA 122.513 0.325 . . . . 0.0 110.684 177.919 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 44.3 t0 -63.61 -26.24 68.59 Favored 'General case' 0 N--CA 1.452 -0.356 0 C-N-CA 122.267 0.227 . . . . 0.0 110.78 176.39 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 39' ' ' HIS . . . . . 0.424 ' HB2' HD11 ' A' ' 42' ' ' ILE . 97.1 m-70 -149.38 99.84 2.95 Favored 'General case' 0 N--CA 1.454 -0.261 0 C-N-CA 122.658 0.383 . . . . 0.0 111.476 -177.028 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 40' ' ' ILE . . . . . 0.6 ' H ' HD13 ' A' ' 40' ' ' ILE . 0.0 OUTLIER -75.39 -19.26 15.97 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.485 0 CA-C-O 118.844 -0.598 . . . . 0.0 110.79 178.0 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 71.1 m-20 -62.21 -9.16 6.97 Favored 'General case' 0 CA--C 1.531 0.212 0 N-CA-C 113.455 0.909 . . . . 0.0 113.455 -175.567 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . 0.424 HD11 ' HB2' ' A' ' 39' ' ' HIS . 0.0 OUTLIER -110.4 13.9 8.52 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.168 0 CA-C-N 118.187 0.449 . . . . 0.0 111.655 173.447 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 3.1 pp20? -52.89 -33.4 49.95 Favored 'General case' 0 CA--C 1.529 0.143 0 O-C-N 121.507 -0.746 . . . . 0.0 111.306 177.61 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 3.3 m -64.9 -40.69 95.47 Favored 'General case' 0 CA--C 1.533 0.304 0 CA-C-O 119.053 -0.499 . . . . 0.0 111.911 -176.369 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . 0.503 ' HD3' ' CD1' ' A' ' 7' ' ' PHE . 15.3 ptpt -73.17 -27.06 61.43 Favored 'General case' 0 C--N 1.341 0.236 0 CA-C-N 119.346 0.975 . . . . 0.0 109.51 176.803 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 78.7 mt -72.34 -47.15 54.03 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.396 0 C-N-CA 122.715 0.406 . . . . 0.0 110.036 -177.427 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 42.2 mm -65.24 -38.16 81.93 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.203 0 N-CA-C 109.658 -0.497 . . . . 0.0 109.658 179.41 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 37.6 t -65.7 -32.49 74.07 Favored 'General case' 0 N--CA 1.455 -0.192 0 C-N-CA 120.38 -0.528 . . . . 0.0 110.478 177.513 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . 0.497 HD22 ' CE1' ' A' ' 7' ' ' PHE . 29.4 tp -75.87 -32.71 59.84 Favored 'General case' 0 N--CA 1.452 -0.364 0 N-CA-C 112.691 0.626 . . . . 0.0 112.691 -177.061 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . 0.405 HD12 HG12 ' A' ' 69' ' ' ILE . 11.6 pt -73.97 -38.5 49.74 Favored 'Isoleucine or valine' 0 C--N 1.338 0.098 0 CA-C-N 118.995 0.816 . . . . 0.0 110.956 177.819 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 46.9 pt -66.31 -37.06 78.86 Favored 'Isoleucine or valine' 0 C--O 1.227 -0.084 0 C-N-CA 119.484 -0.886 . . . . 0.0 109.991 178.351 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 95.1 m-20 -67.39 -36.91 82.27 Favored 'General case' 0 N--CA 1.454 -0.263 0 CA-C-N 117.559 0.163 . . . . 0.0 111.113 176.415 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 53' ' ' TYR . . . . . 0.411 ' CE1' ' HB3' ' A' ' 61' ' ' HIS . 18.5 t80 -67.67 -36.55 80.91 Favored 'General case' 0 C--O 1.226 -0.154 0 N-CA-C 109.908 -0.404 . . . . 0.0 109.908 176.172 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 15.2 m -75.59 -22.3 57.06 Favored 'General case' 0 N--CA 1.452 -0.352 0 C-N-CA 122.503 0.321 . . . . 0.0 111.532 -178.464 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 28.9 ttp-105 -86.69 -47.01 9.51 Favored 'General case' 0 N--CA 1.455 -0.199 0 N-CA-C 112.666 0.617 . . . . 0.0 112.666 -177.354 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 46.7 mt -84.95 -47.19 10.52 Favored 'General case' 0 N--CA 1.455 -0.196 0 N-CA-C 112.728 0.64 . . . . 0.0 112.728 -174.242 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 57' ' ' CYS . . . . . 0.542 ' HB3' ' HD2' ' A' ' 58' ' ' PRO . 59.5 m -74.62 160.01 81.99 Favored Pre-proline 0 CA--C 1.534 0.338 0 C-N-CA 122.97 0.508 . . . . 0.0 112.176 -173.573 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 58' ' ' PRO . . . . . 0.542 ' HD2' ' HB3' ' A' ' 57' ' ' CYS . 68.0 Cg_endo -79.01 -176.17 3.14 Favored 'Trans proline' 0 N--CA 1.455 -0.775 0 C-N-CA 125.174 3.916 . . . . 0.0 112.252 -170.073 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 59' ' ' ASP . . . . . 0.458 ' HB2' ' HA ' ' A' ' 116' ' ' SER . 26.0 p-10 -51.15 -50.13 59.5 Favored 'General case' 0 N--CA 1.457 -0.083 0 C-N-CA 124.605 1.162 . . . . 0.0 113.439 -172.837 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 24.5 m -66.18 -33.75 76.48 Favored 'General case' 0 N--CA 1.453 -0.309 0 N-CA-C 109.881 -0.415 . . . . 0.0 109.881 -175.405 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 61' ' ' HIS . . . . . 0.464 ' CE1' ' HA ' ' A' ' 18' ' ' LYS . 33.6 m170 -75.92 -27.44 57.64 Favored 'General case' 0 N--CA 1.451 -0.42 0 N-CA-C 110.051 -0.351 . . . . 0.0 110.051 179.283 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . 0.408 ' HB3' ' HE3' ' A' ' 62' ' ' LYS . 29.4 mtpp -73.58 -34.83 65.29 Favored 'General case' 0 C--N 1.339 0.115 0 N-CA-C 110.008 -0.367 . . . . 0.0 110.008 174.48 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -62.85 -43.77 97.91 Favored 'General case' 0 CA--C 1.535 0.402 0 N-CA-C 107.733 -1.21 . . . . 0.0 107.733 175.894 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -70.01 -24.74 76.31 Favored Glycine 0 C--N 1.34 0.751 0 CA-C-N 116.032 -0.531 . . . . 0.0 111.78 179.071 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 42.9 t -69.29 -37.44 77.83 Favored 'General case' 0 N--CA 1.452 -0.348 0 CA-C-N 117.972 0.886 . . . . 0.0 109.707 175.546 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 77.0 mt -72.96 -25.05 60.88 Favored 'General case' 0 N--CA 1.451 -0.412 0 CA-C-O 119.41 -0.329 . . . . 0.0 110.341 178.789 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 3.1 m-30 -70.23 -37.43 74.98 Favored 'General case' 0 CA--C 1.52 -0.204 0 CA-C-N 118.078 0.399 . . . . 0.0 110.5 171.016 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 68' ' ' ILE . . . . . 0.501 HD11 ' CE1' ' A' ' 17' ' ' PHE . 32.2 mt -67.4 -52.94 36.73 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.6 0 N-CA-C 108.389 -0.967 . . . . 0.0 108.389 178.189 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 69' ' ' ILE . . . . . 0.405 HG12 HD12 ' A' ' 50' ' ' ILE . 71.6 mt -52.86 -35.42 21.78 Favored 'Isoleucine or valine' 0 C--N 1.339 0.145 0 C-N-CA 123.6 0.76 . . . . 0.0 111.6 175.88 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 18.4 t70 -69.61 -41.2 76.0 Favored 'General case' 0 C--N 1.333 -0.113 0 CA-C-N 118.538 0.608 . . . . 0.0 110.73 177.907 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 20.2 m -70.66 -56.5 6.29 Favored 'General case' 0 N--CA 1.45 -0.439 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.251 -176.509 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 72' ' ' ILE . . . . . 0.462 HD11 ' CZ ' ' A' ' 76' ' ' TYR . 0.0 OUTLIER -75.01 -29.89 22.73 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.247 0 N-CA-C 110.077 -0.342 . . . . 0.0 110.077 -176.85 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -69.72 -56.72 7.97 Favored Glycine 0 C--N 1.336 0.562 0 N-CA-C 111.533 -0.627 . . . . 0.0 111.533 -176.421 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 39.7 mtm105 -68.94 -38.46 79.5 Favored 'General case' 0 N--CA 1.453 -0.288 0 CA-C-N 117.48 0.64 . . . . 0.0 110.309 -179.395 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -64.36 -29.47 70.54 Favored 'General case' 0 N--CA 1.45 -0.449 0 C-N-CA 119.6 -0.84 . . . . 0.0 110.468 -179.219 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 76' ' ' TYR . . . . . 0.462 ' CZ ' HD11 ' A' ' 72' ' ' ILE . 2.1 m-30 -71.78 -46.36 58.57 Favored 'General case' 0 N--CA 1.455 -0.203 0 CA-C-N 118.427 0.558 . . . . 0.0 110.847 176.65 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -65.07 -41.21 95.3 Favored 'General case' 0 N--CA 1.45 -0.432 0 C-N-CA 118.427 -1.309 . . . . 0.0 107.896 -178.357 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 94.3 m-20 -65.55 -42.54 91.76 Favored 'General case' 0 C--O 1.23 0.064 0 N-CA-C 113.377 0.88 . . . . 0.0 113.377 178.161 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 15.5 tm-20 -64.29 -41.86 96.68 Favored 'General case' 0 N--CA 1.448 -0.541 0 CA-C-N 118.45 0.568 . . . . 0.0 110.746 178.322 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 80' ' ' THR . . . . . 0.45 HG21 ' HB3' ' A' ' 94' ' ' CYS . 71.5 p -74.36 -21.34 59.72 Favored 'General case' 0 N--CA 1.456 -0.146 0 CA-C-O 119.783 -0.151 . . . . 0.0 111.057 -179.737 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 64.6 mtt180 -68.35 -36.81 79.8 Favored 'General case' 0 CA--C 1.526 0.054 0 N-CA-C 109.835 -0.432 . . . . 0.0 109.835 169.124 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 35.4 t -88.37 -8.45 55.04 Favored 'General case' 0 N--CA 1.457 -0.105 0 C-N-CA 123.958 0.903 . . . . 0.0 113.226 -176.19 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 33.8 t-20 -130.59 156.32 45.06 Favored 'General case' 0 N--CA 1.456 -0.154 0 CA-C-N 118.047 0.385 . . . . 0.0 111.346 -171.767 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 37.7 t -82.09 7.87 12.29 Favored 'General case' 0 N--CA 1.452 -0.345 0 C-N-CA 123.464 0.706 . . . . 0.0 111.895 -177.985 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 48.2 p30 -77.11 1.47 18.07 Favored 'General case' 0 CA--C 1.533 0.303 0 C-N-CA 122.69 0.396 . . . . 0.0 111.754 -179.733 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 41.4 t -55.88 145.23 25.4 Favored 'General case' 0 N--CA 1.456 -0.171 0 CA-C-O 120.594 0.235 . . . . 0.0 110.531 -179.634 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 67.5 m -152.98 -179.93 8.11 Favored 'General case' 0 N--CA 1.456 -0.154 0 C-N-CA 123.305 0.642 . . . . 0.0 109.955 -174.405 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 79.0 p -148.52 -2.72 0.49 Allowed 'General case' 0 N--CA 1.454 -0.252 0 N-CA-C 111.959 0.355 . . . . 0.0 111.959 178.724 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 10.7 m120 -147.96 32.02 0.85 Allowed 'General case' 0 CA--C 1.531 0.215 0 C-N-CA 122.655 0.382 . . . . 0.0 111.216 -174.932 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 49.4 tttm -142.4 127.69 10.35 Favored Pre-proline 0 CA--C 1.53 0.197 0 CA-C-O 119.282 -0.39 . . . . 0.0 111.398 -176.356 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 71.9 Cg_endo -71.97 143.0 39.79 Favored 'Trans proline' 0 N--CA 1.451 -1.012 0 C-N-CA 122.869 2.38 . . . . 0.0 106.435 168.657 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 92' ' ' GLY . . . . . 0.449 ' HA2' ' O ' ' A' ' 40' ' ' ILE . . . 105.98 24.98 6.66 Favored Glycine 0 CA--C 1.527 0.81 0 C-N-CA 120.386 -0.911 . . . . 0.0 112.436 -172.902 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 37.9 p -153.94 171.93 18.22 Favored 'General case' 0 CA--C 1.522 -0.121 0 CA-C-N 117.908 0.854 . . . . 0.0 109.951 177.09 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 94' ' ' CYS . . . . . 0.454 ' HB2' HD13 ' A' ' 98' ' ' ILE . 19.6 p -62.24 -22.46 65.99 Favored 'General case' 0 N--CA 1.448 -0.541 0 N-CA-C 109.183 -0.673 . . . . 0.0 109.183 176.381 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -63.16 -58.03 8.59 Favored 'General case' 0 N--CA 1.445 -0.691 0 N-CA-C 109.352 -0.61 . . . . 0.0 109.352 -175.609 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 65.2 t60 -71.51 -33.38 69.16 Favored 'General case' 0 N--CA 1.45 -0.459 0 N-CA-C 110.228 -0.286 . . . . 0.0 110.228 -179.973 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -65.88 -53.95 32.96 Favored 'General case' 0 N--CA 1.448 -0.537 0 CA-C-O 119.831 -0.128 . . . . 0.0 111.104 -176.741 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 98' ' ' ILE . . . . . 0.454 HD13 ' HB2' ' A' ' 94' ' ' CYS . 2.5 mp -70.29 -29.57 39.78 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.336 0 C-N-CA 120.474 -0.49 . . . . 0.0 110.926 -178.375 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 13.4 m-80 -70.45 -38.15 74.44 Favored 'General case' 0 N--CA 1.456 -0.165 0 CA-C-N 118.737 0.698 . . . . 0.0 111.522 176.53 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 89.2 m -67.18 -31.93 72.66 Favored 'General case' 0 CA--C 1.519 -0.221 0 N-CA-C 109.577 -0.527 . . . . 0.0 109.577 179.528 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 83.5 mt -72.22 -42.15 66.05 Favored 'General case' 0 N--CA 1.446 -0.656 0 N-CA-C 109.124 -0.695 . . . . 0.0 109.124 174.874 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -59.38 -14.66 28.0 Favored Glycine 0 CA--C 1.526 0.76 0 CA-C-O 119.155 -0.803 . . . . 0.0 112.849 -177.392 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 21.6 pt-20 -104.28 -2.93 24.91 Favored 'General case' 0 CA--C 1.533 0.289 0 CA-C-N 118.557 1.178 . . . . 0.0 113.502 -177.56 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 34.9 m -143.58 -7.6 0.27 Allowed 'Isoleucine or valine' 0 N--CA 1.466 0.325 0 CA-C-N 118.977 0.808 . . . . 0.0 113.133 176.557 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 105' ' ' ILE . . . . . . . . . . . . . 10.8 tp -64.39 -24.87 36.64 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.169 0 CA-C-N 118.741 0.7 . . . . 0.0 111.018 -176.339 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 106' ' ' GLN . . . . . 0.405 ' HA ' ' CD1' ' A' ' 145' ' ' ILE . 23.0 pt20 -69.72 -40.36 76.28 Favored 'General case' 0 N--CA 1.452 -0.33 0 CA-C-O 119.557 -0.258 . . . . 0.0 111.299 -175.591 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 76.4 mm-40 -80.1 -24.97 40.2 Favored 'General case' 0 N--CA 1.453 -0.313 0 CA-C-N 118.401 0.546 . . . . 0.0 110.8 175.958 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 9.1 tt -68.2 -41.62 81.1 Favored 'General case' 0 N--CA 1.452 -0.337 0 N-CA-C 108.908 -0.775 . . . . 0.0 108.908 177.195 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 55.6 mt -68.91 -52.25 31.42 Favored 'General case' 0 N--CA 1.453 -0.298 0 N-CA-C 109.016 -0.735 . . . . 0.0 109.016 174.893 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 34.5 t -42.28 -48.67 5.02 Favored 'General case' 0 C--O 1.234 0.24 0 C-N-CA 123.455 0.702 . . . . 0.0 112.527 175.333 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 35.6 t0 -67.8 -41.25 83.46 Favored 'General case' 0 N--CA 1.455 -0.224 0 N-CA-C 109.937 -0.394 . . . . 0.0 109.937 179.26 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -67.69 -32.94 73.95 Favored 'General case' 0 N--CA 1.446 -0.674 0 C-N-CA 120.848 -0.341 . . . . 0.0 110.794 -176.981 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 113' ' ' ILE . . . . . . . . . . . . . 40.9 mm -70.21 -38.82 75.8 Favored 'Isoleucine or valine' 0 C--N 1.339 0.144 0 CA-C-N 118.474 0.579 . . . . 0.0 109.941 178.766 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -74.27 -47.73 33.09 Favored 'General case' 0 N--CA 1.453 -0.322 0 N-CA-C 111.469 0.174 . . . . 0.0 111.469 179.792 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 115' ' ' LYS . . . . . 0.408 ' HE3' ' HB2' ' A' ' 115' ' ' LYS . 30.4 ttmt -76.98 -30.83 56.14 Favored 'General case' 0 N--CA 1.452 -0.331 0 C-N-CA 124.262 1.025 . . . . 0.0 113.619 -172.492 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 116' ' ' SER . . . . . 0.458 ' HA ' ' HB2' ' A' ' 59' ' ' ASP . 1.5 m -90.05 150.57 22.04 Favored 'General case' 0 CA--C 1.528 0.134 0 CA-C-N 118.177 0.444 . . . . 0.0 111.383 -174.185 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 19.1 t30 -71.21 169.31 15.42 Favored 'General case' 0 C--O 1.225 -0.213 0 C-N-CA 122.802 0.441 . . . . 0.0 110.685 -174.2 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 118' ' ' GLN . . . . . . . . . . . . . 17.1 mt-30 -55.39 -36.23 66.17 Favored 'General case' 0 CA--C 1.528 0.103 0 N-CA-C 111.947 0.351 . . . . 0.0 111.947 -173.616 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -66.59 -34.29 77.56 Favored 'General case' 0 N--CA 1.456 -0.14 0 N-CA-C 109.64 -0.504 . . . . 0.0 109.64 178.331 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 120' ' ' HIS . . . . . 0.455 ' CB ' ' HB3' ' A' ' 116' ' ' SER . 19.4 m170 -75.48 -41.3 55.86 Favored 'General case' 0 N--CA 1.448 -0.549 0 N-CA-C 109.178 -0.675 . . . . 0.0 109.178 179.07 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 49.4 mttm -54.75 -43.6 72.86 Favored 'General case' 0 N--CA 1.456 -0.165 0 N-CA-C 108.824 -0.806 . . . . 0.0 108.824 177.2 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 39.1 tp10 -66.17 -41.81 89.82 Favored 'General case' 0 N--CA 1.454 -0.266 0 CA-C-O 119.62 -0.228 . . . . 0.0 110.633 -179.269 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 88.9 mttt -66.6 -28.64 68.66 Favored 'General case' 0 N--CA 1.452 -0.342 0 C-N-CA 119.721 -0.792 . . . . 0.0 111.112 178.801 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 124' ' ' ILE . . . . . . . . . . . . . 58.1 mt -72.27 -38.22 61.1 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.198 0 CA-C-N 118.52 0.6 . . . . 0.0 109.897 177.906 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 27.9 mmt180 -64.62 -40.37 95.36 Favored 'General case' 0 N--CA 1.455 -0.216 0 O-C-N 121.887 -0.508 . . . . 0.0 110.819 -179.744 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 126' ' ' MET . . . . . . . . . . . . . 28.3 ptm -71.8 -30.69 65.79 Favored 'General case' 0 CA--C 1.528 0.117 0 C-N-CA 120.181 -0.608 . . . . 0.0 110.827 -179.648 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 66.7 mt -64.74 -35.85 82.4 Favored 'General case' 0 N--CA 1.456 -0.128 0 CA-C-N 118.392 0.542 . . . . 0.0 110.103 175.347 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 95.4 mt -69.4 -35.74 76.07 Favored 'General case' 0 CA--C 1.529 0.159 0 CA-C-N 118.193 0.451 . . . . 0.0 110.64 178.12 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 14.9 t0 -63.29 -44.52 94.8 Favored 'General case' 0 N--CA 1.456 -0.172 0 N-CA-C 109.367 -0.605 . . . . 0.0 109.367 176.368 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 65.4 mt -60.93 -34.27 58.95 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.251 0 N-CA-C 109.993 -0.373 . . . . 0.0 109.993 -179.981 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 131' ' ' TRP . . . . . . . . . . . . . 43.4 m0 -75.31 -33.1 61.13 Favored 'General case' 0 N--CA 1.452 -0.334 0 C-N-CA 120.057 -0.657 . . . . 0.0 112.617 -179.271 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 94.2 m-20 -74.64 -27.42 60.43 Favored 'General case' 0 N--CA 1.454 -0.25 0 CA-C-N 118.352 0.524 . . . . 0.0 111.171 178.651 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 133' ' ' ARG . . . . . 0.509 HH21 ' C ' ' B' 2063 ' ' SER . 13.4 mtp180 -72.58 -35.74 68.01 Favored 'General case' 0 N--CA 1.456 -0.154 0 N-CA-C 109.097 -0.705 . . . . 0.0 109.097 174.557 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 38.1 t -76.88 -14.62 59.86 Favored 'General case' 0 CA--C 1.533 0.317 0 C-N-CA 122.969 0.508 . . . . 0.0 111.138 176.856 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 135' ' ' GLY . . . . . . . . . . . . . . . 82.64 16.14 71.53 Favored Glycine 0 CA--C 1.53 0.992 0 CA-C-O 118.929 -0.928 . . . . 0.0 114.579 172.659 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 136' ' ' LEU . . . . . . . . . . . . . 9.4 mp -70.99 168.19 17.57 Favored 'General case' 0 CA--C 1.537 0.46 0 CA-C-N 119.16 1.48 . . . . 0.0 110.42 178.931 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 137' ' ' PHE . . . . . . . . . . . . . 8.4 m-30 -83.55 12.34 5.82 Favored 'General case' 0 CA--C 1.533 0.317 0 N-CA-C 115.636 1.717 . . . . 0.0 115.636 -169.103 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 138' ' ' GLN . . . . . . . . . . . . . 27.2 mp0 -73.07 31.88 0.07 Allowed 'General case' 0 CA--C 1.537 0.459 0 CA-C-N 120.231 1.378 . . . . 0.0 112.384 178.866 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 139' ' ' LYS . . . . . . . . . . . . . 45.9 mmtm -73.8 15.96 0.25 Allowed 'General case' 0 CA--C 1.532 0.271 0 C-N-CA 124.384 1.073 . . . . 0.0 112.403 -177.894 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 140' ' ' SER . . . . . 0.402 ' C ' ' H ' ' A' ' 142' ' ' LEU . 95.8 p -75.35 63.31 1.4 Allowed 'General case' 0 N--CA 1.455 -0.198 0 C-N-CA 123.97 0.908 . . . . 0.0 110.406 179.007 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 141' ' ' TYR . . . . . . . . . . . . . 42.7 m-85 -67.23 27.52 0.02 OUTLIER 'General case' 0 CA--C 1.533 0.311 0 C-N-CA 124.267 1.027 . . . . 0.0 113.312 -179.583 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 142' ' ' LEU . . . . . 0.402 ' H ' ' C ' ' A' ' 140' ' ' SER . 76.1 mt -70.13 168.22 16.09 Favored 'General case' 0 N--CA 1.451 -0.39 0 CA-C-N 118.045 0.384 . . . . 0.0 110.553 -178.316 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 4.3 m120 -57.58 -15.05 6.27 Favored 'General case' 0 C--O 1.231 0.129 0 C-N-CA 123.055 0.542 . . . . 0.0 111.36 179.609 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . -61.45 -40.66 95.31 Favored 'General case' 0 N--CA 1.449 -0.513 0 N-CA-C 109.328 -0.619 . . . . 0.0 109.328 177.101 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 145' ' ' ILE . . . . . 0.405 ' CD1' ' HA ' ' A' ' 106' ' ' GLN . 17.3 mm -75.55 -24.1 16.99 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.219 0 CA-C-N 118.234 0.47 . . . . 0.0 110.393 -178.273 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 146' ' ' ARG . . . . . 0.402 HH21 ' CE1' ' A' ' 157' ' ' HIS . 16.9 tpt180 -74.71 -14.82 60.78 Favored 'General case' 0 N--CA 1.455 -0.223 0 N-CA-C 109.17 -0.678 . . . . 0.0 109.17 171.717 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 147' ' ' SER . . . . . . . . . . . . . 25.2 t 61.87 72.12 0.52 Allowed 'General case' 0 N--CA 1.452 -0.358 0 C-N-CA 125.351 1.46 . . . . 0.0 110.822 178.699 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 148' ' ' LYS . . . . . 0.623 ' HD3' ' H ' ' A' ' 148' ' ' LYS . 0.0 OUTLIER -46.99 -26.43 1.01 Allowed 'General case' 0 N--CA 1.452 -0.355 0 CA-C-N 114.532 -1.213 . . . . 0.0 111.861 174.282 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 149' ' ' CYS . . . . . . . . . . . . . 50.5 t -69.6 -48.96 58.31 Favored 'General case' 0 N--CA 1.452 -0.332 0 N-CA-C 109.291 -0.633 . . . . 0.0 109.291 179.04 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 150' ' ' PHE . . . . . . . . . . . . . 33.2 t80 -63.94 -28.82 70.08 Favored 'General case' 0 N--CA 1.453 -0.302 0 N-CA-C 110.449 -0.204 . . . . 0.0 110.449 -178.074 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 151' ' ' ALA . . . . . . . . . . . . . . . -75.64 -27.32 58.35 Favored 'General case' 0 N--CA 1.452 -0.374 0 C-N-CA 122.692 0.397 . . . . 0.0 111.226 177.545 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 152' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER -83.05 -27.17 30.49 Favored 'General case' 0 N--CA 1.455 -0.179 0 O-C-N 122.233 -0.292 . . . . 0.0 110.43 173.85 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 153' ' ' ASP . . . . . . . . . . . . . 69.0 m-20 -74.58 -44.2 51.99 Favored 'General case' 0 N--CA 1.454 -0.253 0 C-N-CA 123.024 0.529 . . . . 0.0 111.022 178.175 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 154' ' ' LEU . . . . . . . . . . . . . 47.4 mt -143.82 155.77 44.25 Favored 'General case' 0 C--N 1.339 0.124 0 C-N-CA 123.886 0.874 . . . . 0.0 110.59 -179.457 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 155' ' ' GLU . . . . . . . . . . . . . 37.3 mp0 -75.14 13.78 0.65 Allowed 'General case' 0 CA--C 1.531 0.217 0 C-N-CA 123.667 0.787 . . . . 0.0 111.73 -179.905 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 156' ' ' HIS . . . . . . . . . . . . . 39.9 m170 -68.59 137.66 54.44 Favored 'General case' 0 N--CA 1.454 -0.27 0 CA-C-O 121.003 0.43 . . . . 0.0 112.004 -175.487 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 157' ' ' HIS . . . . . 0.402 ' CE1' HH21 ' A' ' 146' ' ' ARG . 85.9 t60 -143.67 1.88 1.2 Allowed 'General case' 0 CA--C 1.529 0.143 0 C-N-CA 123.66 0.784 . . . . 0.0 110.534 178.457 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 158' ' ' HIS . . . . . . . . . . . . . 40.7 p-80 -79.59 40.43 0.44 Allowed 'General case' 0 CA--C 1.53 0.211 0 C-N-CA 123.873 0.869 . . . . 0.0 110.396 178.068 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 159' ' ' HIS . . . . . . . . . . . . . 32.0 p80 . . . . . 0 C--O 1.249 1.037 0 CA-C-O 117.558 -1.21 . . . . 0.0 109.721 -176.631 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' B' B 2052 ' ' ASP . . . . . 0.445 ' HA ' ' OD1' ' B' 2056 ' ' ASP . 1.5 m-20 . . . . . 0 N--CA 1.471 0.615 0 CA-C-O 119.397 -0.335 . . . . 0.0 110.248 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B 2053 ' ' ASP . . . . . . . . . . . . . 5.7 m-20 -118.72 -28.8 5.54 Favored 'General case' 0 CA--C 1.531 0.218 0 O-C-N 123.344 0.402 . . . . 0.0 111.219 -178.662 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B 2054 ' ' ASP . . . . . . . . . . . . . 67.7 t0 -166.47 89.31 0.38 Allowed 'General case' 0 CA--C 1.53 0.205 0 CA-C-N 118.092 0.405 . . . . 0.0 110.851 -177.965 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B 2055 ' ' GLU . . . . . . . . . . . . . 68.1 tt0 53.34 45.51 28.28 Favored 'General case' 0 CA--C 1.531 0.243 0 C-N-CA 123.731 0.812 . . . . 0.0 111.766 177.113 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B 2056 ' ' ASP . . . . . 0.445 ' OD1' ' HA ' ' B' 2052 ' ' ASP . 1.0 OUTLIER -66.1 16.15 0.03 OUTLIER 'General case' 0 CA--C 1.534 0.365 0 N-CA-C 114.769 1.396 . . . . 0.0 114.769 -175.98 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B 2057 ' ' ASP . . . . . . . . . . . . . 27.3 t0 -153.04 65.71 0.78 Allowed 'General case' 0 N--CA 1.455 -0.205 0 CA-C-N 119.385 0.993 . . . . 0.0 111.723 175.252 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B 2058 ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -52.33 124.96 14.58 Favored 'General case' 0 N--CA 1.453 -0.293 0 N-CA-C 108.435 -0.95 . . . . 0.0 108.435 173.467 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B 2059 ' ' THR . . . . . . . . . . . . . 55.1 m -108.75 110.02 61.2 Favored Pre-proline 0 N--CA 1.453 -0.315 0 N-CA-C 109.214 -0.662 . . . . 0.0 109.214 -177.881 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B 2060 ' ' PRO . . . . . . . . . . . . . 31.6 Cg_exo -61.52 166.81 10.83 Favored 'Trans proline' 0 N--CA 1.452 -0.955 0 C-N-CA 123.574 2.85 . . . . 0.0 112.155 177.51 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B 2061 ' ' SER . . . . . . . . . . . . . 72.4 m -147.72 134.21 19.73 Favored 'General case' 0 N--CA 1.452 -0.352 0 N-CA-C 107.844 -1.169 . . . . 0.0 107.844 175.19 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B 2062 ' ' ILE . . . . . . . . . . . . . 19.0 tt -163.06 152.65 3.16 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.219 0 CA-C-O 120.492 0.187 . . . . 0.0 110.599 -176.256 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B 2063 ' ' SER . . . . . 0.509 ' C ' HH21 ' A' ' 133' ' ' ARG . 40.8 m . . . . . 0 C--O 1.247 0.972 0 CA-C-O 116.917 -1.516 . . . . 0.0 109.703 175.846 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 4.0 mpp? . . . . . 0 N--CA 1.472 0.632 0 N-CA-C 110.078 -0.341 . . . . 0.0 110.078 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 4.4 pm0 -152.16 -28.04 0.17 Allowed 'General case' 0 N--CA 1.454 -0.262 0 CA-C-N 116.846 -0.161 . . . . 0.0 111.289 179.955 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . 0.444 ' C ' ' H ' ' A' ' 5' ' ' ASP . 46.7 tp60 -157.01 24.41 0.31 Allowed 'General case' 0 N--CA 1.454 -0.253 0 CA-C-O 121.739 0.78 . . . . 0.0 108.919 178.205 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' ASP . . . . . 0.408 ' N ' ' OD1' ' A' ' 4' ' ' ASP . 0.1 OUTLIER -75.31 29.58 0.1 Allowed 'General case' 0 N--CA 1.454 -0.24 0 C-N-CA 125.377 1.471 . . . . 0.0 110.684 -178.247 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . 0.444 ' H ' ' C ' ' A' ' 3' ' ' GLN . 48.0 m-20 57.85 18.55 5.03 Favored 'General case' 0 N--CA 1.455 -0.191 0 C-N-CA 125.167 1.387 . . . . 0.0 110.378 -168.291 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 20.7 p-10 -78.61 -26.65 45.41 Favored 'General case' 0 N--CA 1.449 -0.488 0 CA-C-N 115.196 -0.911 . . . . 0.0 108.928 175.806 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' PHE . . . . . 0.474 ' CD1' ' HD3' ' A' ' 45' ' ' LYS . 1.5 t80 -49.73 -39.6 37.87 Favored 'General case' 0 N--CA 1.456 -0.145 0 C-N-CA 124.028 0.931 . . . . 0.0 110.089 177.416 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 50.8 tp60 -51.79 -34.63 40.67 Favored 'General case' 0 N--CA 1.455 -0.189 0 C-N-CA 124.061 0.944 . . . . 0.0 111.919 -177.183 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 30.7 m-80 -74.2 -30.7 62.33 Favored 'General case' 0 N--CA 1.451 -0.394 0 N-CA-C 109.916 -0.401 . . . . 0.0 109.916 -179.175 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' PHE . . . . . 0.42 ' CE2' ' HB2' ' A' ' 32' ' ' LEU . 3.2 t80 -71.04 -38.99 72.53 Favored 'General case' 0 N--CA 1.451 -0.414 0 N-CA-C 109.125 -0.695 . . . . 0.0 109.125 176.221 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 65.2 t -64.69 -56.47 15.85 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.307 0 N-CA-C 108.948 -0.76 . . . . 0.0 108.948 178.409 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -59.49 -27.17 65.89 Favored 'General case' 0 N--CA 1.451 -0.393 0 C-N-CA 123.109 0.564 . . . . 0.0 112.247 -179.933 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 81.8 m -73.38 -41.4 63.42 Favored 'General case' 0 N--CA 1.456 -0.162 0 CA-C-N 118.785 0.721 . . . . 0.0 109.262 177.163 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.498 ' HA ' ' CD1' ' A' ' 17' ' ' PHE . 11.8 tp -64.06 -48.0 77.94 Favored 'General case' 0 N--CA 1.452 -0.345 0 CA-C-O 121.357 0.599 . . . . 0.0 109.643 177.728 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 61.7 mm-40 -62.33 -30.48 71.19 Favored 'General case' 0 N--CA 1.452 -0.359 0 C-N-CA 124.209 1.003 . . . . 0.0 109.886 179.303 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 31.4 t -67.84 -31.42 71.24 Favored 'General case' 0 N--CA 1.45 -0.458 0 CA-C-O 119.011 -0.519 . . . . 0.0 110.033 177.476 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' PHE . . . . . 0.498 ' CD1' ' HA ' ' A' ' 14' ' ' LEU . 13.8 m-85 -67.85 -39.91 83.74 Favored 'General case' 0 C--N 1.339 0.132 0 CA-C-N 118.495 0.589 . . . . 0.0 110.439 172.999 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . 0.442 ' HG2' ' CE1' ' A' ' 53' ' ' TYR . 65.8 mttt -64.8 -27.88 69.19 Favored 'General case' 0 C--N 1.338 0.106 0 CA-C-O 120.468 0.175 . . . . 0.0 110.864 -178.008 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 36.3 t0 -75.29 -14.72 60.52 Favored 'General case' 0 CA--C 1.533 0.293 0 C-N-CA 123.634 0.774 . . . . 0.0 112.186 179.865 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 48.7 mt -77.12 168.84 19.39 Favored 'General case' 0 N--CA 1.457 -0.124 0 O-C-N 121.714 -0.616 . . . . 0.0 111.758 -178.992 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 8.3 mtmp? -99.41 -27.19 13.86 Favored 'General case' 0 N--CA 1.455 -0.215 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.049 174.698 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 80.7 p -90.56 -25.33 20.27 Favored 'General case' 0 CA--C 1.529 0.167 0 C-N-CA 122.913 0.485 . . . . 0.0 110.597 176.03 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 77.47 -22.28 2.7 Favored Glycine 0 CA--C 1.529 0.93 0 C-N-CA 123.631 0.634 . . . . 0.0 113.793 176.155 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 66.6 mt -84.72 151.86 3.76 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.215 0 CA-C-N 118.086 0.943 . . . . 0.0 108.912 172.927 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 5.1 t -159.09 79.84 0.76 Allowed 'General case' 0 N--CA 1.453 -0.312 0 CA-C-N 118.46 0.573 . . . . 0.0 110.895 -179.52 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . 0.442 ' O ' ' HE2' ' A' ' 30' ' ' LYS . . . -47.11 -51.22 14.56 Favored Glycine 0 CA--C 1.524 0.606 0 CA-C-O 118.932 -0.927 . . . . 0.0 114.059 -171.954 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 14.6 m -63.98 -49.04 74.04 Favored 'General case' 0 CA--C 1.52 -0.19 0 CA-C-N 119.044 1.422 . . . . 0.0 110.647 -175.511 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 15.2 mtm180 -70.38 -34.04 72.11 Favored 'General case' 0 C--O 1.234 0.26 0 CA-C-O 119.704 -0.189 . . . . 0.0 111.128 -176.737 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' ILE . . . . . 0.41 HG12 ' CG1' ' A' ' 68' ' ' ILE . 54.4 mt -58.73 -45.84 90.89 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.592 0 N-CA-C 108.006 -1.109 . . . . 0.0 108.006 173.133 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . 0.442 ' HE2' ' O ' ' A' ' 26' ' ' GLY . 53.1 mtmt -67.25 -23.6 65.72 Favored 'General case' 0 CA--C 1.529 0.166 0 CA-C-O 118.776 -0.63 . . . . 0.0 111.592 178.579 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . 0.593 ' HA ' ' HE2' ' A' ' 31' ' ' LYS . 8.4 mmpt? -67.85 -58.39 4.66 Favored 'General case' 0 C--N 1.342 0.25 0 CA-C-N 119.218 0.917 . . . . 0.0 110.595 178.047 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.467 HD12 ' N ' ' A' ' 33' ' ' THR . 1.8 pp -74.94 -17.32 60.58 Favored 'General case' 0 CA--C 1.531 0.247 0 C-N-CA 119.286 -0.966 . . . . 0.0 111.552 -177.329 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . 0.467 ' N ' HD12 ' A' ' 32' ' ' LEU . 54.2 m -74.44 -38.13 63.1 Favored 'General case' 0 N--CA 1.455 -0.225 0 N-CA-C 109.509 -0.552 . . . . 0.0 109.509 177.211 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 98.4 m -73.15 -38.07 66.37 Favored 'General case' 0 N--CA 1.45 -0.46 0 N-CA-C 110.153 -0.314 . . . . 0.0 110.153 -178.555 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 27.3 t80 -64.23 -37.08 86.21 Favored 'General case' 0 N--CA 1.456 -0.149 0 N-CA-C 109.942 -0.392 . . . . 0.0 109.942 175.997 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -72.03 -38.63 69.51 Favored 'General case' 0 N--CA 1.448 -0.529 0 CA-C-O 119.462 -0.304 . . . . 0.0 111.429 178.081 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 9.9 mt -67.71 -36.1 80.0 Favored 'General case' 0 C--O 1.231 0.1 0 CA-C-N 118.217 0.462 . . . . 0.0 110.796 -179.757 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 42.6 t0 -71.0 -20.03 62.46 Favored 'General case' 0 N--CA 1.453 -0.291 0 C-N-CA 122.451 0.3 . . . . 0.0 111.358 177.199 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 39' ' ' HIS . . . . . 0.403 ' HB2' HD11 ' A' ' 42' ' ' ILE . 97.9 m-70 -148.69 97.74 2.77 Favored 'General case' 0 C--N 1.339 0.125 0 C-N-CA 122.852 0.461 . . . . 0.0 111.34 -175.036 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 40' ' ' ILE . . . . . 0.61 ' H ' HD13 ' A' ' 40' ' ' ILE . 0.0 OUTLIER -76.02 -12.29 14.42 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.454 0 C-N-CA 123.205 0.602 . . . . 0.0 110.866 176.551 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 19.7 m-20 -58.56 -21.11 51.73 Favored 'General case' 0 C--N 1.339 0.111 0 C-N-CA 122.925 0.49 . . . . 0.0 112.295 -176.793 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . 0.403 HD11 ' HB2' ' A' ' 39' ' ' HIS . 0.0 OUTLIER -104.1 12.93 7.61 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.208 0 C-N-CA 123.104 0.562 . . . . 0.0 112.211 178.353 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 2.9 pp20? -50.37 -33.32 20.09 Favored 'General case' 0 CA--C 1.53 0.21 0 CA-C-N 118.587 0.631 . . . . 0.0 111.766 -179.764 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 39.5 t -62.05 -49.93 74.01 Favored 'General case' 0 C--O 1.233 0.184 0 N-CA-C 111.912 0.338 . . . . 0.0 111.912 -178.047 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . 0.474 ' HD3' ' CD1' ' A' ' 7' ' ' PHE . 18.8 ptpt -70.98 -28.18 64.26 Favored 'General case' 0 C--N 1.339 0.128 0 O-C-N 121.85 -0.531 . . . . 0.0 109.778 -179.531 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 46' ' ' ILE . . . . . 0.414 HG12 ' CZ ' ' A' ' 10' ' ' PHE . 88.1 mt -68.7 -45.03 81.92 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.205 0 N-CA-C 110.049 -0.352 . . . . 0.0 110.049 -178.559 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 30.5 mm -62.72 -36.58 75.97 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.257 0 N-CA-C 109.024 -0.732 . . . . 0.0 109.024 177.309 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 39.4 t -64.63 -31.74 73.1 Favored 'General case' 0 CA--C 1.531 0.224 0 C-N-CA 120.984 -0.286 . . . . 0.0 111.729 179.023 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 6.7 mp -80.04 -31.97 39.5 Favored 'General case' 0 N--CA 1.451 -0.409 0 N-CA-C 113.265 0.839 . . . . 0.0 113.265 -179.698 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 12.5 pt -72.32 -38.46 61.45 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.207 0 CA-C-N 119.874 1.215 . . . . 0.0 110.708 177.558 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 24.4 pt -68.62 -35.22 69.13 Favored 'Isoleucine or valine' 0 CA--C 1.528 0.115 0 C-N-CA 120.336 -0.545 . . . . 0.0 110.032 176.981 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 21.0 t70 -59.3 -53.25 60.39 Favored 'General case' 0 C--N 1.339 0.134 0 CA-C-N 118.417 0.553 . . . . 0.0 110.053 174.858 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 53' ' ' TYR . . . . . 0.442 ' CE1' ' HG2' ' A' ' 18' ' ' LYS . 8.5 t80 -61.63 -44.53 96.81 Favored 'General case' 0 N--CA 1.451 -0.422 0 N-CA-C 109.836 -0.431 . . . . 0.0 109.836 -177.323 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 15.5 m -71.14 -23.03 62.0 Favored 'General case' 0 N--CA 1.453 -0.305 0 N-CA-C 112.196 0.443 . . . . 0.0 112.196 -175.264 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 18.4 tpp180 -84.11 -38.33 20.88 Favored 'General case' 0 N--CA 1.455 -0.216 0 CA-C-N 118.219 0.463 . . . . 0.0 110.642 179.359 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 95.9 mt -85.01 -50.01 7.82 Favored 'General case' 0 N--CA 1.452 -0.333 0 N-CA-C 113.188 0.81 . . . . 0.0 113.188 -175.884 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 5.8 p -66.33 153.87 91.71 Favored Pre-proline 0 CA--C 1.534 0.358 0 N-CA-C 113.647 0.981 . . . . 0.0 113.647 -170.39 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 67.8 Cg_endo -76.87 -170.72 0.96 Allowed 'Trans proline' 0 N--CA 1.455 -0.741 0 C-N-CA 124.837 3.691 . . . . 0.0 111.474 178.866 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 23.6 p-10 -53.82 -60.0 3.89 Favored 'General case' 0 CA--C 1.53 0.189 0 N-CA-C 114.55 1.315 . . . . 0.0 114.55 -170.732 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 22.6 t -67.64 -32.48 73.21 Favored 'General case' 0 N--CA 1.456 -0.134 0 CA-C-N 118.038 0.381 . . . . 0.0 110.947 -173.679 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 39.4 m80 -72.46 -26.55 61.86 Favored 'General case' 0 N--CA 1.453 -0.279 0 N-CA-C 110.035 -0.357 . . . . 0.0 110.035 177.131 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 17.1 ttmt -75.59 -28.52 58.96 Favored 'General case' 0 N--CA 1.451 -0.391 0 N-CA-C 110.113 -0.328 . . . . 0.0 110.113 177.041 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -65.05 -44.36 89.3 Favored 'General case' 0 N--CA 1.454 -0.227 0 N-CA-C 107.479 -1.304 . . . . 0.0 107.479 172.312 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -68.93 -25.3 75.42 Favored Glycine 0 C--N 1.34 0.758 0 N-CA-C 111.398 -0.681 . . . . 0.0 111.398 178.532 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 22.8 t -72.97 -40.32 65.42 Favored 'General case' 0 N--CA 1.452 -0.352 0 CA-C-N 117.782 0.791 . . . . 0.0 109.977 175.843 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 60.0 mt -68.57 -27.39 66.03 Favored 'General case' 0 N--CA 1.452 -0.342 0 N-CA-C 109.813 -0.44 . . . . 0.0 109.813 177.892 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 3.0 m-30 -66.01 -41.39 91.05 Favored 'General case' 0 CA--C 1.518 -0.269 0 N-CA-C 109.918 -0.401 . . . . 0.0 109.918 171.839 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 68' ' ' ILE . . . . . 0.41 ' CG1' HG12 ' A' ' 29' ' ' ILE . 21.0 mt -67.24 -45.32 86.49 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.585 0 N-CA-C 109.261 -0.644 . . . . 0.0 109.261 178.539 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 86.9 mt -58.87 -36.01 59.2 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.321 0 C-N-CA 123.273 0.629 . . . . 0.0 111.62 178.595 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 28.2 t70 -72.58 -40.82 66.29 Favored 'General case' 0 CA--C 1.517 -0.302 0 CA-C-N 119.015 0.825 . . . . 0.0 109.309 174.007 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 42.3 m -59.58 -66.63 0.48 Allowed 'General case' 0 N--CA 1.448 -0.547 0 N-CA-C 108.926 -0.768 . . . . 0.0 108.926 -178.36 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 72' ' ' ILE . . . . . 0.461 HD11 ' CZ ' ' A' ' 76' ' ' TYR . 0.0 OUTLIER -73.98 -44.4 50.86 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.363 0 CA-C-N 117.845 0.293 . . . . 0.0 111.014 -176.372 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -72.22 -49.8 19.55 Favored Glycine 0 CA--C 1.521 0.446 0 N-CA-C 112.418 -0.273 . . . . 0.0 112.418 -171.207 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 7.8 tmm_? -79.38 -30.26 42.46 Favored 'General case' 0 N--CA 1.445 -0.711 0 C-N-CA 119.814 -0.754 . . . . 0.0 110.256 -176.95 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -70.36 -25.54 63.32 Favored 'General case' 0 C--N 1.342 0.268 0 C-N-CA 118.646 -1.222 . . . . 0.0 109.795 173.458 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 76' ' ' TYR . . . . . 0.461 ' CZ ' HD11 ' A' ' 72' ' ' ILE . 1.4 m-30 -64.84 -49.3 71.15 Favored 'General case' 0 CA--C 1.515 -0.373 0 CA-C-N 118.75 0.704 . . . . 0.0 109.811 175.023 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . 0.462 HD13 ' O ' ' A' ' 77' ' ' LEU . 2.2 tm? -66.2 -43.95 85.33 Favored 'General case' 0 N--CA 1.447 -0.587 0 C-N-CA 118.219 -1.393 . . . . 0.0 108.711 -178.892 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 88.2 m-20 -59.3 -46.27 89.02 Favored 'General case' 0 CA--C 1.529 0.171 0 N-CA-C 112.318 0.488 . . . . 0.0 112.318 178.895 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 15.1 tm-20 -67.44 -48.89 65.91 Favored 'General case' 0 N--CA 1.45 -0.428 0 CA-C-N 118.34 0.518 . . . . 0.0 112.034 -178.081 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 64.4 p -64.57 -26.98 68.65 Favored 'General case' 0 N--CA 1.456 -0.147 0 CA-C-N 117.709 0.232 . . . . 0.0 111.312 179.965 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 11.9 ttm105 -75.5 -30.73 59.94 Favored 'General case' 0 N--CA 1.451 -0.392 0 CA-C-N 117.757 0.253 . . . . 0.0 110.341 175.383 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 35.3 t -80.45 -38.01 30.83 Favored 'General case' 0 N--CA 1.455 -0.207 0 N-CA-C 112.408 0.521 . . . . 0.0 112.408 179.702 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 9.1 m-20 -134.06 147.87 50.97 Favored 'General case' 0 N--CA 1.454 -0.227 0 CA-C-O 120.742 0.306 . . . . 0.0 111.732 -170.405 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 77.9 p -86.29 119.8 26.95 Favored 'General case' 0 N--CA 1.454 -0.274 0 N-CA-C 109.72 -0.474 . . . . 0.0 109.72 177.719 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 22.9 p30 -156.55 26.58 0.34 Allowed 'General case' 0 N--CA 1.456 -0.16 0 C-N-CA 122.928 0.491 . . . . 0.0 110.662 179.964 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 20.9 m -60.76 144.34 52.59 Favored 'General case' 0 N--CA 1.452 -0.326 0 C-N-CA 122.719 0.407 . . . . 0.0 112.067 -175.05 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 90.6 p -78.32 172.98 12.8 Favored 'General case' 0 N--CA 1.451 -0.386 0 C-N-CA 123.475 0.71 . . . . 0.0 110.146 177.624 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 67.7 p -76.68 2.89 12.89 Favored 'General case' 0 CA--C 1.53 0.204 0 C-N-CA 123.389 0.676 . . . . 0.0 112.293 179.509 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 10.4 m120 -147.8 179.62 7.57 Favored 'General case' 0 N--CA 1.456 -0.165 0 CA-C-N 118.367 0.53 . . . . 0.0 110.113 -174.624 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 90' ' ' LYS . . . . . 0.444 ' N ' ' HD2' ' A' ' 91' ' ' PRO . 60.5 tttm -64.79 -51.01 60.68 Favored Pre-proline 0 CA--C 1.535 0.38 0 CA-C-O 118.716 -0.659 . . . . 0.0 111.582 177.878 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 91' ' ' PRO . . . . . 0.444 ' HD2' ' N ' ' A' ' 90' ' ' LYS . 73.5 Cg_endo -68.4 161.03 46.61 Favored 'Trans proline' 0 N--CA 1.455 -0.775 0 C-N-CA 122.46 2.107 . . . . 0.0 110.237 174.771 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 89.7 19.48 47.98 Favored Glycine 0 CA--C 1.527 0.79 0 CA-C-O 119.362 -0.688 . . . . 0.0 112.242 179.925 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 20.3 p -153.16 168.87 24.49 Favored 'General case' 0 CA--C 1.521 -0.162 0 CA-C-N 117.89 0.845 . . . . 0.0 110.75 178.052 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 94' ' ' CYS . . . . . 0.417 ' HB2' HD13 ' A' ' 98' ' ' ILE . 29.5 p -57.94 -23.67 54.56 Favored 'General case' 0 N--CA 1.449 -0.515 0 CA-C-N 115.698 -0.683 . . . . 0.0 110.176 174.402 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -58.95 -57.85 11.23 Favored 'General case' 0 N--CA 1.451 -0.42 0 N-CA-C 109.361 -0.607 . . . . 0.0 109.361 -177.339 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 62.2 t60 -75.74 -32.01 59.81 Favored 'General case' 0 N--CA 1.451 -0.376 0 C-N-CA 121.094 -0.242 . . . . 0.0 111.639 -179.506 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -65.36 -48.88 71.42 Favored 'General case' 0 N--CA 1.45 -0.457 0 O-C-N 122.959 0.162 . . . . 0.0 111.053 -178.895 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 98' ' ' ILE . . . . . 0.417 HD13 ' HB2' ' A' ' 94' ' ' CYS . 1.8 mp -74.44 -27.71 21.63 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.162 0 CA-C-O 119.507 -0.282 . . . . 0.0 110.583 -179.886 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 3.9 m120 -64.23 -48.9 74.05 Favored 'General case' 0 N--CA 1.452 -0.339 0 CA-C-N 118.605 0.639 . . . . 0.0 110.163 173.902 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 26.4 m -74.64 -27.52 60.48 Favored 'General case' 0 N--CA 1.456 -0.164 0 N-CA-C 110.553 -0.166 . . . . 0.0 110.553 -175.947 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 57.0 tp -75.46 -47.97 24.79 Favored 'General case' 0 N--CA 1.448 -0.534 0 N-CA-C 110.272 -0.27 . . . . 0.0 110.272 177.027 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -65.81 -14.48 60.84 Favored Glycine 0 CA--C 1.528 0.846 0 CA-C-O 119.521 -0.6 . . . . 0.0 113.063 -173.33 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 24.2 pt-20 -95.98 -7.51 36.25 Favored 'General case' 0 CA--C 1.531 0.229 0 CA-C-N 118.297 1.049 . . . . 0.0 112.5 -178.482 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 27.3 m -129.97 -14.3 2.12 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.147 0 CA-C-N 118.542 0.61 . . . . 0.0 112.264 176.911 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 105' ' ' ILE . . . . . . . . . . . . . 9.7 tp -61.24 -22.62 27.86 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.137 0 CA-C-N 118.473 0.579 . . . . 0.0 110.7 -179.938 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 22.9 pt20 -64.79 -33.06 75.08 Favored 'General case' 0 N--CA 1.452 -0.359 0 C-N-CA 122.912 0.485 . . . . 0.0 110.445 177.145 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 82.9 mt-10 -75.61 -36.04 60.37 Favored 'General case' 0 N--CA 1.455 -0.218 0 CA-C-O 120.769 0.319 . . . . 0.0 110.171 177.991 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 50.2 mt -75.37 -37.42 60.61 Favored 'General case' 0 N--CA 1.448 -0.549 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.925 -177.359 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 67.0 mt -69.55 -57.13 5.59 Favored 'General case' 0 N--CA 1.452 -0.361 0 N-CA-C 109.909 -0.404 . . . . 0.0 109.909 177.377 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 6.4 p -46.07 -53.35 10.39 Favored 'General case' 0 CA--C 1.522 -0.121 0 C-N-CA 122.606 0.362 . . . . 0.0 111.434 179.294 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 34.4 t0 -61.66 -43.74 98.29 Favored 'General case' 0 N--CA 1.443 -0.784 0 N-CA-C 109.987 -0.375 . . . . 0.0 109.987 -179.954 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -65.6 -32.92 74.76 Favored 'General case' 0 N--CA 1.446 -0.636 0 C-N-CA 120.038 -0.665 . . . . 0.0 110.895 -176.984 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 113' ' ' ILE . . . . . . . . . . . . . 27.8 mm -68.28 -41.55 83.83 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.115 0 CA-C-N 118.984 0.811 . . . . 0.0 109.944 179.931 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -75.95 -39.39 56.15 Favored 'General case' 0 N--CA 1.454 -0.268 0 N-CA-C 112.033 0.383 . . . . 0.0 112.033 -179.711 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 1.3 tppp? -77.13 -33.03 56.8 Favored 'General case' 0 N--CA 1.449 -0.477 0 C-N-CA 123.966 0.906 . . . . 0.0 113.148 -175.086 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 116' ' ' SER . . . . . 0.467 ' HB2' ' CB ' ' A' ' 120' ' ' HIS . 51.7 p -84.89 160.68 20.1 Favored 'General case' 0 CA--C 1.53 0.2 0 N-CA-C 111.952 0.353 . . . . 0.0 111.952 -174.082 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 48.9 t30 -80.03 167.71 20.09 Favored 'General case' 0 CA--C 1.534 0.349 0 C-N-CA 122.901 0.48 . . . . 0.0 110.445 -179.618 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 118' ' ' GLN . . . . . . . . . . . . . 24.6 mm100 -52.64 -42.83 65.01 Favored 'General case' 0 CA--C 1.529 0.144 0 N-CA-C 112.954 0.724 . . . . 0.0 112.954 -173.047 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 11.1 p-10 -66.39 -35.71 81.01 Favored 'General case' 0 N--CA 1.456 -0.165 0 N-CA-C 110.223 -0.288 . . . . 0.0 110.223 179.296 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 120' ' ' HIS . . . . . 0.467 ' CB ' ' HB2' ' A' ' 116' ' ' SER . 25.6 m170 -68.98 -41.65 77.6 Favored 'General case' 0 N--CA 1.451 -0.423 0 CA-C-N 116.416 -0.357 . . . . 0.0 110.092 177.351 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 45.9 mttm -58.57 -39.24 79.74 Favored 'General case' 0 C--N 1.34 0.184 0 N-CA-C 109.371 -0.603 . . . . 0.0 109.371 178.813 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 1.8 tm-20 -65.51 -46.0 81.34 Favored 'General case' 0 N--CA 1.452 -0.331 0 C-N-CA 122.885 0.474 . . . . 0.0 110.756 -179.115 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 62.8 mttp -66.3 -31.45 72.25 Favored 'General case' 0 N--CA 1.455 -0.215 0 CA-C-N 117.741 0.246 . . . . 0.0 111.31 -179.782 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 124' ' ' ILE . . . . . . . . . . . . . 61.7 mt -74.59 -32.94 30.77 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.239 0 O-C-N 121.952 -0.468 . . . . 0.0 109.9 176.473 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -71.7 -36.86 70.68 Favored 'General case' 0 N--CA 1.455 -0.209 0 CA-C-O 119.163 -0.446 . . . . 0.0 111.492 179.032 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 126' ' ' MET . . . . . . . . . . . . . 28.2 ptm -68.14 -32.68 73.12 Favored 'General case' 0 CA--C 1.53 0.184 0 C-N-CA 119.148 -1.021 . . . . 0.0 109.243 174.648 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 4.0 mp -65.24 -32.73 74.55 Favored 'General case' 0 C--N 1.342 0.247 0 CA-C-O 119.474 -0.298 . . . . 0.0 110.321 171.926 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 44.2 tp -68.24 -43.09 78.68 Favored 'General case' 0 N--CA 1.455 -0.208 0 CA-C-N 118.165 0.439 . . . . 0.0 109.83 179.098 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 35.6 m-20 -60.06 -41.54 92.57 Favored 'General case' 0 N--CA 1.455 -0.208 0 N-CA-C 109.889 -0.411 . . . . 0.0 109.889 176.511 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 130' ' ' ILE . . . . . 0.464 ' HA ' ' HD3' ' A' ' 133' ' ' ARG . 65.0 mt -63.26 -36.7 77.12 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.273 0 N-CA-C 109.989 -0.374 . . . . 0.0 109.989 179.116 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 131' ' ' TRP . . . . . . . . . . . . . 42.2 m0 -75.8 -30.77 59.17 Favored 'General case' 0 N--CA 1.451 -0.406 0 N-CA-C 112.589 0.589 . . . . 0.0 112.589 -179.382 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 70.7 m-20 -70.31 -30.15 67.07 Favored 'General case' 0 CA--C 1.533 0.318 0 CA-C-N 118.443 0.565 . . . . 0.0 109.928 175.861 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 133' ' ' ARG . . . . . 0.464 ' HD3' ' HA ' ' A' ' 130' ' ' ILE . 21.9 mtp180 -75.49 -35.16 60.87 Favored 'General case' 0 N--CA 1.454 -0.23 0 C-N-CA 123.68 0.792 . . . . 0.0 111.628 178.587 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 46.0 t -73.14 -19.0 61.22 Favored 'General case' 0 N--CA 1.454 -0.242 0 N-CA-C 111.794 0.294 . . . . 0.0 111.794 -176.992 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 135' ' ' GLY . . . . . . . . . . . . . . . 93.5 15.3 50.91 Favored Glycine 0 CA--C 1.529 0.907 0 N-CA-C 111.965 -0.454 . . . . 0.0 111.965 -178.381 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 136' ' ' LEU . . . . . . . . . . . . . 86.5 mt -69.34 172.5 6.98 Favored 'General case' 0 CA--C 1.532 0.284 0 CA-C-N 117.373 0.587 . . . . 0.0 110.09 176.808 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 137' ' ' PHE . . . . . . . . . . . . . 63.7 m-85 -127.1 39.84 3.83 Favored 'General case' 0 C--O 1.232 0.163 0 N-CA-C 112.711 0.634 . . . . 0.0 112.711 -172.604 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 138' ' ' GLN . . . . . 0.521 ' CD ' ' H ' ' A' ' 138' ' ' GLN . 7.9 pm0 -66.5 17.13 0.02 OUTLIER 'General case' 0 CA--C 1.534 0.346 0 C-N-CA 124.631 1.172 . . . . 0.0 113.637 178.36 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 139' ' ' LYS . . . . . . . . . . . . . 43.0 mmtm 56.35 41.91 28.41 Favored 'General case' 0 N--CA 1.456 -0.155 0 C-N-CA 123.466 0.707 . . . . 0.0 112.343 176.974 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 140' ' ' SER . . . . . . . . . . . . . 17.2 m -56.0 -19.35 12.25 Favored 'General case' 0 CA--C 1.528 0.119 0 C-N-CA 122.927 0.491 . . . . 0.0 112.076 -179.631 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 141' ' ' TYR . . . . . . . . . . . . . 54.5 m-85 -79.87 -8.46 59.31 Favored 'General case' 0 N--CA 1.453 -0.287 0 C-N-CA 122.83 0.452 . . . . 0.0 112.061 179.73 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 142' ' ' LEU . . . . . 0.538 ' HG ' ' H ' ' A' ' 144' ' ' ALA . 48.1 tp -87.2 144.35 26.87 Favored 'General case' 0 N--CA 1.455 -0.217 0 CA-C-N 118.398 0.544 . . . . 0.0 110.538 -177.924 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 84.4 m-20 -66.55 -15.25 63.27 Favored 'General case' 0 N--CA 1.456 -0.151 0 N-CA-C 111.806 0.298 . . . . 0.0 111.806 -178.316 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 144' ' ' ALA . . . . . 0.538 ' H ' ' HG ' ' A' ' 142' ' ' LEU . . . -67.51 -34.21 76.65 Favored 'General case' 0 N--CA 1.452 -0.368 0 CA-C-N 117.737 0.244 . . . . 0.0 110.675 -179.096 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 145' ' ' ILE . . . . . . . . . . . . . 13.2 mm -75.33 -29.71 21.7 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.298 0 CA-C-N 117.677 0.217 . . . . 0.0 110.797 -179.738 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 146' ' ' ARG . . . . . . . . . . . . . 49.1 mtm-85 -74.91 -39.89 61.18 Favored 'General case' 0 N--CA 1.455 -0.193 0 N-CA-C 109.51 -0.552 . . . . 0.0 109.51 176.545 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 147' ' ' SER . . . . . . . . . . . . . 46.9 t 55.69 44.96 25.51 Favored 'General case' 0 N--CA 1.456 -0.149 0 C-N-CA 124.083 0.953 . . . . 0.0 112.105 172.642 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 148' ' ' LYS . . . . . 0.527 ' HE2' ' HA ' ' A' ' 148' ' ' LYS . 7.1 mmpt? -60.86 -14.27 20.97 Favored 'General case' 0 N--CA 1.454 -0.237 0 C-N-CA 123.552 0.741 . . . . 0.0 112.131 -178.139 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 149' ' ' CYS . . . . . . . . . . . . . 59.4 m -60.21 -31.69 70.4 Favored 'General case' 0 N--CA 1.452 -0.359 0 CA-C-N 118.252 0.478 . . . . 0.0 110.15 177.978 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 150' ' ' PHE . . . . . . . . . . . . . 52.0 t80 -66.44 -32.61 74.08 Favored 'General case' 0 N--CA 1.453 -0.282 0 N-CA-C 110.062 -0.348 . . . . 0.0 110.062 178.538 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 151' ' ' ALA . . . . . . . . . . . . . . . -75.75 -25.71 56.76 Favored 'General case' 0 N--CA 1.453 -0.314 0 C-N-CA 122.426 0.29 . . . . 0.0 111.022 179.272 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 152' ' ' MET . . . . . . . . . . . . . 97.1 mmm -76.48 -31.84 57.99 Favored 'General case' 0 N--CA 1.455 -0.188 0 N-CA-C 110.165 -0.309 . . . . 0.0 110.165 173.954 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 153' ' ' ASP . . . . . . . . . . . . . 74.4 m-20 -75.97 -46.32 30.29 Favored 'General case' 0 N--CA 1.453 -0.286 0 C-N-CA 123.143 0.577 . . . . 0.0 111.971 178.752 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 154' ' ' LEU . . . . . . . . . . . . . 48.7 mt -142.81 161.94 36.77 Favored 'General case' 0 N--CA 1.457 -0.1 0 C-N-CA 123.722 0.809 . . . . 0.0 110.063 -177.643 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 155' ' ' GLU . . . . . . . . . . . . . 20.3 pt-20 -70.88 162.2 29.68 Favored 'General case' 0 N--CA 1.454 -0.226 0 N-CA-C 109.756 -0.461 . . . . 0.0 109.756 176.501 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 156' ' ' HIS . . . . . . . . . . . . . 56.8 p-80 -137.34 16.67 2.96 Favored 'General case' 0 CA--C 1.529 0.169 0 N-CA-C 111.787 0.291 . . . . 0.0 111.787 -176.208 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 157' ' ' HIS . . . . . . . . . . . . . 69.0 m-70 -72.87 -12.14 60.86 Favored 'General case' 0 CA--C 1.53 0.206 0 N-CA-C 112.104 0.409 . . . . 0.0 112.104 -177.414 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 158' ' ' HIS . . . . . . . . . . . . . 90.3 m-70 -84.67 163.73 19.05 Favored 'General case' 0 C--O 1.231 0.103 0 C-N-CA 122.989 0.515 . . . . 0.0 111.398 -179.193 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 159' ' ' HIS . . . . . . . . . . . . . 20.5 t-160 . . . . . 0 C--O 1.249 1.032 0 CA-C-O 116.776 -1.583 . . . . 0.0 109.561 179.741 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' B' B 2052 ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 N--CA 1.473 0.703 0 CA-C-O 120.565 0.221 . . . . 0.0 110.448 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B 2053 ' ' ASP . . . . . . . . . . . . . 17.4 p-10 -80.62 31.51 0.3 Allowed 'General case' 0 CA--C 1.533 0.31 0 C-N-CA 125.217 1.407 . . . . 0.0 111.065 178.273 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B 2054 ' ' ASP . . . . . . . . . . . . . 29.8 t0 -152.62 -177.12 6.04 Favored 'General case' 0 N--CA 1.454 -0.27 0 N-CA-C 109.337 -0.616 . . . . 0.0 109.337 -175.622 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B 2055 ' ' GLU . . . . . . . . . . . . . 85.3 mt-10 -59.16 -23.38 62.15 Favored 'General case' 0 N--CA 1.454 -0.234 0 C-N-CA 123.749 0.82 . . . . 0.0 111.213 179.308 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B 2056 ' ' ASP . . . . . . . . . . . . . 10.6 m-20 48.12 16.67 0.09 Allowed 'General case' 0 C--N 1.341 0.226 0 C-N-CA 124.882 1.273 . . . . 0.0 113.777 -176.105 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B 2057 ' ' ASP . . . . . . . . . . . . . 35.0 t0 -154.0 169.27 23.91 Favored 'General case' 0 N--CA 1.447 -0.588 0 N-CA-C 109.171 -0.677 . . . . 0.0 109.171 174.684 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B 2058 ' ' TYR . . . . . . . . . . . . . 0.9 OUTLIER -153.97 136.61 15.18 Favored 'General case' 0 N--CA 1.452 -0.367 0 N-CA-C 108.714 -0.847 . . . . 0.0 108.714 -178.841 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B 2059 ' ' THR . . . . . . . . . . . . . 63.5 m -108.16 106.71 59.15 Favored Pre-proline 0 N--CA 1.452 -0.349 0 C-N-CA 123.192 0.597 . . . . 0.0 109.48 -178.461 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B 2060 ' ' PRO . . . . . . . . . . . . . 24.0 Cg_exo -65.87 164.62 26.42 Favored 'Trans proline' 0 N--CA 1.451 -0.971 0 C-N-CA 123.242 2.628 . . . . 0.0 112.055 177.42 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B 2061 ' ' SER . . . . . . . . . . . . . 93.7 p -150.29 137.96 19.9 Favored 'General case' 0 N--CA 1.451 -0.414 0 N-CA-C 108.696 -0.853 . . . . 0.0 108.696 173.082 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B 2062 ' ' ILE . . . . . . . . . . . . . 13.7 tt -167.27 150.27 1.46 Allowed 'Isoleucine or valine' 0 N--CA 1.454 -0.253 0 C-N-CA 123.424 0.69 . . . . 0.0 109.296 -178.777 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B 2063 ' ' SER . . . . . . . . . . . . . 42.9 t . . . . . 0 C--O 1.25 1.107 0 CA-C-O 116.938 -1.506 . . . . 0.0 111.149 176.913 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 49.6 tpp . . . . . 0 N--CA 1.472 0.63 0 N-CA-C 110.28 -0.267 . . . . 0.0 110.28 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 12.6 pt20 53.4 24.86 4.18 Favored 'General case' 0 CA--C 1.529 0.166 0 C-N-CA 125.583 1.553 . . . . 0.0 113.49 176.517 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 20.9 pt20 -143.87 28.2 1.43 Allowed 'General case' 0 CA--C 1.532 0.252 0 C-N-CA 122.992 0.517 . . . . 0.0 110.01 177.077 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 51.8 m-20 58.38 16.37 4.06 Favored 'General case' 0 C--N 1.338 0.079 0 C-N-CA 125.617 1.567 . . . . 0.0 115.049 179.003 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 40.1 p-10 -88.66 -5.23 58.27 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 122.161 0.982 . . . . 0.0 109.8 171.646 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 3.8 p30 -97.12 -33.72 11.41 Favored 'General case' 0 N--CA 1.447 -0.607 0 CA-C-N 113.848 -1.524 . . . . 0.0 107.13 175.669 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' PHE . . . . . 0.489 ' HB2' ' HZ3' ' A' ' 45' ' ' LYS . 1.3 t80 -62.55 -34.21 76.49 Favored 'General case' 0 N--CA 1.45 -0.475 0 C-N-CA 124.482 1.113 . . . . 0.0 108.998 172.657 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 51.5 tp60 -49.64 -36.37 24.33 Favored 'General case' 0 N--CA 1.453 -0.281 0 C-N-CA 124.953 1.301 . . . . 0.0 112.167 -177.481 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 22.9 m-80 -71.8 -34.48 69.41 Favored 'General case' 0 N--CA 1.454 -0.264 0 CA-C-O 120.801 0.334 . . . . 0.0 110.176 -179.524 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' PHE . . . . . 0.439 ' CZ ' HG12 ' A' ' 46' ' ' ILE . 1.6 t80 -70.98 -39.57 72.43 Favored 'General case' 0 N--CA 1.45 -0.45 0 C-N-CA 123.787 0.835 . . . . 0.0 109.107 177.451 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 95.2 t -66.42 -52.21 49.3 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.353 0 N-CA-C 109.164 -0.68 . . . . 0.0 109.164 178.666 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -59.12 -31.16 68.68 Favored 'General case' 0 N--CA 1.451 -0.389 0 C-N-CA 122.428 0.291 . . . . 0.0 111.486 -178.86 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 78.6 m -69.88 -37.45 76.05 Favored 'General case' 0 CA--C 1.531 0.214 0 N-CA-C 108.753 -0.832 . . . . 0.0 108.753 176.061 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.495 HD21 ' HB2' ' A' ' 53' ' ' TYR . 6.2 tp -66.73 -41.43 87.89 Favored 'General case' 0 N--CA 1.455 -0.203 0 CA-C-O 121.485 0.66 . . . . 0.0 110.488 178.742 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 63.3 mm-40 -64.82 -27.79 69.12 Favored 'General case' 0 N--CA 1.451 -0.417 0 C-N-CA 123.698 0.799 . . . . 0.0 109.08 178.027 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 5.3 p -71.75 -29.3 64.35 Favored 'General case' 0 N--CA 1.452 -0.346 0 N-CA-C 109.966 -0.383 . . . . 0.0 109.966 177.596 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' PHE . . . . . 0.502 ' CE1' HD11 ' A' ' 68' ' ' ILE . 24.3 m-85 -68.85 -34.32 75.27 Favored 'General case' 0 N--CA 1.457 -0.124 0 C-N-CA 119.718 -0.793 . . . . 0.0 110.395 171.536 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . 0.422 ' HA ' ' CE1' ' A' ' 61' ' ' HIS . 55.1 mttt -65.76 -26.3 67.66 Favored 'General case' 0 C--N 1.338 0.103 0 C-N-CA 120.395 -0.522 . . . . 0.0 110.153 176.112 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 40.3 t0 -73.48 -43.73 59.54 Favored 'General case' 0 CA--C 1.532 0.26 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.637 177.137 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 87.6 mt -65.12 146.66 54.69 Favored 'General case' 0 N--CA 1.456 -0.148 0 O-C-N 121.862 -0.524 . . . . 0.0 110.001 179.546 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -81.54 -32.5 32.25 Favored 'General case' 0 C--N 1.334 -0.076 0 N-CA-C 109.737 -0.468 . . . . 0.0 109.737 -179.916 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 14.1 m -79.22 -21.55 46.1 Favored 'General case' 0 N--CA 1.453 -0.289 0 C-N-CA 123.166 0.586 . . . . 0.0 110.738 175.487 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 72.74 -26.93 0.75 Allowed Glycine 0 CA--C 1.527 0.826 0 C-N-CA 124.578 1.085 . . . . 0.0 112.328 -178.792 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 74.3 mt -81.61 147.37 6.23 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.441 0 C-N-CA 123.396 0.678 . . . . 0.0 110.413 178.916 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 37.8 t -165.67 97.4 0.66 Allowed 'General case' 0 CA--C 1.517 -0.305 0 N-CA-C 108.42 -0.956 . . . . 0.0 108.42 173.606 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . 0.467 ' O ' ' HE2' ' A' ' 30' ' ' LYS . . . -55.84 -36.83 67.35 Favored Glycine 0 CA--C 1.527 0.796 0 N-CA-C 110.313 -1.115 . . . . 0.0 110.313 -176.497 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . 0.465 ' H ' ' HB3' ' B' 2055 ' ' GLU . 88.5 p -62.27 -51.76 66.41 Favored 'General case' 0 N--CA 1.454 -0.274 0 CA-C-N 117.502 0.651 . . . . 0.0 110.123 -177.817 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 83.7 mtt180 -70.86 -40.97 72.0 Favored 'General case' 0 N--CA 1.455 -0.188 0 C-N-CA 123.626 0.77 . . . . 0.0 110.737 -178.71 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 64.0 mt -56.43 -42.01 73.74 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.707 0 N-CA-C 109.101 -0.703 . . . . 0.0 109.101 174.861 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . 0.467 ' HE2' ' O ' ' A' ' 26' ' ' GLY . 48.8 mtmt -67.81 -26.88 66.29 Favored 'General case' 0 C--N 1.34 0.194 0 CA-C-O 118.79 -0.624 . . . . 0.0 111.385 177.554 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . 0.49 ' HE3' ' HA ' ' A' ' 31' ' ' LYS . 0.0 OUTLIER -63.93 -56.56 14.32 Favored 'General case' 0 C--N 1.339 0.112 0 CA-C-N 119.187 0.903 . . . . 0.0 110.146 176.568 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.439 HD12 ' N ' ' A' ' 33' ' ' THR . 3.3 pp -75.21 -20.63 59.17 Favored 'General case' 0 CA--C 1.531 0.222 0 C-N-CA 119.662 -0.815 . . . . 0.0 111.419 -177.532 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . 0.439 ' N ' HD12 ' A' ' 32' ' ' LEU . 31.3 m -69.8 -41.68 74.71 Favored 'General case' 0 C--O 1.231 0.107 0 N-CA-C 108.28 -1.007 . . . . 0.0 108.28 175.96 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 97.5 m -68.44 -41.82 79.75 Favored 'General case' 0 N--CA 1.45 -0.46 0 N-CA-C 109.876 -0.416 . . . . 0.0 109.876 -178.751 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 52.7 t80 -62.89 -32.12 73.32 Favored 'General case' 0 C--N 1.337 0.046 0 N-CA-C 109.972 -0.381 . . . . 0.0 109.972 177.475 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -72.97 -28.72 62.57 Favored 'General case' 0 N--CA 1.447 -0.62 0 CA-C-O 119.491 -0.29 . . . . 0.0 111.061 178.999 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 2.2 mm? -79.78 -33.93 40.14 Favored 'General case' 0 CA--C 1.519 -0.224 0 N-CA-C 109.009 -0.737 . . . . 0.0 109.009 -178.371 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 81.2 m-20 -66.32 -17.25 64.65 Favored 'General case' 0 N--CA 1.443 -0.818 0 C-N-CA 123.892 0.877 . . . . 0.0 111.188 173.966 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 96.5 m-70 -152.52 90.78 1.52 Allowed 'General case' 0 N--CA 1.453 -0.286 0 C-N-CA 123.904 0.882 . . . . 0.0 110.681 -176.87 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 40' ' ' ILE . . . . . 0.567 ' H ' HD13 ' A' ' 40' ' ' ILE . 0.0 OUTLIER -71.23 -18.39 20.4 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.29 0 CA-C-N 119.235 0.925 . . . . 0.0 108.526 172.374 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 7.7 m-20 -44.84 -41.78 7.36 Favored 'General case' 0 N--CA 1.455 -0.212 0 C-N-CA 125.817 1.647 . . . . 0.0 112.806 -179.525 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . 0.402 HD13 HD11 ' A' ' 46' ' ' ILE . 1.4 pp -101.07 16.73 4.14 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.57 0 C-N-CA 124.151 0.98 . . . . 0.0 111.742 -173.283 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . 0.44 ' HA ' HD12 ' A' ' 46' ' ' ILE . 3.0 pp20? -52.97 -32.96 48.95 Favored 'General case' 0 CA--C 1.529 0.14 0 O-C-N 122.076 -0.39 . . . . 0.0 111.205 176.759 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 47.8 t -59.71 -46.14 90.0 Favored 'General case' 0 CA--C 1.53 0.211 0 O-C-N 122.273 -0.267 . . . . 0.0 111.654 -177.326 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . 0.489 ' HZ3' ' HB2' ' A' ' 7' ' ' PHE . 18.4 ptpt -75.09 -23.03 57.91 Favored 'General case' 0 C--N 1.341 0.223 0 C-N-CA 121.006 -0.278 . . . . 0.0 110.547 179.434 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 46' ' ' ILE . . . . . 0.44 HD12 ' HA ' ' A' ' 43' ' ' GLU . 77.0 mt -73.88 -50.13 30.67 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.253 0 N-CA-C 110.18 -0.304 . . . . 0.0 110.18 -179.92 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 46.0 mm -67.32 -37.25 78.69 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.431 0 O-C-N 123.357 0.41 . . . . 0.0 110.364 -177.302 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 22.6 t -67.5 -39.7 85.19 Favored 'General case' 0 N--CA 1.452 -0.346 0 C-N-CA 119.351 -0.94 . . . . 0.0 109.818 176.939 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . 0.467 ' HG ' HD22 ' A' ' 14' ' ' LEU . 53.4 tp -69.33 -35.48 75.98 Favored 'General case' 0 N--CA 1.449 -0.507 0 CA-C-O 119.162 -0.447 . . . . 0.0 111.832 -174.444 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . 0.472 HD12 HG12 ' A' ' 69' ' ' ILE . 3.9 pt -72.07 -44.68 65.36 Favored 'Isoleucine or valine' 0 C--N 1.34 0.163 0 CA-C-N 118.834 0.743 . . . . 0.0 110.855 178.032 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 30.9 pt -66.16 -39.06 83.35 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.141 0 C-N-CA 119.559 -0.856 . . . . 0.0 111.064 179.628 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 88.9 m-20 -64.86 -45.21 87.01 Favored 'General case' 0 N--CA 1.452 -0.338 0 CA-C-N 117.958 0.344 . . . . 0.0 110.749 178.959 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 53' ' ' TYR . . . . . 0.495 ' HB2' HD21 ' A' ' 14' ' ' LEU . 3.2 t80 -65.04 -34.79 79.27 Favored 'General case' 0 N--CA 1.456 -0.16 0 N-CA-C 109.326 -0.62 . . . . 0.0 109.326 175.867 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 28.7 t -62.37 -34.72 77.24 Favored 'General case' 0 N--CA 1.454 -0.261 0 CA-C-N 117.878 0.308 . . . . 0.0 111.082 -178.692 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . 0.431 ' NE ' ' HA ' ' A' ' 55' ' ' ARG . 11.8 mmp_? -75.42 -46.41 32.94 Favored 'General case' 0 C--N 1.34 0.183 0 CA-C-N 118.489 0.586 . . . . 0.0 111.525 177.709 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 30.5 mt -75.23 -41.25 57.98 Favored 'General case' 0 C--O 1.227 -0.085 0 N-CA-C 112.92 0.711 . . . . 0.0 112.92 -173.253 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 13.2 p -63.66 155.53 75.93 Favored Pre-proline 0 CA--C 1.535 0.391 0 N-CA-C 112.607 0.595 . . . . 0.0 112.607 -174.857 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 87.2 Cg_endo -74.57 173.04 15.0 Favored 'Trans proline' 0 N--CA 1.453 -0.876 0 C-N-CA 124.746 3.631 . . . . 0.0 111.668 -179.433 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -46.57 -52.8 12.71 Favored 'General case' 0 N--CA 1.452 -0.328 0 C-N-CA 125.407 1.483 . . . . 0.0 113.952 -170.744 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 95.1 p -68.14 -31.86 71.74 Favored 'General case' 0 N--CA 1.457 -0.089 0 O-C-N 121.915 -0.491 . . . . 0.0 110.111 -177.154 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 61' ' ' HIS . . . . . 0.422 ' CE1' ' HA ' ' A' ' 18' ' ' LYS . 37.0 m170 -75.34 -24.93 57.43 Favored 'General case' 0 N--CA 1.45 -0.431 0 N-CA-C 109.923 -0.399 . . . . 0.0 109.923 179.395 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 67.7 mttm -67.05 -40.4 87.14 Favored 'General case' 0 C--N 1.34 0.184 0 N-CA-C 109.246 -0.65 . . . . 0.0 109.246 173.292 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -60.79 -40.8 93.97 Favored 'General case' 0 CA--C 1.533 0.29 0 N-CA-C 108.458 -0.941 . . . . 0.0 108.458 175.548 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -67.62 -30.58 74.94 Favored Glycine 0 CA--C 1.528 0.876 0 N-CA-C 111.727 -0.549 . . . . 0.0 111.727 178.442 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 35.6 p -66.94 -35.12 79.27 Favored 'General case' 0 N--CA 1.456 -0.153 0 CA-C-N 117.805 0.803 . . . . 0.0 109.637 178.217 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . 0.434 HD21 ' CD2' ' A' ' 108' ' ' LEU . 43.0 mt -73.94 -30.51 62.59 Favored 'General case' 0 N--CA 1.453 -0.277 0 C-N-CA 122.346 0.258 . . . . 0.0 110.579 177.424 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 2.6 m-85 -68.93 -36.44 77.97 Favored 'General case' 0 CA--C 1.518 -0.265 0 CA-C-N 117.75 0.25 . . . . 0.0 110.776 176.577 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 68' ' ' ILE . . . . . 0.502 HD11 ' CE1' ' A' ' 17' ' ' PHE . 16.3 mt -69.51 -51.52 41.15 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.484 0 C-N-CA 119.631 -0.827 . . . . 0.0 108.776 178.536 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 69' ' ' ILE . . . . . 0.472 HG12 HD12 ' A' ' 50' ' ' ILE . 77.2 mt -48.47 -37.45 7.98 Favored 'Isoleucine or valine' 0 C--N 1.341 0.224 0 O-C-N 123.574 0.546 . . . . 0.0 111.161 172.355 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 19.9 t70 -70.9 -48.16 55.23 Favored 'General case' 0 C--O 1.233 0.202 0 CA-C-N 118.863 0.756 . . . . 0.0 111.096 179.418 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 30.8 t -65.11 -51.45 61.25 Favored 'General case' 0 N--CA 1.451 -0.404 0 C-N-CA 122.447 0.299 . . . . 0.0 111.251 -176.4 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 72' ' ' ILE . . . . . 0.422 HD11 ' CZ ' ' A' ' 76' ' ' TYR . 0.0 OUTLIER -75.82 -32.62 24.25 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.234 0 N-CA-C 109.89 -0.411 . . . . 0.0 109.89 -178.557 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -69.19 -46.49 57.56 Favored Glycine 0 CA--C 1.523 0.558 0 N-CA-C 111.419 -0.672 . . . . 0.0 111.419 -176.531 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 37.5 mtm105 -69.47 -42.01 75.41 Favored 'General case' 0 CA--C 1.515 -0.395 0 CA-C-N 117.694 0.747 . . . . 0.0 110.09 177.641 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -62.83 -31.32 72.31 Favored 'General case' 0 N--CA 1.448 -0.528 0 C-N-CA 119.996 -0.682 . . . . 0.0 110.306 -179.194 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 76' ' ' TYR . . . . . 0.422 ' CZ ' HD11 ' A' ' 72' ' ' ILE . 2.3 m-30 -72.29 -56.38 5.6 Favored 'General case' 0 CA--C 1.518 -0.281 0 CA-C-N 118.149 0.431 . . . . 0.0 111.065 175.428 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 53.8 tp -63.87 -40.88 97.58 Favored 'General case' 0 N--CA 1.447 -0.577 0 C-N-CA 117.885 -1.526 . . . . 0.0 109.948 -175.265 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 95.8 m-20 -60.69 -50.97 71.35 Favored 'General case' 0 N--CA 1.454 -0.24 0 CA-C-O 118.693 -0.67 . . . . 0.0 112.389 -179.843 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 68.0 mm-40 -72.52 -35.73 68.16 Favored 'General case' 0 N--CA 1.455 -0.196 0 CA-C-N 119.385 0.993 . . . . 0.0 112.078 -177.357 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 80.5 p -72.11 -30.63 65.26 Favored 'General case' 0 N--CA 1.451 -0.404 0 C-N-CA 120.18 -0.608 . . . . 0.0 110.579 179.493 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 7.4 ttm105 -82.71 -29.6 29.74 Favored 'General case' 0 CA--C 1.531 0.224 0 C-N-CA 123.649 0.78 . . . . 0.0 112.159 177.76 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 44.2 m -79.21 -15.11 58.55 Favored 'General case' 0 CA--C 1.528 0.111 0 N-CA-C 112.645 0.609 . . . . 0.0 112.645 -179.102 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 50.1 m-80 -130.22 -1.59 4.53 Favored 'General case' 0 N--CA 1.455 -0.213 0 N-CA-C 112.304 0.483 . . . . 0.0 112.304 -174.93 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 47.8 t -162.85 179.18 7.81 Favored 'General case' 0 N--CA 1.451 -0.384 0 N-CA-C 110.005 -0.369 . . . . 0.0 110.005 -179.842 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 10.1 m120 -76.92 3.26 12.51 Favored 'General case' 0 CA--C 1.533 0.303 0 C-N-CA 122.676 0.391 . . . . 0.0 110.97 176.451 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 33.4 p 62.26 -9.58 0.09 Allowed 'General case' 0 CA--C 1.533 0.297 0 C-N-CA 126.315 1.846 . . . . 0.0 114.259 -177.749 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 48.2 t 58.69 175.69 0.07 Allowed 'General case' 0 CA--C 1.534 0.339 0 C-N-CA 124.468 1.107 . . . . 0.0 112.533 -178.912 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 47.9 t -139.56 5.87 2.25 Favored 'General case' 0 N--CA 1.455 -0.191 0 C-N-CA 123.553 0.741 . . . . 0.0 110.931 179.306 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 70.4 m-80 -145.52 173.46 12.01 Favored 'General case' 0 CA--C 1.531 0.225 0 C-N-CA 124.486 1.114 . . . . 0.0 109.752 179.969 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 90' ' ' LYS . . . . . 0.409 ' HB3' ' HE3' ' A' ' 90' ' ' LYS . 20.2 ttpp 67.72 134.59 0.04 OUTLIER Pre-proline 0 CA--C 1.536 0.406 0 C-N-CA 125.926 1.691 . . . . 0.0 113.386 -179.51 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 82.1 Cg_endo -70.3 168.92 20.87 Favored 'Trans proline' 0 N--CA 1.454 -0.809 0 C-N-CA 124.31 3.34 . . . . 0.0 110.522 173.894 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 83.59 20.63 59.66 Favored Glycine 0 CA--C 1.526 0.773 0 CA-C-O 119.775 -0.458 . . . . 0.0 112.448 177.442 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -158.28 167.16 30.51 Favored 'General case' 0 N--CA 1.451 -0.392 0 C-N-CA 124.281 1.033 . . . . 0.0 109.528 179.94 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 94' ' ' CYS . . . . . 0.569 ' SG ' HD13 ' A' ' 98' ' ' ILE . 2.0 t -52.37 -28.06 18.07 Favored 'General case' 0 N--CA 1.454 -0.241 0 C-N-CA 123.82 0.848 . . . . 0.0 110.816 175.176 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -52.94 -62.57 1.57 Allowed 'General case' 0 N--CA 1.448 -0.548 0 O-C-N 122.497 -0.127 . . . . 0.0 111.086 -178.239 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 76.4 t60 -73.56 -32.98 64.45 Favored 'General case' 0 N--CA 1.453 -0.323 0 O-C-N 122.27 -0.269 . . . . 0.0 110.954 -178.308 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -64.04 -53.58 47.66 Favored 'General case' 0 N--CA 1.451 -0.397 0 O-C-N 122.934 0.147 . . . . 0.0 111.183 -177.252 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 98' ' ' ILE . . . . . 0.569 HD13 ' SG ' ' A' ' 94' ' ' CYS . 1.7 mp -69.88 -34.55 60.77 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.166 0 N-CA-C 109.83 -0.433 . . . . 0.0 109.83 -179.81 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 59.6 m-20 -62.07 -42.39 99.15 Favored 'General case' 0 N--CA 1.456 -0.168 0 O-C-N 122.163 -0.336 . . . . 0.0 110.6 178.102 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 98.0 m -64.23 -41.28 97.08 Favored 'General case' 0 N--CA 1.454 -0.249 0 N-CA-C 109.9 -0.407 . . . . 0.0 109.9 -178.653 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 90.8 mt -68.98 -24.1 64.2 Favored 'General case' 0 N--CA 1.452 -0.329 0 CA-C-N 116.426 -0.352 . . . . 0.0 111.389 179.882 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -73.73 -25.59 71.63 Favored Glycine 0 CA--C 1.527 0.833 0 CA-C-O 119.551 -0.583 . . . . 0.0 113.518 -178.212 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 74.1 mm-40 -81.08 -45.55 16.32 Favored 'General case' 0 N--CA 1.453 -0.294 0 CA-C-N 118.3 1.05 . . . . 0.0 111.996 179.35 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 18.1 m -85.26 6.69 2.19 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.14 0 C-N-CA 123.641 0.777 . . . . 0.0 111.097 -175.79 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 105' ' ' ILE . . . . . . . . . . . . . 9.7 tp -62.0 -37.0 77.25 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.354 0 C-N-CA 122.125 0.17 . . . . 0.0 110.795 -174.464 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 16.5 pt20 -76.05 -35.67 59.35 Favored 'General case' 0 N--CA 1.451 -0.404 0 CA-C-O 119.14 -0.457 . . . . 0.0 111.153 -177.231 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 59.3 mp0 -74.7 -39.36 61.99 Favored 'General case' 0 N--CA 1.451 -0.382 0 CA-C-N 118.814 0.734 . . . . 0.0 110.449 -179.684 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 108' ' ' LEU . . . . . 0.434 ' CD2' HD21 ' A' ' 66' ' ' LEU . 7.6 tt -73.5 -41.38 63.17 Favored 'General case' 0 N--CA 1.45 -0.475 0 CA-C-O 119.672 -0.204 . . . . 0.0 111.326 -174.774 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 9.6 mp -73.43 -49.9 24.53 Favored 'General case' 0 C--O 1.225 -0.203 0 C-N-CA 120.534 -0.466 . . . . 0.0 110.012 179.148 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 23.3 t -55.32 -39.47 70.0 Favored 'General case' 0 N--CA 1.454 -0.231 0 CA-C-N 118.334 0.515 . . . . 0.0 111.109 -177.452 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 36.9 t0 -62.4 -49.33 75.94 Favored 'General case' 0 N--CA 1.454 -0.264 0 N-CA-C 109.067 -0.716 . . . . 0.0 109.067 175.423 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -66.69 -35.72 80.8 Favored 'General case' 0 N--CA 1.446 -0.657 0 CA-C-O 119.031 -0.509 . . . . 0.0 112.097 -175.457 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 113' ' ' ILE . . . . . . . . . . . . . 20.6 mm -70.26 -40.71 78.28 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.213 0 CA-C-N 119.315 0.961 . . . . 0.0 110.209 -178.936 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -74.35 -40.38 62.19 Favored 'General case' 0 N--CA 1.451 -0.377 0 C-N-CA 121.288 -0.165 . . . . 0.0 111.385 -179.421 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 115' ' ' LYS . . . . . 0.614 ' HE2' ' HA ' ' A' ' 115' ' ' LYS . 0.6 OUTLIER -75.58 -39.31 58.25 Favored 'General case' 0 N--CA 1.449 -0.485 0 N-CA-C 113.341 0.867 . . . . 0.0 113.341 -178.516 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 116' ' ' SER . . . . . 0.477 ' HB2' ' CB ' ' A' ' 120' ' ' HIS . 44.4 p -80.5 161.3 24.91 Favored 'General case' 0 N--CA 1.455 -0.198 0 N-CA-C 112.425 0.528 . . . . 0.0 112.425 -172.52 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 22.6 m120 -88.64 178.02 6.61 Favored 'General case' 0 C--O 1.227 -0.1 0 C-N-CA 123.435 0.694 . . . . 0.0 112.59 -177.367 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 118' ' ' GLN . . . . . . . . . . . . . 2.9 pt20 -49.21 -55.09 13.65 Favored 'General case' 0 N--CA 1.456 -0.128 0 C-N-CA 123.633 0.773 . . . . 0.0 112.937 -177.661 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 21.9 t70 -56.59 -33.98 66.75 Favored 'General case' 0 C--O 1.23 0.052 0 CA-C-N 118.451 0.569 . . . . 0.0 110.104 -179.993 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 120' ' ' HIS . . . . . 0.477 ' CB ' ' HB2' ' A' ' 116' ' ' SER . 15.9 m170 -75.05 -41.41 59.17 Favored 'General case' 0 N--CA 1.449 -0.489 0 N-CA-C 109.932 -0.395 . . . . 0.0 109.932 -177.571 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 62.1 mttp -58.08 -37.97 75.48 Favored 'General case' 0 N--CA 1.455 -0.202 0 N-CA-C 110.228 -0.286 . . . . 0.0 110.228 179.88 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 81.6 mm-40 -68.86 -46.24 69.0 Favored 'General case' 0 N--CA 1.449 -0.486 0 C-N-CA 122.72 0.408 . . . . 0.0 110.299 179.033 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 97.4 mttt -64.55 -31.33 72.5 Favored 'General case' 0 N--CA 1.453 -0.307 0 CA-C-N 115.75 -0.659 . . . . 0.0 111.07 -178.698 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 124' ' ' ILE . . . . . . . . . . . . . 58.4 mt -75.62 -38.47 38.4 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.242 0 O-C-N 121.791 -0.568 . . . . 0.0 110.132 176.761 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 22.9 mtp180 -67.49 -33.11 74.44 Favored 'General case' 0 N--CA 1.453 -0.277 0 N-CA-C 112.385 0.513 . . . . 0.0 112.385 178.14 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 126' ' ' MET . . . . . . . . . . . . . 28.1 ptm -72.5 -33.82 67.2 Favored 'General case' 0 N--CA 1.455 -0.207 0 C-N-CA 119.489 -0.884 . . . . 0.0 108.686 174.328 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 2.6 mp -63.33 -38.23 90.34 Favored 'General case' 0 C--N 1.34 0.163 0 N-CA-C 109.896 -0.409 . . . . 0.0 109.896 175.19 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 57.4 tp -64.24 -42.62 96.45 Favored 'General case' 0 N--CA 1.453 -0.285 0 CA-C-N 117.747 0.249 . . . . 0.0 110.335 179.614 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 18.9 t0 -63.82 -46.64 84.19 Favored 'General case' 0 N--CA 1.455 -0.178 0 N-CA-C 109.855 -0.424 . . . . 0.0 109.855 177.697 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 54.8 mt -56.37 -35.81 44.72 Favored 'Isoleucine or valine' 0 C--O 1.235 0.296 0 N-CA-C 110.257 -0.275 . . . . 0.0 110.257 179.931 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 131' ' ' TRP . . . . . . . . . . . . . 47.6 m0 -73.17 -43.72 61.0 Favored 'General case' 0 N--CA 1.45 -0.462 0 N-CA-C 112.635 0.606 . . . . 0.0 112.635 -179.536 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 76.7 m-20 -64.83 -27.56 68.96 Favored 'General case' 0 N--CA 1.453 -0.279 0 CA-C-N 118.462 0.574 . . . . 0.0 110.916 -179.088 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 12.3 mtp180 -75.67 -36.59 60.06 Favored 'General case' 0 C--O 1.226 -0.137 0 C-N-CA 123.313 0.645 . . . . 0.0 110.551 177.079 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 39.7 m -75.13 -13.95 60.52 Favored 'General case' 0 N--CA 1.455 -0.177 0 C-N-CA 123.019 0.528 . . . . 0.0 112.272 -178.246 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 135' ' ' GLY . . . . . . . . . . . . . . . 94.03 5.69 62.31 Favored Glycine 0 CA--C 1.529 0.944 0 N-CA-C 110.969 -0.853 . . . . 0.0 110.969 -175.183 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 136' ' ' LEU . . . . . . . . . . . . . 81.5 mt -82.65 12.62 4.47 Favored 'General case' 0 N--CA 1.454 -0.271 0 C-N-CA 123.743 0.817 . . . . 0.0 111.253 177.76 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 137' ' ' PHE . . . . . . . . . . . . . 21.6 p90 -59.03 151.08 23.0 Favored 'General case' 0 C--N 1.341 0.208 0 CA-C-N 118.217 0.462 . . . . 0.0 110.409 -178.898 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 138' ' ' GLN . . . . . . . . . . . . . 70.7 mm-40 -137.58 173.45 11.65 Favored 'General case' 0 CA--C 1.523 -0.061 0 CA-C-O 121.445 0.641 . . . . 0.0 111.333 -176.145 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 139' ' ' LYS . . . . . . . . . . . . . 63.2 pttt -79.43 174.92 11.08 Favored 'General case' 0 N--CA 1.452 -0.333 0 CA-C-N 114.983 -1.008 . . . . 0.0 111.335 178.926 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 140' ' ' SER . . . . . 0.471 ' C ' ' H ' ' A' ' 142' ' ' LEU . 9.5 t 59.51 37.87 22.69 Favored 'General case' 0 CA--C 1.533 0.316 0 N-CA-C 114.358 1.244 . . . . 0.0 114.358 174.719 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 141' ' ' TYR . . . . . . . . . . . . . 9.9 m-30 -73.24 35.72 0.08 Allowed 'General case' 0 CA--C 1.535 0.402 0 O-C-N 121.71 -0.619 . . . . 0.0 110.159 171.084 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 142' ' ' LEU . . . . . 0.471 ' H ' ' C ' ' A' ' 140' ' ' SER . 82.0 mt -80.25 -174.68 4.68 Favored 'General case' 0 N--CA 1.454 -0.24 0 C-N-CA 124.539 1.136 . . . . 0.0 111.531 -175.722 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 68.5 m-80 -55.71 -17.26 5.52 Favored 'General case' 0 N--CA 1.456 -0.171 0 C-N-CA 123.828 0.851 . . . . 0.0 112.566 -179.7 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . -66.2 -30.89 71.44 Favored 'General case' 0 N--CA 1.452 -0.369 0 CA-C-N 118.245 0.475 . . . . 0.0 110.416 179.587 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 145' ' ' ILE . . . . . . . . . . . . . 47.6 mm -74.6 -35.83 39.11 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.233 0 N-CA-C 110.048 -0.353 . . . . 0.0 110.048 179.678 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 146' ' ' ARG . . . . . . . . . . . . . 15.3 mmm180 -75.9 -22.87 55.64 Favored 'General case' 0 N--CA 1.453 -0.299 0 O-C-N 122.243 -0.286 . . . . 0.0 110.86 179.278 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 147' ' ' SER . . . . . . . . . . . . . 74.4 p 42.36 48.96 4.5 Favored 'General case' 0 C--N 1.341 0.221 0 C-N-CA 124.892 1.277 . . . . 0.0 112.642 174.625 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 148' ' ' LYS . . . . . 0.571 ' H ' ' CD ' ' A' ' 148' ' ' LYS . 0.0 OUTLIER -55.35 -14.93 2.11 Favored 'General case' 0 N--CA 1.453 -0.278 0 C-N-CA 124.047 0.939 . . . . 0.0 112.587 178.586 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 149' ' ' CYS . . . . . . . . . . . . . 59.6 m -60.88 -30.52 70.2 Favored 'General case' 0 N--CA 1.451 -0.402 0 O-C-N 121.804 -0.56 . . . . 0.0 109.72 175.887 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 150' ' ' PHE . . . . . . . . . . . . . 92.7 t80 -65.0 -29.45 70.37 Favored 'General case' 0 N--CA 1.454 -0.233 0 N-CA-C 110.018 -0.364 . . . . 0.0 110.018 178.774 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 151' ' ' ALA . . . . . . . . . . . . . . . -75.9 -33.76 59.92 Favored 'General case' 0 N--CA 1.449 -0.502 0 C-N-CA 122.401 0.28 . . . . 0.0 110.752 177.024 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 152' ' ' MET . . . . . . . . . . . . . 89.4 mtp -73.96 -31.04 62.83 Favored 'General case' 0 N--CA 1.454 -0.259 0 N-CA-C 110.225 -0.287 . . . . 0.0 110.225 178.454 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 153' ' ' ASP . . . . . . . . . . . . . 79.7 m-20 -75.42 -23.91 57.05 Favored 'General case' 0 N--CA 1.454 -0.23 0 N-CA-C 113.105 0.78 . . . . 0.0 113.105 -179.571 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 154' ' ' LEU . . . . . . . . . . . . . 84.3 mt -131.32 18.13 4.9 Favored 'General case' 0 C--N 1.339 0.119 0 C-N-CA 123.032 0.533 . . . . 0.0 111.891 -174.176 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 155' ' ' GLU . . . . . . . . . . . . . 94.0 mt-10 51.53 8.99 0.06 Allowed 'General case' 0 CA--C 1.535 0.381 0 C-N-CA 126.19 1.796 . . . . 0.0 114.227 -179.054 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 156' ' ' HIS . . . . . . . . . . . . . 73.2 t60 -161.96 145.92 12.38 Favored 'General case' 0 N--CA 1.454 -0.235 0 N-CA-C 108.169 -1.048 . . . . 0.0 108.169 -178.638 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 157' ' ' HIS . . . . . . . . . . . . . 62.1 t60 -98.47 -25.23 14.85 Favored 'General case' 0 C--N 1.338 0.103 0 N-CA-C 113.326 0.861 . . . . 0.0 113.326 -172.955 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 158' ' ' HIS . . . . . . . . . . . . . 88.1 m-70 -91.37 40.92 1.05 Allowed 'General case' 0 N--CA 1.455 -0.204 0 N-CA-C 112.97 0.73 . . . . 0.0 112.97 -171.911 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 159' ' ' HIS . . . . . . . . . . . . . 97.6 m-70 . . . . . 0 C--O 1.251 1.134 0 CA-C-O 117.759 -1.115 . . . . 0.0 108.956 169.097 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' B' B 2052 ' ' ASP . . . . . . . . . . . . . 23.9 m-20 . . . . . 0 N--CA 1.47 0.541 0 N-CA-C 109.637 -0.505 . . . . 0.0 109.637 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' B' B 2053 ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER 57.43 35.28 25.74 Favored 'General case' 0 N--CA 1.454 -0.243 0 N-CA-C 113.415 0.894 . . . . 0.0 113.415 168.582 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B 2054 ' ' ASP . . . . . . . . . . . . . 55.2 t0 -142.18 69.16 1.32 Allowed 'General case' 0 CA--C 1.533 0.293 0 C-N-CA 123.047 0.539 . . . . 0.0 110.05 -177.03 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B 2055 ' ' GLU . . . . . 0.465 ' HB3' ' H ' ' A' ' 27' ' ' SER . 60.9 tt0 55.11 49.02 18.35 Favored 'General case' 0 CA--C 1.531 0.224 0 C-N-CA 124.319 1.048 . . . . 0.0 110.42 -177.209 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B 2056 ' ' ASP . . . . . . . . . . . . . 17.1 m-20 -57.96 -6.66 0.6 Allowed 'General case' 0 C--N 1.341 0.199 0 C-N-CA 125.231 1.412 . . . . 0.0 114.675 -172.77 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B 2057 ' ' ASP . . . . . . . . . . . . . 24.6 t0 -150.62 112.43 4.52 Favored 'General case' 0 N--CA 1.452 -0.339 0 CA-C-N 119.166 0.893 . . . . 0.0 110.267 173.621 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B 2058 ' ' TYR . . . . . . . . . . . . . 3.4 t80 -66.99 -25.27 66.23 Favored 'General case' 0 N--CA 1.455 -0.219 0 C-N-CA 125.19 1.396 . . . . 0.0 110.451 179.112 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B 2059 ' ' THR . . . . . . . . . . . . . 8.1 t 34.33 55.38 1.76 Allowed Pre-proline 0 C--N 1.344 0.357 0 C-N-CA 124.984 1.314 . . . . 0.0 112.315 178.924 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B 2060 ' ' PRO . . . . . . . . . . . . . 42.1 Cg_endo -62.22 157.71 43.55 Favored 'Trans proline' 0 N--CA 1.451 -1.001 0 C-N-CA 123.257 2.638 . . . . 0.0 111.735 -171.194 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B 2061 ' ' SER . . . . . . . . . . . . . 45.7 t -149.45 168.45 23.4 Favored 'General case' 0 N--CA 1.452 -0.352 0 CA-C-N 115.703 -0.68 . . . . 0.0 109.725 -178.207 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B 2062 ' ' ILE . . . . . . . . . . . . . 11.6 tt -158.61 153.64 5.63 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.174 0 N-CA-C 109.237 -0.653 . . . . 0.0 109.237 -174.559 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B 2063 ' ' SER . . . . . . . . . . . . . 48.4 t . . . . . 0 C--O 1.252 1.196 0 CA-C-O 117.992 -1.004 . . . . 0.0 111.9 179.452 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 56.5 ttp . . . . . 0 N--CA 1.474 0.726 0 CA-C-O 119.248 -0.406 . . . . 0.0 111.565 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 41.7 tp60 60.77 35.19 19.63 Favored 'General case' 0 CA--C 1.531 0.245 0 CA-C-O 121.748 0.785 . . . . 0.0 110.818 178.204 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 12.0 tt0 -153.43 164.14 38.71 Favored 'General case' 0 N--CA 1.45 -0.44 0 N-CA-C 108.58 -0.896 . . . . 0.0 108.58 -179.237 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 14.0 m-20 55.09 26.28 8.02 Favored 'General case' 0 C--O 1.23 0.074 0 C-N-CA 123.567 0.747 . . . . 0.0 112.899 179.572 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 31.5 t0 56.35 38.15 29.48 Favored 'General case' 0 C--N 1.331 -0.227 0 C-N-CA 124.022 0.929 . . . . 0.0 111.534 -179.68 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 31.3 p-10 -57.65 -34.06 68.95 Favored 'General case' 0 N--CA 1.454 -0.256 0 N-CA-C 110.283 -0.265 . . . . 0.0 110.283 179.456 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' PHE . . . . . 0.514 ' CD1' ' HD3' ' A' ' 45' ' ' LYS . 1.3 t80 -57.28 -41.84 80.53 Favored 'General case' 0 N--CA 1.451 -0.376 0 C-N-CA 123.496 0.718 . . . . 0.0 111.714 -179.658 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 46.1 tp60 -53.73 -33.94 57.27 Favored 'General case' 0 N--CA 1.456 -0.127 0 C-N-CA 122.777 0.431 . . . . 0.0 111.653 -176.537 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 18.8 m-80 -70.92 -31.12 67.63 Favored 'General case' 0 N--CA 1.451 -0.398 0 N-CA-C 109.944 -0.391 . . . . 0.0 109.944 -179.964 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' PHE . . . . . 0.467 ' CE2' ' HB2' ' A' ' 32' ' ' LEU . 10.9 t80 -71.54 -39.02 70.97 Favored 'General case' 0 N--CA 1.452 -0.343 0 N-CA-C 109.419 -0.586 . . . . 0.0 109.419 176.189 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 57.5 t -63.15 -55.83 21.01 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.359 0 N-CA-C 109.18 -0.674 . . . . 0.0 109.18 179.059 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -60.24 -29.22 68.62 Favored 'General case' 0 N--CA 1.453 -0.291 0 C-N-CA 123.277 0.631 . . . . 0.0 112.161 -179.922 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 99.9 m -72.62 -39.74 67.02 Favored 'General case' 0 CA--C 1.53 0.211 0 CA-C-N 118.904 0.775 . . . . 0.0 109.403 177.268 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.485 ' HA ' ' CD1' ' A' ' 17' ' ' PHE . 14.2 tp -65.23 -46.71 79.51 Favored 'General case' 0 N--CA 1.454 -0.233 0 CA-C-O 121.644 0.735 . . . . 0.0 109.467 178.192 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 69.0 mm-40 -63.4 -29.58 70.85 Favored 'General case' 0 N--CA 1.45 -0.443 0 C-N-CA 124.136 0.974 . . . . 0.0 110.048 178.898 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 42.3 t -69.46 -32.24 71.04 Favored 'General case' 0 N--CA 1.452 -0.336 0 N-CA-C 109.679 -0.489 . . . . 0.0 109.679 177.375 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' PHE . . . . . 0.485 ' CD1' ' HA ' ' A' ' 14' ' ' LEU . 19.7 m-85 -63.61 -42.05 98.25 Favored 'General case' 0 N--CA 1.454 -0.25 0 C-N-CA 119.388 -0.925 . . . . 0.0 109.604 172.559 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 67.1 mttt -61.82 -28.54 69.55 Favored 'General case' 0 C--N 1.341 0.2 0 O-C-N 122.985 0.178 . . . . 0.0 110.833 -178.776 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 54.5 t0 -73.95 -43.62 57.63 Favored 'General case' 0 N--CA 1.455 -0.177 0 O-C-N 123.48 0.488 . . . . 0.0 111.019 178.829 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . 0.442 HD12 ' HB2' ' A' ' 25' ' ' SER . 63.6 mt -57.82 144.13 39.75 Favored 'General case' 0 N--CA 1.454 -0.228 0 O-C-N 122.048 -0.408 . . . . 0.0 111.073 -177.157 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . 0.508 ' HE2' ' OD1' ' B' 2052 ' ' ASP . 1.0 OUTLIER -83.7 -22.86 31.92 Favored 'General case' 0 N--CA 1.453 -0.323 0 N-CA-C 109.652 -0.499 . . . . 0.0 109.652 177.001 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' SER . . . . . 0.418 ' C ' ' H ' ' A' ' 24' ' ' ILE . 68.8 m -75.36 -24.09 57.26 Favored 'General case' 0 N--CA 1.456 -0.148 0 N-CA-C 109.832 -0.433 . . . . 0.0 109.832 170.335 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 70.64 -31.69 0.48 Allowed Glycine 0 CA--C 1.527 0.799 0 C-N-CA 124.883 1.23 . . . . 0.0 112.103 179.689 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . 0.418 ' H ' ' C ' ' A' ' 22' ' ' SER . 47.2 mt -87.23 154.95 3.28 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.523 0 C-N-CA 123.801 0.841 . . . . 0.0 109.143 173.881 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . 0.442 ' HB2' HD12 ' A' ' 20' ' ' LEU . 32.7 t -158.29 81.46 0.83 Allowed 'General case' 0 CA--C 1.517 -0.319 0 N-CA-C 109.886 -0.413 . . . . 0.0 109.886 177.82 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -50.58 -33.01 25.13 Favored Glycine 0 CA--C 1.529 0.927 0 CA-C-O 119.499 -0.612 . . . . 0.0 112.43 -175.442 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 40.3 t -73.13 -52.39 14.38 Favored 'General case' 0 N--CA 1.453 -0.298 0 CA-C-N 118.205 1.003 . . . . 0.0 110.771 -179.709 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 82.6 mtt85 -69.88 -31.74 69.71 Favored 'General case' 0 C--N 1.34 0.189 0 CA-C-N 117.544 0.156 . . . . 0.0 110.681 -177.491 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 53.0 mt -59.77 -45.81 94.28 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.724 0 N-CA-C 108.164 -1.05 . . . . 0.0 108.164 174.423 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 33.5 mtmm -68.22 -23.32 64.8 Favored 'General case' 0 N--CA 1.454 -0.234 0 CA-C-O 118.606 -0.711 . . . . 0.0 111.869 177.06 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . 0.413 ' HE3' ' HA ' ' A' ' 31' ' ' LYS . 0.0 OUTLIER -65.04 -59.4 4.19 Favored 'General case' 0 C--N 1.341 0.197 0 CA-C-N 119.341 0.973 . . . . 0.0 110.281 177.777 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.487 HD12 ' N ' ' A' ' 33' ' ' THR . 1.2 pp -75.29 -17.94 60.17 Favored 'General case' 0 CA--C 1.531 0.245 0 C-N-CA 119.47 -0.892 . . . . 0.0 112.068 -177.271 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . 0.487 ' N ' HD12 ' A' ' 32' ' ' LEU . 55.2 m -72.66 -38.75 67.55 Favored 'General case' 0 N--CA 1.457 -0.123 0 N-CA-C 108.898 -0.779 . . . . 0.0 108.898 175.684 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 98.8 m -70.4 -37.4 74.46 Favored 'General case' 0 N--CA 1.453 -0.321 0 N-CA-C 109.861 -0.422 . . . . 0.0 109.861 179.995 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 19.8 t80 -61.64 -38.26 87.05 Favored 'General case' 0 C--N 1.34 0.159 0 N-CA-C 109.962 -0.385 . . . . 0.0 109.962 175.359 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -68.07 -37.54 81.38 Favored 'General case' 0 N--CA 1.447 -0.621 0 CA-C-N 116.791 -0.186 . . . . 0.0 110.945 -179.331 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 3.2 mm? -71.05 -35.97 72.15 Favored 'General case' 0 CA--C 1.522 -0.114 0 C-N-CA 122.096 0.158 . . . . 0.0 110.948 -179.369 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 41.5 t0 -72.86 -14.62 61.53 Favored 'General case' 0 N--CA 1.452 -0.337 0 C-N-CA 122.472 0.309 . . . . 0.0 110.588 177.238 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 96.6 m-70 -151.52 88.99 1.45 Allowed 'General case' 0 CA--C 1.53 0.192 0 C-N-CA 122.935 0.494 . . . . 0.0 111.411 -173.897 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -75.42 -12.71 14.88 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.232 0 O-C-N 122.023 -0.423 . . . . 0.0 111.024 175.707 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -57.24 -24.38 54.33 Favored 'General case' 0 C--O 1.228 -0.045 0 C-N-CA 123.34 0.656 . . . . 0.0 111.762 -176.404 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -106.98 18.63 5.77 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.24 0 C-N-CA 123.291 0.637 . . . . 0.0 112.58 178.768 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 3.0 pp20? -54.0 -28.61 39.03 Favored 'General case' 0 CA--C 1.528 0.129 0 CA-C-N 118.723 0.692 . . . . 0.0 111.7 177.848 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 29.6 t -65.39 -46.14 81.27 Favored 'General case' 0 N--CA 1.452 -0.335 0 O-C-N 122.384 -0.198 . . . . 0.0 110.936 -176.199 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . 0.514 ' HD3' ' CD1' ' A' ' 7' ' ' PHE . 19.2 ptpt -74.69 -26.9 60.15 Favored 'General case' 0 C--N 1.339 0.13 0 N-CA-C 109.566 -0.531 . . . . 0.0 109.566 177.908 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 61.0 mt -68.63 -48.8 69.88 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.228 0 N-CA-C 109.823 -0.436 . . . . 0.0 109.823 -179.036 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 47' ' ' ILE . . . . . 0.435 HD13 HD11 ' A' ' 50' ' ' ILE . 35.4 mm -63.84 -38.25 81.86 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.249 0 N-CA-C 109.065 -0.717 . . . . 0.0 109.065 176.944 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 49.8 m -63.33 -42.64 98.99 Favored 'General case' 0 CA--C 1.531 0.23 0 C-N-CA 120.82 -0.352 . . . . 0.0 111.5 -178.345 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 6.9 mp -73.51 -36.35 65.72 Favored 'General case' 0 N--CA 1.453 -0.276 0 N-CA-C 112.652 0.612 . . . . 0.0 112.652 -176.332 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . 0.468 HD12 HG12 ' A' ' 69' ' ' ILE . 5.5 pt -71.63 -44.4 69.76 Favored 'Isoleucine or valine' 0 C--N 1.34 0.169 0 CA-C-N 119.352 0.978 . . . . 0.0 110.846 -178.55 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 51' ' ' ILE . . . . . 0.526 HG22 HD11 ' A' ' 108' ' ' LEU . 16.2 pt -66.12 -38.04 81.1 Favored 'Isoleucine or valine' 0 C--N 1.335 -0.055 0 C-N-CA 120.192 -0.603 . . . . 0.0 110.785 -179.783 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 90.7 m-20 -70.86 -41.07 71.9 Favored 'General case' 0 N--CA 1.454 -0.274 0 CA-C-N 118.107 0.412 . . . . 0.0 111.756 178.365 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 18.8 t80 -63.61 -41.3 98.32 Favored 'General case' 0 N--CA 1.455 -0.182 0 N-CA-C 109.081 -0.711 . . . . 0.0 109.081 175.93 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 23.3 t -62.25 -38.91 91.05 Favored 'General case' 0 N--CA 1.45 -0.462 0 C-N-CA 122.437 0.295 . . . . 0.0 111.435 -176.64 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 55.6 mtm180 -75.12 -40.88 59.47 Favored 'General case' 0 N--CA 1.456 -0.156 0 N-CA-C 111.913 0.338 . . . . 0.0 111.913 -177.239 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 48.7 mt -80.46 -44.52 19.1 Favored 'General case' 0 N--CA 1.455 -0.206 0 N-CA-C 113.221 0.823 . . . . 0.0 113.221 -176.023 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 14.5 p -62.68 159.45 43.58 Favored Pre-proline 0 CA--C 1.535 0.382 0 N-CA-C 114.241 1.2 . . . . 0.0 114.241 -170.701 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 35.9 Cg_exo -58.79 -179.51 0.15 Allowed 'Trans proline' 0 N--CA 1.454 -0.822 1 C-N-CA 125.758 4.306 . . . . 0.0 113.746 174.423 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 42.3 p-10 -66.4 -42.65 87.52 Favored 'General case' 0 CA--C 1.533 0.298 0 C-N-CA 124.534 1.134 . . . . 0.0 113.364 -175.013 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 39.8 m -72.75 -37.03 67.81 Favored 'General case' 0 N--CA 1.455 -0.189 0 O-C-N 121.773 -0.58 . . . . 0.0 109.762 179.74 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 55.4 m80 -69.02 -27.87 66.06 Favored 'General case' 0 N--CA 1.45 -0.425 0 CA-C-N 116.176 -0.465 . . . . 0.0 109.867 176.025 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . 0.487 ' HE3' ' HB2' ' A' ' 112' ' ' ALA . 56.4 tptt -65.88 -45.39 82.24 Favored 'General case' 0 C--N 1.338 0.108 0 C-N-CA 122.623 0.369 . . . . 0.0 110.025 177.877 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . 0.515 HD12 ' CD2' ' A' ' 120' ' ' HIS . 0.3 OUTLIER -61.29 -41.94 97.82 Favored 'General case' 0 N--CA 1.455 -0.213 0 N-CA-C 108.458 -0.941 . . . . 0.0 108.458 177.641 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -65.22 -29.26 74.87 Favored Glycine 0 CA--C 1.527 0.791 0 N-CA-C 111.964 -0.454 . . . . 0.0 111.964 178.554 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 37.0 p -68.7 -37.1 79.26 Favored 'General case' 0 N--CA 1.451 -0.375 0 CA-C-N 117.931 0.866 . . . . 0.0 110.062 178.462 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 95.1 mt -75.32 -24.81 57.47 Favored 'General case' 0 N--CA 1.452 -0.338 0 CA-C-N 116.596 -0.275 . . . . 0.0 110.726 178.98 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 9.6 m-30 -70.69 -36.01 73.08 Favored 'General case' 0 CA--C 1.515 -0.374 0 CA-C-N 118.338 0.517 . . . . 0.0 110.422 174.007 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 68' ' ' ILE . . . . . 0.472 HD11 ' CE1' ' A' ' 17' ' ' PHE . 22.0 mt -68.29 -54.3 22.76 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.621 0 N-CA-C 107.448 -1.315 . . . . 0.0 107.448 177.69 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 69' ' ' ILE . . . . . 0.468 HG12 HD12 ' A' ' 50' ' ' ILE . 65.5 mt -50.39 -37.14 14.28 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.174 0 C-N-CA 123.885 0.874 . . . . 0.0 111.802 175.021 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 8.8 t70 -71.06 -54.85 9.71 Favored 'General case' 0 CA--C 1.521 -0.147 0 CA-C-N 118.819 0.736 . . . . 0.0 111.487 -179.737 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 53.6 p -66.87 -44.26 81.4 Favored 'General case' 0 N--CA 1.452 -0.373 0 O-C-N 123.161 0.288 . . . . 0.0 110.499 -175.25 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -75.13 -36.65 38.22 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.246 0 N-CA-C 109.629 -0.508 . . . . 0.0 109.629 179.731 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -67.09 -46.15 75.32 Favored Glycine 0 C--N 1.337 0.622 0 N-CA-C 111.417 -0.673 . . . . 0.0 111.417 -175.351 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 39.0 mtm105 -69.81 -42.61 73.47 Favored 'General case' 0 CA--C 1.517 -0.309 0 CA-C-N 117.37 0.585 . . . . 0.0 109.906 177.913 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -64.83 -33.88 77.05 Favored 'General case' 0 N--CA 1.45 -0.432 0 CA-C-O 119.335 -0.364 . . . . 0.0 110.918 -178.191 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 1.0 OUTLIER -68.18 -45.45 73.4 Favored 'General case' 0 CA--C 1.519 -0.241 0 CA-C-N 118.571 0.623 . . . . 0.0 110.929 177.076 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . 0.436 ' HA ' ' SG ' ' A' ' 94' ' ' CYS . 6.5 tt -66.62 -48.17 70.33 Favored 'General case' 0 N--CA 1.447 -0.596 0 C-N-CA 118.249 -1.381 . . . . 0.0 108.24 -178.266 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 90.4 m-20 -54.19 -44.96 72.0 Favored 'General case' 0 C--O 1.228 -0.079 0 N-CA-C 112.864 0.69 . . . . 0.0 112.864 177.979 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 15.5 tm-20 -61.53 -50.2 73.64 Favored 'General case' 0 N--CA 1.448 -0.548 0 CA-C-N 117.878 0.308 . . . . 0.0 111.117 -177.752 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 80' ' ' THR . . . . . 0.625 HG21 ' HB3' ' A' ' 94' ' ' CYS . 31.6 p -72.82 -26.88 61.65 Favored 'General case' 0 N--CA 1.453 -0.276 0 C-N-CA 120.477 -0.489 . . . . 0.0 110.412 -178.12 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 33.2 ttp180 -70.4 -23.7 62.8 Favored 'General case' 0 N--CA 1.45 -0.448 0 C-N-CA 123.676 0.79 . . . . 0.0 111.061 175.022 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 34.0 t -84.1 -14.04 51.45 Favored 'General case' 0 N--CA 1.454 -0.262 0 N-CA-C 113.14 0.793 . . . . 0.0 113.14 -179.13 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 26.6 p30 -151.94 16.61 0.66 Allowed 'General case' 0 CA--C 1.519 -0.223 0 N-CA-C 114.064 1.135 . . . . 0.0 114.064 -175.292 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 25.2 p 63.22 19.22 11.54 Favored 'General case' 0 N--CA 1.448 -0.557 0 N-CA-C 114.501 1.297 . . . . 0.0 114.501 174.599 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 99.1 m-20 -55.13 -24.5 26.47 Favored 'General case' 0 CA--C 1.53 0.201 0 CA-C-N 119.182 0.901 . . . . 0.0 111.556 179.661 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 40.7 t -68.28 -7.48 31.2 Favored 'General case' 0 CA--C 1.531 0.24 0 C-N-CA 122.685 0.394 . . . . 0.0 111.946 -178.781 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 92.8 p -83.79 -15.08 49.76 Favored 'General case' 0 C--N 1.339 0.144 0 C-N-CA 122.683 0.393 . . . . 0.0 111.355 176.93 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 86.5 p -81.84 -157.62 0.2 Allowed 'General case' 0 CA--C 1.531 0.22 0 C-N-CA 123.411 0.685 . . . . 0.0 110.231 -179.061 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 2.0 p-10 -55.12 143.07 28.42 Favored 'General case' 0 CA--C 1.528 0.128 0 C-N-CA 122.953 0.501 . . . . 0.0 109.872 178.906 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -71.29 -64.89 1.04 Allowed Pre-proline 0 N--CA 1.456 -0.128 0 CA-C-O 118.073 -0.965 . . . . 0.0 110.702 -175.917 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 31.5 Cg_exo -59.53 139.21 88.15 Favored 'Trans proline' 0 N--CA 1.447 -1.211 0 N-CA-C 108.209 -1.496 . . . . 0.0 108.209 172.987 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 90.68 16.57 54.6 Favored Glycine 0 CA--C 1.526 0.766 0 CA-C-O 119.369 -0.684 . . . . 0.0 112.28 -176.756 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 78.0 p -151.2 172.17 16.25 Favored 'General case' 0 N--CA 1.455 -0.213 0 CA-C-N 118.05 0.925 . . . . 0.0 111.349 176.307 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 94' ' ' CYS . . . . . 0.625 ' HB3' HG21 ' A' ' 80' ' ' THR . 5.3 t -57.03 -27.21 61.44 Favored 'General case' 0 N--CA 1.451 -0.422 0 CA-C-N 115.196 -0.911 . . . . 0.0 109.91 173.376 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -56.11 -59.25 5.19 Favored 'General case' 0 N--CA 1.446 -0.653 0 N-CA-C 109.384 -0.599 . . . . 0.0 109.384 -176.189 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 73.6 t60 -74.59 -34.44 62.87 Favored 'General case' 0 N--CA 1.45 -0.472 0 CA-C-N 116.36 -0.382 . . . . 0.0 111.419 -179.152 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -64.93 -50.67 65.55 Favored 'General case' 0 N--CA 1.454 -0.261 0 O-C-N 122.969 0.168 . . . . 0.0 111.356 -177.145 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 98' ' ' ILE . . . . . 0.593 HD13 ' SG ' ' A' ' 94' ' ' CYS . 1.7 mp -73.61 -32.31 35.31 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.207 0 N-CA-C 110.033 -0.358 . . . . 0.0 110.033 -178.32 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 2.0 m120 -67.11 -45.24 77.79 Favored 'General case' 0 N--CA 1.453 -0.306 0 CA-C-N 118.062 0.392 . . . . 0.0 111.101 176.838 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 95.9 m -70.67 -33.64 71.16 Favored 'General case' 0 N--CA 1.457 -0.12 0 CA-C-N 117.947 0.339 . . . . 0.0 110.497 -177.109 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 68.4 tp -73.58 -30.39 62.99 Favored 'General case' 0 N--CA 1.451 -0.408 0 C-N-CA 122.661 0.385 . . . . 0.0 110.946 -179.104 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -70.09 -19.84 75.91 Favored Glycine 0 CA--C 1.529 0.922 0 CA-C-O 119.555 -0.581 . . . . 0.0 112.828 -176.998 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 14.6 mm-40 -80.23 -39.46 29.01 Favored 'General case' 0 C--O 1.231 0.125 0 CA-C-N 118.008 0.904 . . . . 0.0 111.381 179.998 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 30.3 m -97.87 -8.87 9.09 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.158 0 N-CA-C 113.177 0.806 . . . . 0.0 113.177 -173.868 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 105' ' ' ILE . . . . . . . . . . . . . 10.6 tp -57.15 -26.78 26.09 Favored 'Isoleucine or valine' 0 CA--C 1.528 0.124 0 CA-C-N 119.162 0.892 . . . . 0.0 111.655 -176.716 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 106' ' ' GLN . . . . . 0.401 ' HA ' ' CD1' ' A' ' 145' ' ' ILE . 25.4 pt20 -67.48 -30.04 69.64 Favored 'General case' 0 N--CA 1.454 -0.267 0 O-C-N 122.182 -0.324 . . . . 0.0 110.523 178.852 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 66.5 mt-10 -73.98 -41.6 61.68 Favored 'General case' 0 N--CA 1.455 -0.201 0 N-CA-C 108.795 -0.817 . . . . 0.0 108.795 177.315 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 108' ' ' LEU . . . . . 0.526 HD11 HG22 ' A' ' 51' ' ' ILE . 41.1 mt -68.65 -42.73 77.53 Favored 'General case' 0 N--CA 1.449 -0.505 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.573 -174.348 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 95.9 mt -72.61 -47.1 50.58 Favored 'General case' 0 N--CA 1.451 -0.416 0 CA-C-O 119.01 -0.519 . . . . 0.0 111.319 -179.033 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 44.6 t -61.89 -41.19 97.58 Favored 'General case' 0 C--O 1.233 0.204 0 CA-C-N 118.849 0.75 . . . . 0.0 110.684 -179.295 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 22.6 t0 -59.25 -40.26 85.43 Favored 'General case' 0 N--CA 1.453 -0.289 0 N-CA-C 108.469 -0.937 . . . . 0.0 108.469 174.7 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 112' ' ' ALA . . . . . 0.487 ' HB2' ' HE3' ' A' ' 62' ' ' LYS . . . -69.33 -38.75 78.32 Favored 'General case' 0 N--CA 1.443 -0.779 0 C-N-CA 120.603 -0.439 . . . . 0.0 111.138 -175.768 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 113' ' ' ILE . . . . . 0.45 ' O ' ' HE2' ' A' ' 121' ' ' LYS . 36.6 mm -66.21 -42.37 90.92 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.473 0 C-N-CA 118.809 -1.156 . . . . 0.0 109.739 -178.276 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -71.96 -46.86 55.9 Favored 'General case' 0 N--CA 1.451 -0.422 0 N-CA-C 111.555 0.205 . . . . 0.0 111.555 -178.899 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 33.1 ttpt -76.77 -37.25 56.22 Favored 'General case' 0 N--CA 1.451 -0.384 0 N-CA-C 113.497 0.925 . . . . 0.0 113.497 -175.405 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 116' ' ' SER . . . . . 0.488 ' HB2' ' CB ' ' A' ' 120' ' ' HIS . 24.4 p -76.54 159.82 30.0 Favored 'General case' 0 CA--C 1.527 0.095 0 N-CA-C 112.605 0.595 . . . . 0.0 112.605 -170.678 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 11.6 m120 -76.68 168.4 20.15 Favored 'General case' 0 CA--C 1.519 -0.236 0 C-N-CA 123.227 0.611 . . . . 0.0 111.851 -179.719 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 118' ' ' GLN . . . . . . . . . . . . . 12.7 mm100 -53.75 -42.23 67.96 Favored 'General case' 0 C--O 1.233 0.216 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.559 -178.394 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 18.4 t0 -66.67 -32.73 74.23 Favored 'General case' 0 N--CA 1.456 -0.164 0 N-CA-C 109.303 -0.628 . . . . 0.0 109.303 -179.622 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 120' ' ' HIS . . . . . 0.515 ' CD2' HD12 ' A' ' 63' ' ' LEU . 20.8 m170 -76.05 -40.38 53.48 Favored 'General case' 0 N--CA 1.449 -0.491 0 CA-C-N 116.002 -0.544 . . . . 0.0 110.073 -178.859 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 121' ' ' LYS . . . . . 0.45 ' HE2' ' O ' ' A' ' 113' ' ' ILE . 96.0 mttt -54.98 -41.04 70.69 Favored 'General case' 0 C--N 1.339 0.118 0 N-CA-C 108.222 -1.029 . . . . 0.0 108.222 177.932 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 46.0 tp10 -70.63 -39.31 73.79 Favored 'General case' 0 CA--C 1.53 0.178 0 N-CA-C 111.467 0.173 . . . . 0.0 111.467 178.222 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 92.0 mttt -71.36 -26.43 62.8 Favored 'General case' 0 N--CA 1.452 -0.335 0 O-C-N 121.835 -0.541 . . . . 0.0 110.827 -179.266 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 124' ' ' ILE . . . . . . . . . . . . . 69.1 mt -69.99 -40.25 78.37 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.244 0 N-CA-C 108.653 -0.869 . . . . 0.0 108.653 174.233 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 125' ' ' ARG . . . . . 0.446 HH11 ' HA ' ' A' ' 125' ' ' ARG . 6.6 mmm180 -61.28 -48.41 81.53 Favored 'General case' 0 N--CA 1.45 -0.433 0 CA-C-O 118.899 -0.572 . . . . 0.0 111.518 179.269 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 126' ' ' MET . . . . . . . . . . . . . 28.7 ptm -62.96 -30.11 71.33 Favored 'General case' 0 N--CA 1.453 -0.284 0 C-N-CA 119.183 -1.007 . . . . 0.0 109.299 179.217 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 1.2 mp -62.44 -39.29 92.86 Favored 'General case' 0 C--N 1.339 0.146 0 CA-C-N 118.187 0.449 . . . . 0.0 111.037 175.957 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 80.8 mt -72.72 -36.76 67.87 Favored 'General case' 0 N--CA 1.455 -0.223 0 CA-C-N 118.488 0.586 . . . . 0.0 110.127 179.614 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 15.1 m-20 -65.71 -35.84 81.91 Favored 'General case' 0 N--CA 1.454 -0.274 0 N-CA-C 109.351 -0.611 . . . . 0.0 109.351 176.624 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 130' ' ' ILE . . . . . 0.412 ' HA ' ' HD3' ' A' ' 133' ' ' ARG . 35.7 mt -63.62 -36.43 76.41 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.229 0 C-N-CA 122.487 0.315 . . . . 0.0 110.212 176.423 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 131' ' ' TRP . . . . . . . . . . . . . 46.4 m0 -73.8 -31.01 63.05 Favored 'General case' 0 N--CA 1.449 -0.481 0 N-CA-C 112.899 0.703 . . . . 0.0 112.899 179.54 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 82.9 m-20 -70.36 -34.3 72.45 Favored 'General case' 0 N--CA 1.456 -0.172 0 CA-C-N 118.458 0.572 . . . . 0.0 110.577 176.889 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 133' ' ' ARG . . . . . 0.446 ' HB2' HD11 ' B' 2062 ' ' ILE . 23.1 mtp180 -72.36 -33.94 67.63 Favored 'General case' 0 N--CA 1.456 -0.163 0 C-N-CA 123.221 0.608 . . . . 0.0 109.823 177.747 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 37.0 m -80.47 -14.59 58.14 Favored 'General case' 0 N--CA 1.453 -0.3 0 C-N-CA 123.409 0.684 . . . . 0.0 111.973 -178.918 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 135' ' ' GLY . . . . . . . . . . . . . . . 85.09 11.5 76.04 Favored Glycine 0 CA--C 1.53 1.008 0 CA-C-O 119.121 -0.822 . . . . 0.0 113.564 177.538 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 136' ' ' LEU . . . . . . . . . . . . . 11.0 mp -69.01 154.58 41.83 Favored 'General case' 0 C--O 1.232 0.133 0 CA-C-N 118.759 1.28 . . . . 0.0 109.292 177.612 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 137' ' ' PHE . . . . . . . . . . . . . 81.9 m-85 -77.68 -22.32 50.72 Favored 'General case' 0 N--CA 1.453 -0.295 0 N-CA-C 112.189 0.44 . . . . 0.0 112.189 -175.672 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 138' ' ' GLN . . . . . . . . . . . . . 25.9 mp0 -75.15 132.88 41.49 Favored 'General case' 0 N--CA 1.455 -0.193 0 C-N-CA 122.845 0.458 . . . . 0.0 110.802 -178.809 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 139' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -174.74 175.71 2.38 Favored 'General case' 0 C--N 1.341 0.211 0 C-N-CA 123.916 0.886 . . . . 0.0 110.807 175.618 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 140' ' ' SER . . . . . . . . . . . . . 42.6 t -74.08 64.48 1.04 Allowed 'General case' 0 N--CA 1.454 -0.238 0 C-N-CA 124.336 1.054 . . . . 0.0 112.977 -176.351 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 141' ' ' TYR . . . . . . . . . . . . . 86.0 m-85 -66.36 -72.94 0.14 Allowed 'General case' 0 N--CA 1.455 -0.178 0 O-C-N 122.014 -0.429 . . . . 0.0 109.876 174.777 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 142' ' ' LEU . . . . . . . . . . . . . 73.2 mt -69.78 155.57 40.34 Favored 'General case' 0 N--CA 1.454 -0.267 0 C-N-CA 123.249 0.62 . . . . 0.0 111.844 -175.396 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 21.1 p30 -68.83 -11.56 60.58 Favored 'General case' 0 N--CA 1.453 -0.283 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.621 177.446 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . -68.12 -32.23 72.38 Favored 'General case' 0 N--CA 1.454 -0.253 0 N-CA-C 110.155 -0.313 . . . . 0.0 110.155 177.046 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 145' ' ' ILE . . . . . 0.401 ' CD1' ' HA ' ' A' ' 106' ' ' GLN . 29.5 mm -69.38 -26.75 32.12 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.262 0 N-CA-C 109.812 -0.44 . . . . 0.0 109.812 177.549 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 146' ' ' ARG . . . . . . . . . . . . . 81.7 mtt85 -81.17 -34.0 32.66 Favored 'General case' 0 N--CA 1.451 -0.378 0 N-CA-C 110.188 -0.301 . . . . 0.0 110.188 177.774 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 147' ' ' SER . . . . . . . . . . . . . 37.7 m 41.85 50.65 4.1 Favored 'General case' 0 C--N 1.344 0.359 0 C-N-CA 123.647 0.779 . . . . 0.0 110.893 178.793 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -36.91 -41.74 0.35 Allowed 'General case' 0 N--CA 1.448 -0.555 0 C-N-CA 126.279 1.832 . . . . 0.0 113.145 179.471 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 149' ' ' CYS . . . . . . . . . . . . . 13.9 p -71.29 -61.42 1.78 Allowed 'General case' 0 N--CA 1.448 -0.529 0 N-CA-C 109.976 -0.379 . . . . 0.0 109.976 -177.186 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 150' ' ' PHE . . . . . . . . . . . . . 15.6 m-85 -66.89 -16.31 64.23 Favored 'General case' 0 N--CA 1.454 -0.256 0 CA-C-N 118.561 0.618 . . . . 0.0 111.421 -175.399 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 151' ' ' ALA . . . . . . . . . . . . . . . -73.94 -46.69 42.61 Favored 'General case' 0 N--CA 1.449 -0.497 0 CA-C-O 119.438 -0.315 . . . . 0.0 110.447 176.546 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 152' ' ' MET . . . . . . . . . . . . . 93.4 mtp -85.74 -31.47 22.39 Favored 'General case' 0 CA--C 1.532 0.258 0 N-CA-C 112.71 0.633 . . . . 0.0 112.71 -179.259 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 153' ' ' ASP . . . . . . . . . . . . . 72.6 m-20 -74.55 -12.73 60.54 Favored 'General case' 0 N--CA 1.455 -0.221 0 C-N-CA 124.009 0.924 . . . . 0.0 112.735 -175.627 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 154' ' ' LEU . . . . . . . . . . . . . 79.6 mt -126.81 144.65 50.9 Favored 'General case' 0 N--CA 1.453 -0.322 0 CA-C-N 118.274 0.488 . . . . 0.0 110.799 -176.823 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 155' ' ' GLU . . . . . . . . . . . . . 1.9 pp20? -137.72 4.85 2.6 Favored 'General case' 0 N--CA 1.455 -0.221 0 C-N-CA 123.746 0.818 . . . . 0.0 111.454 -177.293 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 156' ' ' HIS . . . . . . . . . . . . . 33.1 p-80 -59.77 128.92 39.34 Favored 'General case' 0 N--CA 1.451 -0.423 0 CA-C-O 121.304 0.574 . . . . 0.0 111.389 -172.01 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 157' ' ' HIS . . . . . . . . . . . . . 20.2 t-160 -161.83 19.78 0.11 Allowed 'General case' 0 CA--C 1.532 0.257 0 C-N-CA 124.855 1.262 . . . . 0.0 108.31 175.222 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 158' ' ' HIS . . . . . . . . . . . . . 16.6 p80 -156.07 169.66 23.97 Favored 'General case' 0 N--CA 1.45 -0.459 0 C-N-CA 123.968 0.907 . . . . 0.0 109.378 -170.929 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 159' ' ' HIS . . . . . . . . . . . . . 50.2 p-80 . . . . . 0 C--O 1.25 1.125 0 CA-C-O 117.295 -1.336 . . . . 0.0 109.826 -179.461 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' B' B 2052 ' ' ASP . . . . . 0.508 ' OD1' ' HE2' ' A' ' 21' ' ' LYS . 0.8 OUTLIER . . . . . 0 N--CA 1.472 0.661 0 CA-C-O 120.276 0.084 . . . . 0.0 110.793 . . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B 2053 ' ' ASP . . . . . . . . . . . . . 35.9 p-10 -100.7 9.04 42.94 Favored 'General case' 0 CA--C 1.532 0.257 0 C-N-CA 123.736 0.814 . . . . 0.0 112.464 -176.027 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B 2054 ' ' ASP . . . . . . . . . . . . . 3.0 p-10 -140.1 -158.5 0.86 Allowed 'General case' 0 N--CA 1.454 -0.249 0 CA-C-N 118.863 0.756 . . . . 0.0 111.218 -179.71 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B 2055 ' ' GLU . . . . . . . . . . . . . 41.5 mt-10 -59.89 -21.68 61.36 Favored 'General case' 0 CA--C 1.529 0.143 0 C-N-CA 124.135 0.974 . . . . 0.0 112.411 -176.539 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B 2056 ' ' ASP . . . . . . . . . . . . . 17.8 m-20 47.56 -118.26 0.91 Allowed 'General case' 0 N--CA 1.454 -0.258 0 C-N-CA 123.256 0.622 . . . . 0.0 110.922 -175.106 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B 2057 ' ' ASP . . . . . . . . . . . . . 43.1 t0 -55.5 96.7 0.02 OUTLIER 'General case' 0 CA--C 1.531 0.237 0 C-N-CA 123.761 0.824 . . . . 0.0 112.084 -173.195 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B 2058 ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -71.82 137.92 47.94 Favored 'General case' 0 N--CA 1.454 -0.262 0 C-N-CA 124.277 1.031 . . . . 0.0 110.673 -178.89 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B 2059 ' ' THR . . . . . . . . . . . . . 60.2 m -106.95 114.04 61.97 Favored Pre-proline 0 N--CA 1.453 -0.278 0 N-CA-C 109.199 -0.667 . . . . 0.0 109.199 178.158 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B 2060 ' ' PRO . . . . . . . . . . . . . 93.4 Cg_endo -74.26 132.5 16.54 Favored 'Trans proline' 0 N--CA 1.452 -0.968 0 C-N-CA 123.13 2.554 . . . . 0.0 111.348 -179.401 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B 2061 ' ' SER . . . . . . . . . . . . . 43.4 m -83.31 138.21 33.65 Favored 'General case' 0 N--CA 1.454 -0.232 0 N-CA-C 108.562 -0.903 . . . . 0.0 108.562 172.231 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B 2062 ' ' ILE . . . . . 0.446 HD11 ' HB2' ' A' ' 133' ' ' ARG . 5.9 tp -160.67 137.48 2.06 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.203 0 N-CA-C 112.693 0.627 . . . . 0.0 112.693 -176.973 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B 2063 ' ' SER . . . . . 0.414 ' C ' HH21 ' A' ' 133' ' ' ARG . 82.4 p . . . . . 0 C--O 1.251 1.173 0 CA-C-O 117.266 -1.349 . . . . 0.0 109.533 175.516 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 85.9 mtp . . . . . 0 N--CA 1.469 0.517 0 CA-C-O 119.239 -0.41 . . . . 0.0 110.727 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 24.5 mp0 -132.63 8.13 4.18 Favored 'General case' 0 C--N 1.341 0.23 0 N-CA-C 112.985 0.735 . . . . 0.0 112.985 -179.372 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 44.6 tp60 -153.0 -31.03 0.13 Allowed 'General case' 0 C--N 1.341 0.206 0 CA-C-N 118.585 0.63 . . . . 0.0 111.223 178.936 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 2.3 p-10 -78.28 160.28 27.98 Favored 'General case' 0 N--CA 1.452 -0.353 0 C-N-CA 123.443 0.697 . . . . 0.0 110.163 176.245 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 13.7 m-20 -80.83 24.79 0.47 Allowed 'General case' 0 N--CA 1.458 -0.063 0 N-CA-C 113.53 0.937 . . . . 0.0 113.53 -175.035 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 22.4 p-10 -67.05 -31.54 72.12 Favored 'General case' 0 C--N 1.334 -0.102 0 CA-C-O 121.275 0.559 . . . . 0.0 109.602 -177.806 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' PHE . . . . . 0.499 ' CE1' ' HD3' ' A' ' 45' ' ' LYS . 1.4 t80 -55.28 -34.72 64.34 Favored 'General case' 0 N--CA 1.447 -0.59 0 C-N-CA 125.007 1.323 . . . . 0.0 111.022 -178.314 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 50.8 tp60 -53.68 -34.82 59.99 Favored 'General case' 0 N--CA 1.454 -0.262 0 C-N-CA 123.448 0.699 . . . . 0.0 112.059 -177.189 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 27.9 m-80 -72.3 -33.36 67.34 Favored 'General case' 0 N--CA 1.453 -0.311 0 N-CA-C 110.052 -0.351 . . . . 0.0 110.052 -179.529 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' PHE . . . . . 0.512 ' CZ ' HG12 ' A' ' 46' ' ' ILE . 6.4 t80 -70.19 -39.39 75.23 Favored 'General case' 0 N--CA 1.45 -0.439 0 N-CA-C 108.794 -0.817 . . . . 0.0 108.794 176.18 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 88.3 t -65.89 -53.38 38.62 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.271 0 N-CA-C 109.163 -0.68 . . . . 0.0 109.163 179.054 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -58.2 -30.62 66.61 Favored 'General case' 0 N--CA 1.455 -0.221 0 C-N-CA 122.716 0.406 . . . . 0.0 111.305 -179.312 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 91.4 m -71.13 -40.36 71.44 Favored 'General case' 0 N--CA 1.453 -0.325 0 N-CA-C 109.131 -0.692 . . . . 0.0 109.131 176.213 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.46 ' HA ' ' CD1' ' A' ' 17' ' ' PHE . 8.2 tp -65.9 -41.55 91.33 Favored 'General case' 0 N--CA 1.449 -0.476 0 CA-C-O 121.416 0.627 . . . . 0.0 109.869 179.473 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 73.2 mm-40 -63.81 -27.96 69.54 Favored 'General case' 0 N--CA 1.448 -0.545 0 C-N-CA 124.133 0.973 . . . . 0.0 109.949 177.931 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 51.0 m -69.78 -30.65 68.27 Favored 'General case' 0 N--CA 1.453 -0.29 0 N-CA-C 109.74 -0.467 . . . . 0.0 109.74 176.474 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' PHE . . . . . 0.557 ' CD1' HD11 ' A' ' 68' ' ' ILE . 33.6 m-85 -69.98 -33.16 71.69 Favored 'General case' 0 C--N 1.339 0.137 0 C-N-CA 119.469 -0.892 . . . . 0.0 111.065 171.982 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . 0.475 ' HG2' ' CE1' ' A' ' 53' ' ' TYR . 70.0 mttt -67.37 -24.18 65.67 Favored 'General case' 0 N--CA 1.462 0.152 0 CA-C-O 120.918 0.389 . . . . 0.0 110.496 174.739 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 31.2 t0 -79.37 -46.35 17.8 Favored 'General case' 0 C--N 1.334 -0.075 0 CA-C-N 116.521 -0.309 . . . . 0.0 110.653 175.469 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . 0.44 HD21 ' H ' ' B' 2053 ' ' ASP . 13.5 mt -54.63 126.67 24.77 Favored 'General case' 0 N--CA 1.457 -0.112 0 CA-C-O 120.894 0.378 . . . . 0.0 111.556 -176.666 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 1.2 mppt? -74.06 -23.28 59.35 Favored 'General case' 0 N--CA 1.456 -0.168 0 N-CA-C 108.988 -0.745 . . . . 0.0 108.988 175.194 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 34.6 m -82.67 -20.89 35.32 Favored 'General case' 0 N--CA 1.455 -0.184 0 C-N-CA 122.923 0.489 . . . . 0.0 110.637 174.916 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 72.21 -42.52 0.8 Allowed Glycine 0 CA--C 1.527 0.829 0 C-N-CA 124.982 1.277 . . . . 0.0 111.831 -177.168 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 84.1 mt -75.52 149.43 6.95 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.392 0 C-N-CA 123.995 0.918 . . . . 0.0 111.109 177.911 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 31.2 t -167.18 93.31 0.43 Allowed 'General case' 0 CA--C 1.518 -0.281 0 N-CA-C 108.847 -0.797 . . . . 0.0 108.847 169.791 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . 0.42 ' O ' ' HE2' ' A' ' 30' ' ' LYS . . . -55.23 -35.51 60.43 Favored Glycine 0 C--N 1.332 0.349 0 N-CA-C 110.709 -0.956 . . . . 0.0 110.709 -176.834 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . 0.532 ' H ' ' HB3' ' B' 2055 ' ' GLU . 30.3 t -61.83 -53.15 59.85 Favored 'General case' 0 N--CA 1.449 -0.494 0 N-CA-C 109.752 -0.462 . . . . 0.0 109.752 -179.153 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 82.5 mmt-85 -68.87 -40.6 79.2 Favored 'General case' 0 C--O 1.231 0.123 0 C-N-CA 122.941 0.496 . . . . 0.0 110.417 -179.446 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 65.6 mt -57.37 -45.13 85.32 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.657 0 N-CA-C 108.559 -0.904 . . . . 0.0 108.559 177.931 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . 0.42 ' HE2' ' O ' ' A' ' 26' ' ' GLY . 51.0 mtmt -68.52 -27.27 65.96 Favored 'General case' 0 N--CA 1.456 -0.132 0 CA-C-O 118.65 -0.691 . . . . 0.0 111.51 179.531 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . 0.425 ' HE3' ' HA ' ' A' ' 31' ' ' LYS . 0.0 OUTLIER -63.59 -59.61 4.4 Favored 'General case' 0 C--N 1.341 0.232 0 CA-C-N 119.131 0.878 . . . . 0.0 110.163 177.299 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.503 HD12 ' N ' ' A' ' 33' ' ' THR . 1.6 pp -75.67 -19.22 59.29 Favored 'General case' 0 CA--C 1.532 0.28 0 C-N-CA 119.263 -0.975 . . . . 0.0 111.64 -176.924 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . 0.503 ' N ' HD12 ' A' ' 32' ' ' LEU . 21.4 m -69.61 -42.93 73.71 Favored 'General case' 0 CA--C 1.52 -0.174 0 N-CA-C 108.845 -0.798 . . . . 0.0 108.845 175.927 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 87.4 m -72.1 -41.54 67.18 Favored 'General case' 0 N--CA 1.448 -0.552 0 CA-C-N 116.482 -0.326 . . . . 0.0 110.374 -175.995 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 58.3 t80 -63.98 -31.34 72.49 Favored 'General case' 0 N--CA 1.456 -0.163 0 C-N-CA 119.946 -0.701 . . . . 0.0 109.842 178.436 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -72.02 -27.66 62.87 Favored 'General case' 0 N--CA 1.447 -0.589 0 CA-C-O 119.385 -0.34 . . . . 0.0 110.682 174.414 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.484 HD22 ' HA ' ' A' ' 37' ' ' LEU . 0.6 OUTLIER -76.39 -39.14 54.51 Favored 'General case' 0 CA--C 1.519 -0.229 0 N-CA-C 107.79 -1.189 . . . . 0.0 107.79 -175.89 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 77.0 m-20 -67.4 -15.28 63.59 Favored 'General case' 0 N--CA 1.441 -0.883 0 C-N-CA 124.981 1.312 . . . . 0.0 111.331 176.927 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 97.0 m-70 -153.42 91.55 1.51 Allowed 'General case' 0 N--CA 1.451 -0.415 0 C-N-CA 123.265 0.626 . . . . 0.0 111.137 -175.569 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 40' ' ' ILE . . . . . 0.528 ' H ' HD13 ' A' ' 40' ' ' ILE . 0.0 OUTLIER -70.07 -14.83 18.64 Favored 'Isoleucine or valine' 0 C--O 1.226 -0.176 0 O-C-N 121.788 -0.57 . . . . 0.0 109.789 173.11 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 20.9 m-20 -57.91 -10.49 1.78 Allowed 'General case' 0 CA--C 1.532 0.255 0 C-N-CA 125.248 1.419 . . . . 0.0 113.897 -177.672 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -118.54 9.04 6.85 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.192 0 C-N-CA 124.114 0.966 . . . . 0.0 111.335 179.714 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 3.0 pp20? -47.76 -31.07 4.44 Favored 'General case' 0 C--N 1.331 -0.212 0 O-C-N 121.996 -0.44 . . . . 0.0 112.122 176.638 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 2.5 m -71.58 -39.03 70.83 Favored 'General case' 0 CA--C 1.53 0.211 0 O-C-N 121.794 -0.566 . . . . 0.0 111.234 -175.665 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . 0.499 ' HD3' ' CE1' ' A' ' 7' ' ' PHE . 19.1 ptpt -74.16 -24.5 59.41 Favored 'General case' 0 CA--C 1.531 0.24 0 O-C-N 121.637 -0.665 . . . . 0.0 109.719 176.357 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 46' ' ' ILE . . . . . 0.512 HG12 ' CZ ' ' A' ' 10' ' ' PHE . 97.7 mt -72.75 -47.37 50.2 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.237 0 C-N-CA 122.514 0.326 . . . . 0.0 110.206 -179.642 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 33.6 mm -62.79 -36.59 76.11 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.181 0 N-CA-C 109.183 -0.673 . . . . 0.0 109.183 177.454 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 47.1 m -62.84 -38.4 90.64 Favored 'General case' 0 N--CA 1.455 -0.202 0 C-N-CA 120.978 -0.289 . . . . 0.0 111.228 179.213 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 18.6 mt -74.68 -35.17 62.77 Favored 'General case' 0 N--CA 1.451 -0.413 0 N-CA-C 113.176 0.806 . . . . 0.0 113.176 -178.278 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 19.4 pt -69.59 -39.99 79.0 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.181 0 CA-C-N 118.925 0.784 . . . . 0.0 110.258 -178.893 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 36.0 pt -67.21 -42.79 88.38 Favored 'Isoleucine or valine' 0 C--N 1.338 0.092 0 C-N-CA 119.701 -0.799 . . . . 0.0 110.246 178.514 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 85.3 m-20 -63.96 -46.4 84.81 Favored 'General case' 0 N--CA 1.455 -0.208 0 CA-C-N 118.117 0.417 . . . . 0.0 110.886 -179.806 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 53' ' ' TYR . . . . . 0.475 ' CE1' ' HG2' ' A' ' 18' ' ' LYS . 12.1 t80 -63.59 -43.02 98.19 Favored 'General case' 0 N--CA 1.453 -0.314 0 N-CA-C 109.925 -0.398 . . . . 0.0 109.925 -179.819 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 24.2 m -66.0 -30.17 70.68 Favored 'General case' 0 N--CA 1.454 -0.24 0 CA-C-N 118.024 0.375 . . . . 0.0 111.757 -175.923 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 83.0 mtt-85 -76.62 -54.46 6.64 Favored 'General case' 0 N--CA 1.454 -0.251 0 CA-C-N 118.053 0.388 . . . . 0.0 111.523 -177.938 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . 0.424 ' N ' ' CD2' ' A' ' 56' ' ' LEU . 2.8 mm? -75.42 -20.16 59.05 Favored 'General case' 0 N--CA 1.455 -0.204 0 N-CA-C 113.863 1.06 . . . . 0.0 113.863 -174.084 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 57' ' ' CYS . . . . . 0.407 ' HB2' ' CB ' ' A' ' 61' ' ' HIS . 8.5 p -83.82 157.22 63.92 Favored Pre-proline 0 CA--C 1.537 0.465 0 N-CA-C 113.611 0.967 . . . . 0.0 113.611 -172.634 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 75.9 Cg_endo -75.4 -174.2 1.9 Allowed 'Trans proline' 0 N--CA 1.459 -0.507 1 C-N-CA 125.644 4.229 . . . . 0.0 111.82 174.358 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 59' ' ' ASP . . . . . 0.407 ' HB2' ' HA ' ' A' ' 116' ' ' SER . 38.5 p-10 -57.76 -50.22 73.97 Favored 'General case' 0 CA--C 1.529 0.155 0 C-N-CA 125.022 1.329 . . . . 0.0 114.407 -171.868 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 39.9 m -71.52 -32.21 67.92 Favored 'General case' 0 C--N 1.333 -0.134 0 O-C-N 122.074 -0.392 . . . . 0.0 110.428 -174.863 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 61' ' ' HIS . . . . . 0.407 ' CB ' ' HB2' ' A' ' 57' ' ' CYS . 61.5 m170 -75.39 -27.83 59.23 Favored 'General case' 0 N--CA 1.451 -0.414 0 C-N-CA 122.608 0.363 . . . . 0.0 110.207 176.464 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 45.6 tptt -68.97 -40.22 78.97 Favored 'General case' 0 N--CA 1.451 -0.425 0 N-CA-C 109.664 -0.495 . . . . 0.0 109.664 177.812 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . 0.472 HD23 HG13 ' A' ' 124' ' ' ILE . 1.8 tm? -73.21 -35.43 66.32 Favored 'General case' 0 N--CA 1.454 -0.241 0 N-CA-C 109.537 -0.542 . . . . 0.0 109.537 178.6 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -69.39 -29.35 71.79 Favored Glycine 0 CA--C 1.525 0.718 0 N-CA-C 110.646 -0.982 . . . . 0.0 110.646 175.765 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 43.9 t -71.11 -42.74 68.89 Favored 'General case' 0 N--CA 1.454 -0.241 0 CA-C-N 117.566 0.683 . . . . 0.0 110.133 176.797 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 72.3 mt -68.01 -24.46 65.12 Favored 'General case' 0 N--CA 1.452 -0.358 0 N-CA-C 110.151 -0.314 . . . . 0.0 110.151 179.104 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 2.0 m-85 -70.04 -39.62 75.63 Favored 'General case' 0 N--CA 1.454 -0.274 0 C-N-CA 122.288 0.235 . . . . 0.0 110.815 172.802 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 68' ' ' ILE . . . . . 0.557 HD11 ' CD1' ' A' ' 17' ' ' PHE . 20.3 mt -67.07 -46.6 84.16 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.381 0 N-CA-C 108.728 -0.841 . . . . 0.0 108.728 177.994 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 97.3 mt -57.24 -36.48 52.23 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.121 0 C-N-CA 123.366 0.666 . . . . 0.0 111.028 175.729 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 22.2 t70 -70.18 -43.59 70.49 Favored 'General case' 0 N--CA 1.455 -0.223 0 CA-C-N 117.883 0.31 . . . . 0.0 110.912 178.437 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 30.1 t -67.25 -53.39 30.5 Favored 'General case' 0 N--CA 1.452 -0.351 0 CA-C-N 116.553 -0.294 . . . . 0.0 110.759 -177.458 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -75.13 -33.34 28.53 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.304 0 N-CA-C 109.911 -0.403 . . . . 0.0 109.911 -177.532 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -68.62 -45.33 67.08 Favored Glycine 0 C--N 1.338 0.67 0 CA-C-O 119.703 -0.498 . . . . 0.0 112.074 -176.155 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 33.4 mtm105 -71.01 -40.9 71.54 Favored 'General case' 0 N--CA 1.452 -0.329 0 CA-C-N 117.651 0.726 . . . . 0.0 109.695 177.143 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -61.22 -37.15 81.98 Favored 'General case' 0 N--CA 1.453 -0.297 0 C-N-CA 120.871 -0.332 . . . . 0.0 110.442 -178.673 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 2.4 m-30 -70.19 -47.5 61.25 Favored 'General case' 0 N--CA 1.453 -0.299 0 CA-C-N 118.033 0.379 . . . . 0.0 111.112 178.235 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -65.86 -38.27 88.38 Favored 'General case' 0 N--CA 1.444 -0.761 0 C-N-CA 118.935 -1.106 . . . . 0.0 108.675 -176.98 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 95.5 m-20 -63.49 -45.04 92.57 Favored 'General case' 0 N--CA 1.455 -0.188 0 N-CA-C 111.792 0.293 . . . . 0.0 111.792 177.255 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 14.5 tm-20 -63.54 -46.86 84.03 Favored 'General case' 0 N--CA 1.447 -0.579 0 CA-C-N 117.679 0.218 . . . . 0.0 111.215 -177.698 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 80' ' ' THR . . . . . 0.577 HG21 ' HB3' ' A' ' 94' ' ' CYS . 52.7 p -73.79 -18.53 60.95 Favored 'General case' 0 N--CA 1.453 -0.301 0 N-CA-C 112.068 0.396 . . . . 0.0 112.068 179.611 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 20.3 ttm105 -75.77 -37.13 59.52 Favored 'General case' 0 N--CA 1.455 -0.182 0 CA-C-N 118.161 0.437 . . . . 0.0 109.881 171.425 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 30.9 t -76.09 -34.27 59.53 Favored 'General case' 0 N--CA 1.456 -0.17 0 C-N-CA 122.997 0.519 . . . . 0.0 112.385 -179.331 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 47.1 m-20 -125.21 167.68 14.51 Favored 'General case' 0 N--CA 1.455 -0.213 0 CA-C-O 120.867 0.365 . . . . 0.0 111.926 -170.027 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 31.9 t -69.32 13.94 0.11 Allowed 'General case' 0 CA--C 1.535 0.4 0 N-CA-C 113.789 1.033 . . . . 0.0 113.789 -174.543 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 83.4 m-20 -76.38 -3.05 34.88 Favored 'General case' 0 CA--C 1.53 0.204 0 O-C-N 121.722 -0.611 . . . . 0.0 111.79 179.003 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 37.1 t -66.46 137.38 56.79 Favored 'General case' 0 N--CA 1.454 -0.256 0 N-CA-C 109.736 -0.468 . . . . 0.0 109.736 176.882 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 78.0 p -166.94 -170.99 1.68 Allowed 'General case' 0 N--CA 1.454 -0.253 0 N-CA-C 109.071 -0.714 . . . . 0.0 109.071 -176.88 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 32.2 t -148.46 154.82 40.39 Favored 'General case' 0 N--CA 1.454 -0.242 0 N-CA-C 110.26 -0.274 . . . . 0.0 110.26 177.881 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 7.1 m120 54.5 34.61 21.48 Favored 'General case' 0 CA--C 1.535 0.37 0 N-CA-C 113.686 0.995 . . . . 0.0 113.686 176.682 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 90' ' ' LYS . . . . . 0.41 ' HE3' ' HB3' ' A' ' 90' ' ' LYS . 21.0 ttpp -146.96 132.23 9.1 Favored Pre-proline 0 CA--C 1.534 0.333 0 CA-C-N 118.598 0.635 . . . . 0.0 111.348 -178.266 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 91' ' ' PRO . . . . . 0.407 ' HA ' ' HB3' ' A' ' 96' ' ' HIS . 85.9 Cg_endo -72.64 167.62 26.63 Favored 'Trans proline' 0 N--CA 1.453 -0.885 0 C-N-CA 123.599 2.866 . . . . 0.0 109.746 174.371 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 80.61 17.89 72.09 Favored Glycine 0 CA--C 1.525 0.663 0 N-CA-C 111.489 -0.644 . . . . 0.0 111.489 179.306 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -156.78 166.68 32.68 Favored 'General case' 0 N--CA 1.455 -0.208 0 C-N-CA 124.811 1.244 . . . . 0.0 108.918 -178.809 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 94' ' ' CYS . . . . . 0.577 ' HB3' HG21 ' A' ' 80' ' ' THR . 30.5 p -59.47 -18.59 40.99 Favored 'General case' 0 N--CA 1.451 -0.424 0 C-N-CA 122.358 0.263 . . . . 0.0 110.535 178.382 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -56.55 -63.09 1.31 Allowed 'General case' 0 N--CA 1.449 -0.48 0 C-N-CA 122.333 0.253 . . . . 0.0 110.62 -177.658 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 96' ' ' HIS . . . . . 0.407 ' HB3' ' HA ' ' A' ' 91' ' ' PRO . 76.0 t60 -72.25 -33.54 67.58 Favored 'General case' 0 N--CA 1.449 -0.515 0 CA-C-N 116.949 -0.114 . . . . 0.0 110.739 -179.556 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -63.48 -54.1 41.63 Favored 'General case' 0 N--CA 1.452 -0.347 0 O-C-N 123.021 0.201 . . . . 0.0 111.375 -177.333 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 98' ' ' ILE . . . . . 0.444 HD13 ' HB2' ' A' ' 94' ' ' CYS . 1.7 mp -70.13 -36.7 69.24 Favored 'Isoleucine or valine' 0 C--N 1.337 0.05 0 CA-C-N 117.778 0.263 . . . . 0.0 110.428 -179.505 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 35.9 m-20 -67.69 -45.22 75.77 Favored 'General case' 0 N--CA 1.454 -0.27 0 CA-C-N 117.916 0.325 . . . . 0.0 111.316 -178.512 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 98.1 m -70.27 -31.7 69.19 Favored 'General case' 0 N--CA 1.453 -0.308 0 N-CA-C 110.125 -0.324 . . . . 0.0 110.125 -177.797 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 53.7 tp -74.06 -38.34 63.98 Favored 'General case' 0 N--CA 1.449 -0.476 0 CA-C-O 119.626 -0.226 . . . . 0.0 111.058 179.439 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -65.96 -22.64 70.59 Favored Glycine 0 CA--C 1.53 1.009 0 CA-C-O 119.811 -0.438 . . . . 0.0 113.216 -174.562 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 17.3 mm-40 -78.84 -36.4 42.55 Favored 'General case' 0 N--CA 1.456 -0.127 0 CA-C-N 117.877 0.839 . . . . 0.0 111.455 179.186 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 19.6 m -105.02 -8.4 9.84 Favored 'Isoleucine or valine' 0 CA--C 1.527 0.089 0 N-CA-C 112.895 0.702 . . . . 0.0 112.895 -174.492 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 105' ' ' ILE . . . . . . . . . . . . . 10.6 tp -59.59 -26.79 35.78 Favored 'Isoleucine or valine' 0 C--N 1.337 0.062 0 CA-C-N 119.484 1.038 . . . . 0.0 110.587 -179.32 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 27.7 pt20 -66.97 -29.05 68.79 Favored 'General case' 0 N--CA 1.45 -0.432 0 N-CA-C 110.325 -0.25 . . . . 0.0 110.325 177.434 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 60.7 mt-10 -75.96 -36.44 59.3 Favored 'General case' 0 CA--C 1.529 0.153 0 N-CA-C 109.94 -0.393 . . . . 0.0 109.94 177.137 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 10.7 mp -71.69 -41.3 68.83 Favored 'General case' 0 N--CA 1.448 -0.543 0 N-CA-C 109.892 -0.41 . . . . 0.0 109.892 179.847 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 91.5 mt -70.72 -53.14 16.75 Favored 'General case' 0 N--CA 1.455 -0.183 0 CA-C-O 119.526 -0.273 . . . . 0.0 111.176 -179.581 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 9.8 p -47.14 -55.79 7.79 Favored 'General case' 0 C--N 1.34 0.162 0 C-N-CA 122.664 0.386 . . . . 0.0 111.067 177.474 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 18.5 t0 -59.76 -37.71 79.76 Favored 'General case' 0 N--CA 1.446 -0.665 0 N-CA-C 109.475 -0.565 . . . . 0.0 109.475 -179.808 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -68.65 -37.61 79.8 Favored 'General case' 0 N--CA 1.444 -0.761 0 C-N-CA 119.862 -0.735 . . . . 0.0 110.814 -176.504 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 113' ' ' ILE . . . . . . . . . . . . . 27.5 mm -67.71 -39.38 81.98 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.288 0 C-N-CA 119.331 -0.948 . . . . 0.0 110.211 -178.16 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -75.2 -43.57 51.23 Favored 'General case' 0 CA--C 1.53 0.201 0 N-CA-C 112.073 0.397 . . . . 0.0 112.073 179.265 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 39.4 ttmt -75.73 -38.31 58.59 Favored 'General case' 0 C--N 1.338 0.079 0 C-N-CA 123.486 0.714 . . . . 0.0 112.538 -175.263 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 116' ' ' SER . . . . . 0.421 ' HB2' ' HB2' ' A' ' 120' ' ' HIS . 54.9 p -74.66 154.09 38.64 Favored 'General case' 0 N--CA 1.453 -0.294 0 N-CA-C 112.692 0.627 . . . . 0.0 112.692 -170.735 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 21.5 t-20 -75.76 163.81 26.89 Favored 'General case' 0 N--CA 1.454 -0.267 0 N-CA-C 108.84 -0.8 . . . . 0.0 108.84 178.131 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 118' ' ' GLN . . . . . . . . . . . . . 26.5 mm100 -49.59 -51.91 33.99 Favored 'General case' 0 N--CA 1.457 -0.079 0 C-N-CA 123.117 0.567 . . . . 0.0 111.726 -171.61 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 16.0 t0 -57.16 -41.59 79.46 Favored 'General case' 0 C--O 1.23 0.04 0 N-CA-C 109.859 -0.422 . . . . 0.0 109.859 -179.761 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 120' ' ' HIS . . . . . 0.421 ' HB2' ' HB2' ' A' ' 116' ' ' SER . 68.3 m-70 -68.84 -34.4 75.42 Favored 'General case' 0 N--CA 1.447 -0.597 0 CA-C-O 118.981 -0.533 . . . . 0.0 110.603 -179.709 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 60.5 mttm -57.64 -42.81 84.17 Favored 'General case' 0 N--CA 1.464 0.267 0 CA-C-N 118.958 0.799 . . . . 0.0 109.845 177.319 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 29.6 mm-40 -75.62 -32.83 60.42 Favored 'General case' 0 N--CA 1.449 -0.478 0 N-CA-C 112.282 0.475 . . . . 0.0 112.282 -178.002 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 46.4 mtmt -67.5 -28.98 68.3 Favored 'General case' 0 C--N 1.332 -0.193 0 C-N-CA 120.046 -0.662 . . . . 0.0 109.427 176.791 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 124' ' ' ILE . . . . . 0.472 HG13 HD23 ' A' ' 63' ' ' LEU . 62.2 mt -69.89 -38.79 76.57 Favored 'Isoleucine or valine' 0 C--O 1.226 -0.143 0 N-CA-C 109.463 -0.569 . . . . 0.0 109.463 171.812 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -56.39 -49.05 75.6 Favored 'General case' 0 C--N 1.341 0.219 0 O-C-N 122.185 -0.322 . . . . 0.0 110.468 179.818 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 126' ' ' MET . . . . . . . . . . . . . 27.8 ptm -69.41 -31.28 69.54 Favored 'General case' 0 N--CA 1.454 -0.243 0 C-N-CA 120.508 -0.477 . . . . 0.0 110.402 -179.582 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 2.1 mp -62.85 -32.77 74.07 Favored 'General case' 0 N--CA 1.456 -0.144 0 CA-C-N 118.568 0.622 . . . . 0.0 110.547 176.107 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 128' ' ' LEU . . . . . 0.413 ' HB3' ' HE3' ' A' ' 139' ' ' LYS . 96.4 mt -72.43 -38.14 68.42 Favored 'General case' 0 N--CA 1.456 -0.162 0 CA-C-N 118.777 0.717 . . . . 0.0 109.927 177.291 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 50.9 m-20 -63.4 -36.34 83.39 Favored 'General case' 0 N--CA 1.456 -0.174 0 N-CA-C 109.796 -0.446 . . . . 0.0 109.796 175.375 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 130' ' ' ILE . . . . . 0.567 ' HA ' ' CD ' ' A' ' 133' ' ' ARG . 55.0 mt -69.02 -31.97 52.51 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.278 0 C-N-CA 122.59 0.356 . . . . 0.0 110.615 179.404 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 131' ' ' TRP . . . . . . . . . . . . . 47.9 m0 -75.92 -26.7 57.17 Favored 'General case' 0 N--CA 1.452 -0.361 0 C-N-CA 120.12 -0.632 . . . . 0.0 111.651 175.303 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 66.2 m-20 -73.93 -46.67 42.81 Favored 'General case' 0 C--N 1.341 0.198 0 CA-C-N 118.065 0.393 . . . . 0.0 110.708 175.294 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 133' ' ' ARG . . . . . 0.567 ' CD ' ' HA ' ' A' ' 130' ' ' ILE . 8.4 ptm180 -75.05 -24.42 58.25 Favored 'General case' 0 N--CA 1.454 -0.246 0 C-N-CA 123.141 0.576 . . . . 0.0 112.382 -175.801 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 28.5 t -90.62 -5.44 55.86 Favored 'General case' 0 N--CA 1.452 -0.368 0 N-CA-C 111.781 0.289 . . . . 0.0 111.781 178.181 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 135' ' ' GLY . . . . . . . . . . . . . . . 74.44 14.25 81.1 Favored Glycine 0 CA--C 1.527 0.81 0 CA-C-O 119.679 -0.511 . . . . 0.0 112.939 177.526 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 136' ' ' LEU . . . . . 0.4 ' C ' HD23 ' A' ' 136' ' ' LEU . 3.5 tt -70.1 -55.82 8.48 Favored 'General case' 0 CA--C 1.529 0.14 0 CA-C-N 117.928 0.864 . . . . 0.0 109.531 -178.543 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 137' ' ' PHE . . . . . . . . . . . . . 66.3 t80 -160.59 130.82 5.24 Favored 'General case' 0 N--CA 1.454 -0.248 0 N-CA-C 108.635 -0.876 . . . . 0.0 108.635 -178.262 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 138' ' ' GLN . . . . . . . . . . . . . 22.4 mp0 -81.79 136.79 35.39 Favored 'General case' 0 N--CA 1.451 -0.377 0 CA-C-O 120.921 0.391 . . . . 0.0 111.653 -175.999 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 139' ' ' LYS . . . . . 0.413 ' HE3' ' HB3' ' A' ' 128' ' ' LEU . 3.2 ttmp? -61.48 118.2 6.7 Favored 'General case' 0 N--CA 1.452 -0.34 0 C-N-CA 123.942 0.897 . . . . 0.0 108.752 175.052 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 140' ' ' SER . . . . . . . . . . . . . 35.0 t -89.21 -2.68 58.59 Favored 'General case' 0 CA--C 1.53 0.175 0 N-CA-C 112.806 0.669 . . . . 0.0 112.806 -176.783 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 141' ' ' TYR . . . . . . . . . . . . . 79.4 m-85 52.61 20.6 1.56 Allowed 'General case' 0 CA--C 1.533 0.321 0 C-N-CA 123.469 0.708 . . . . 0.0 112.46 -178.423 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 142' ' ' LEU . . . . . 0.417 ' HG ' ' H ' ' A' ' 144' ' ' ALA . 59.6 tp -65.2 147.94 52.56 Favored 'General case' 0 N--CA 1.454 -0.246 0 C-N-CA 123.446 0.698 . . . . 0.0 110.185 -178.166 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 27.5 p-10 -61.05 -26.78 67.87 Favored 'General case' 0 N--CA 1.455 -0.18 0 N-CA-C 111.859 0.318 . . . . 0.0 111.859 -175.023 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 144' ' ' ALA . . . . . 0.417 ' H ' ' HG ' ' A' ' 142' ' ' LEU . . . -64.61 -36.8 85.43 Favored 'General case' 0 N--CA 1.452 -0.348 0 N-CA-C 109.582 -0.525 . . . . 0.0 109.582 177.451 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 145' ' ' ILE . . . . . . . . . . . . . 24.3 mm -75.31 -27.75 19.72 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.311 0 N-CA-C 110.182 -0.303 . . . . 0.0 110.182 -179.967 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 146' ' ' ARG . . . . . . . . . . . . . 75.5 mtt180 -72.66 -20.47 61.24 Favored 'General case' 0 C--N 1.34 0.172 0 N-CA-C 109.574 -0.528 . . . . 0.0 109.574 174.82 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 147' ' ' SER . . . . . . . . . . . . . 36.2 t 57.74 55.99 5.13 Favored 'General case' 0 N--CA 1.451 -0.415 0 C-N-CA 123.341 0.657 . . . . 0.0 110.229 176.488 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 148' ' ' LYS . . . . . 0.572 ' HE2' ' HA ' ' A' ' 148' ' ' LYS . 8.0 mmpt? -55.78 -18.89 9.46 Favored 'General case' 0 N--CA 1.456 -0.137 0 N-CA-C 112.698 0.629 . . . . 0.0 112.698 -174.9 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 149' ' ' CYS . . . . . . . . . . . . . 60.6 m -63.78 -42.64 97.72 Favored 'General case' 0 N--CA 1.455 -0.208 0 CA-C-N 119.212 0.915 . . . . 0.0 109.716 177.481 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 150' ' ' PHE . . . . . . . . . . . . . 87.2 t80 -69.11 -22.89 63.94 Favored 'General case' 0 N--CA 1.453 -0.276 0 N-CA-C 109.871 -0.418 . . . . 0.0 109.871 179.16 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 151' ' ' ALA . . . . . . . . . . . . . . . -81.13 -28.32 35.16 Favored 'General case' 0 N--CA 1.45 -0.436 0 C-N-CA 122.484 0.314 . . . . 0.0 110.517 175.312 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 152' ' ' MET . . . . . . . . . . . . . 92.6 mtp -75.39 -20.5 58.91 Favored 'General case' 0 C--N 1.342 0.259 0 C-N-CA 122.795 0.438 . . . . 0.0 111.183 176.868 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 153' ' ' ASP . . . . . . . . . . . . . 60.1 m-20 -64.54 -9.66 20.53 Favored 'General case' 0 CA--C 1.535 0.383 0 N-CA-C 110.481 -0.192 . . . . 0.0 110.481 170.204 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 154' ' ' LEU . . . . . . . . . . . . . 77.9 mt -130.49 -177.92 4.55 Favored 'General case' 0 N--CA 1.455 -0.179 0 C-N-CA 124.936 1.294 . . . . 0.0 108.534 178.16 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 155' ' ' GLU . . . . . . . . . . . . . 13.3 pm0 -75.17 4.56 6.69 Favored 'General case' 0 CA--C 1.534 0.361 0 O-C-N 121.963 -0.461 . . . . 0.0 111.909 177.356 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 156' ' ' HIS . . . . . . . . . . . . . 32.5 m170 -77.96 43.53 0.43 Allowed 'General case' 0 CA--C 1.529 0.163 0 C-N-CA 124.786 1.234 . . . . 0.0 112.069 -175.265 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 157' ' ' HIS . . . . . . . . . . . . . 36.4 m170 -69.01 0.45 4.53 Favored 'General case' 0 CA--C 1.535 0.368 0 N-CA-C 112.597 0.591 . . . . 0.0 112.597 -176.553 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 158' ' ' HIS . . . . . . . . . . . . . 51.4 p-80 -73.07 163.88 27.51 Favored 'General case' 0 N--CA 1.456 -0.159 0 CA-C-N 118.576 0.626 . . . . 0.0 110.991 178.958 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 159' ' ' HIS . . . . . . . . . . . . . 30.7 m80 . . . . . 0 C--O 1.249 1.038 0 CA-C-O 117.181 -1.39 . . . . 0.0 111.429 -179.653 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' B' B 2052 ' ' ASP . . . . . . . . . . . . . 4.0 m-20 . . . . . 0 N--CA 1.476 0.83 0 N-CA-C 110.729 -0.1 . . . . 0.0 110.729 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' B' B 2053 ' ' ASP . . . . . 0.44 ' H ' HD21 ' A' ' 20' ' ' LEU . 10.8 m-20 -148.88 164.03 35.68 Favored 'General case' 0 N--CA 1.453 -0.322 0 C-N-CA 123.419 0.688 . . . . 0.0 111.933 -173.993 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B 2054 ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -72.0 164.07 26.77 Favored 'General case' 0 CA--C 1.532 0.276 0 C-N-CA 125.103 1.361 . . . . 0.0 113.454 -177.938 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B 2055 ' ' GLU . . . . . 0.532 ' HB3' ' H ' ' A' ' 27' ' ' SER . 40.6 tt0 56.31 41.09 29.56 Favored 'General case' 0 CA--C 1.535 0.373 0 C-N-CA 125.801 1.64 . . . . 0.0 114.204 172.863 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B 2056 ' ' ASP . . . . . . . . . . . . . 40.2 p-10 -74.28 0.49 14.08 Favored 'General case' 0 CA--C 1.532 0.284 0 O-C-N 120.999 -1.063 . . . . 0.0 110.822 175.706 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B 2057 ' ' ASP . . . . . . . . . . . . . 34.6 p-10 -92.81 17.13 10.96 Favored 'General case' 0 CA--C 1.531 0.233 0 C-N-CA 124.9 1.28 . . . . 0.0 111.02 178.086 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B 2058 ' ' TYR . . . . . . . . . . . . . 72.9 t80 -53.36 148.67 8.5 Favored 'General case' 0 N--CA 1.454 -0.231 0 CA-C-O 121.456 0.646 . . . . 0.0 111.981 -179.077 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B 2059 ' ' THR . . . . . . . . . . . . . 54.6 m -134.36 132.9 21.2 Favored Pre-proline 0 N--CA 1.451 -0.392 0 N-CA-C 107.734 -1.21 . . . . 0.0 107.734 178.736 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B 2060 ' ' PRO . . . . . . . . . . . . . 88.4 Cg_endo -70.29 168.65 21.64 Favored 'Trans proline' 0 N--CA 1.449 -1.092 0 C-N-CA 123.274 2.649 . . . . 0.0 111.549 -177.112 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B 2061 ' ' SER . . . . . . . . . . . . . 23.3 t -77.6 159.65 29.09 Favored 'General case' 0 CA--C 1.531 0.218 0 N-CA-C 112.898 0.703 . . . . 0.0 112.898 -174.215 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B 2062 ' ' ILE . . . . . . . . . . . . . 12.1 mt 63.44 135.83 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.534 0.33 0 C-N-CA 127.109 2.164 . . . . 0.0 112.929 -178.909 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B 2063 ' ' SER . . . . . . . . . . . . . 30.2 t . . . . . 0 C--O 1.249 1.077 0 CA-C-O 117.501 -1.238 . . . . 0.0 112.045 -172.072 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 55.2 ttm . . . . . 0 N--CA 1.474 0.731 0 CA-C-O 121.258 0.552 . . . . 0.0 110.301 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 43.9 tt0 -160.75 127.84 4.23 Favored 'General case' 0 N--CA 1.454 -0.261 0 N-CA-C 107.54 -1.281 . . . . 0.0 107.54 177.987 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 16.5 mt-30 51.83 -142.86 0.71 Allowed 'General case' 0 CA--C 1.531 0.246 0 N-CA-C 108.49 -0.93 . . . . 0.0 108.49 -176.121 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 10.6 p-10 -81.59 109.66 16.24 Favored 'General case' 0 N--CA 1.448 -0.539 0 O-C-N 121.935 -0.478 . . . . 0.0 109.784 175.155 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 90.2 m-20 -69.96 -0.36 7.32 Favored 'General case' 0 C--N 1.339 0.124 0 CA-C-O 120.967 0.413 . . . . 0.0 111.632 175.815 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 22.0 m-20 -69.1 -19.02 64.05 Favored 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 108.85 -0.796 . . . . 0.0 108.85 176.904 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' PHE . . . . . 0.513 ' CD1' ' HD3' ' A' ' 45' ' ' LYS . 1.4 t80 -58.26 -34.51 70.56 Favored 'General case' 0 N--CA 1.449 -0.497 0 C-N-CA 123.29 0.636 . . . . 0.0 109.779 179.55 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 51.0 tp60 -51.69 -36.75 47.81 Favored 'General case' 0 N--CA 1.456 -0.145 0 C-N-CA 124.545 1.138 . . . . 0.0 111.829 -177.668 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 26.5 m-80 -71.43 -34.85 70.66 Favored 'General case' 0 N--CA 1.454 -0.272 0 N-CA-C 109.821 -0.437 . . . . 0.0 109.821 -179.379 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' PHE . . . . . 0.477 ' CZ ' HG12 ' A' ' 46' ' ' ILE . 2.1 t80 -71.45 -38.2 71.33 Favored 'General case' 0 N--CA 1.45 -0.439 0 N-CA-C 109.078 -0.712 . . . . 0.0 109.078 178.24 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 86.8 t -66.48 -55.36 18.82 Favored 'Isoleucine or valine' 0 CA--C 1.52 -0.181 0 N-CA-C 109.106 -0.702 . . . . 0.0 109.106 178.448 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -58.01 -29.75 65.54 Favored 'General case' 0 N--CA 1.456 -0.13 0 C-N-CA 122.704 0.402 . . . . 0.0 111.996 -179.107 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 92.3 m -71.93 -39.77 69.22 Favored 'General case' 0 CA--C 1.53 0.209 0 N-CA-C 109.214 -0.661 . . . . 0.0 109.214 176.18 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.422 ' HA ' ' CD1' ' A' ' 17' ' ' PHE . 0.1 OUTLIER -64.28 -45.45 87.97 Favored 'General case' 0 N--CA 1.45 -0.439 0 N-CA-C 109.076 -0.713 . . . . 0.0 109.076 177.145 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 72.5 mm-40 -64.91 -29.75 70.71 Favored 'General case' 0 N--CA 1.454 -0.267 0 C-N-CA 124.004 0.922 . . . . 0.0 110.264 179.798 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 70.5 m -67.18 -34.76 78.21 Favored 'General case' 0 N--CA 1.452 -0.348 0 N-CA-C 109.464 -0.569 . . . . 0.0 109.464 175.646 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' PHE . . . . . 0.469 ' CE1' HD11 ' A' ' 68' ' ' ILE . 15.4 m-85 -63.77 -39.98 95.59 Favored 'General case' 0 C--N 1.34 0.186 0 C-N-CA 120.176 -0.61 . . . . 0.0 109.821 174.657 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . 0.474 ' HG2' ' CE1' ' A' ' 53' ' ' TYR . 59.0 mttt -65.92 -29.45 69.87 Favored 'General case' 0 C--N 1.338 0.071 0 CA-C-N 117.625 0.193 . . . . 0.0 110.993 -179.122 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 60.6 t0 -75.16 -42.05 56.88 Favored 'General case' 0 N--CA 1.454 -0.242 0 O-C-N 123.374 0.421 . . . . 0.0 111.073 -179.189 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 14.1 mt -57.99 140.79 51.58 Favored 'General case' 0 N--CA 1.451 -0.396 0 C-N-CA 120.181 -0.608 . . . . 0.0 111.069 -176.483 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . 0.493 ' HE2' ' OD2' ' B' 2052 ' ' ASP . 1.1 mppt? -79.84 -21.42 44.19 Favored 'General case' 0 N--CA 1.454 -0.254 0 N-CA-C 109.319 -0.623 . . . . 0.0 109.319 176.543 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' SER . . . . . 0.402 ' C ' ' H ' ' A' ' 24' ' ' ILE . 85.8 p -76.75 -24.95 52.96 Favored 'General case' 0 CA--C 1.53 0.205 0 N-CA-C 109.557 -0.535 . . . . 0.0 109.557 169.82 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 71.7 -29.03 0.61 Allowed Glycine 0 CA--C 1.527 0.807 0 C-N-CA 125.294 1.426 . . . . 0.0 112.683 177.3 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . 0.402 ' H ' ' C ' ' A' ' 22' ' ' SER . 35.9 mt -89.73 155.07 3.12 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.557 0 N-CA-C 108.433 -0.951 . . . . 0.0 108.433 173.327 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 4.0 t -158.48 76.27 0.75 Allowed 'General case' 0 C--O 1.225 -0.199 0 CA-C-N 118.665 0.666 . . . . 0.0 110.518 -177.498 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -48.03 -49.86 22.91 Favored Glycine 0 CA--C 1.53 1.01 0 CA-C-O 118.592 -1.116 . . . . 0.0 115.403 -170.036 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 60.1 p -71.7 -35.96 70.4 Favored 'General case' 0 C--N 1.34 0.19 0 CA-C-N 120.173 1.987 . . . . 0.0 110.871 -176.182 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 75.2 mtt85 -70.94 -37.91 72.87 Favored 'General case' 0 C--N 1.341 0.237 0 CA-C-N 118.236 0.471 . . . . 0.0 110.183 178.027 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 41.3 mt -56.45 -45.03 81.73 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.446 0 N-CA-C 107.811 -1.181 . . . . 0.0 107.811 174.159 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 52.8 mtmt -68.36 -23.73 64.72 Favored 'General case' 0 N--CA 1.454 -0.225 0 CA-C-O 118.458 -0.782 . . . . 0.0 112.341 177.544 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . 0.539 ' HE3' ' HA ' ' A' ' 31' ' ' LYS . 0.0 OUTLIER -66.1 -59.28 3.93 Favored 'General case' 0 C--N 1.344 0.331 0 CA-C-N 119.629 1.104 . . . . 0.0 110.35 177.345 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.452 HD12 ' N ' ' A' ' 33' ' ' THR . 1.4 pp -74.17 -17.97 60.84 Favored 'General case' 0 N--CA 1.455 -0.176 0 C-N-CA 119.267 -0.973 . . . . 0.0 111.695 -177.024 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . 0.452 ' N ' HD12 ' A' ' 32' ' ' LEU . 39.7 m -73.54 -37.04 65.73 Favored 'General case' 0 N--CA 1.457 -0.12 0 N-CA-C 109.621 -0.511 . . . . 0.0 109.621 176.18 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 97.6 m -74.05 -37.27 64.33 Favored 'General case' 0 N--CA 1.453 -0.301 0 N-CA-C 110.231 -0.285 . . . . 0.0 110.231 -179.297 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 71.7 t80 -67.55 -33.32 74.81 Favored 'General case' 0 N--CA 1.454 -0.229 0 N-CA-C 109.718 -0.475 . . . . 0.0 109.718 176.727 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -71.14 -31.01 67.19 Favored 'General case' 0 N--CA 1.451 -0.386 0 CA-C-O 119.722 -0.18 . . . . 0.0 111.2 177.595 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 13.1 mt -71.92 -40.88 68.48 Favored 'General case' 0 N--CA 1.454 -0.23 0 C-N-CA 122.349 0.26 . . . . 0.0 111.123 178.101 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 41.8 t0 -67.6 -21.51 65.41 Favored 'General case' 0 CA--C 1.532 0.28 0 N-CA-C 110.504 -0.184 . . . . 0.0 110.504 178.613 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 74.6 m80 -146.39 92.0 2.12 Favored 'General case' 0 N--CA 1.453 -0.314 0 CA-C-O 120.88 0.372 . . . . 0.0 111.197 -177.662 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 40' ' ' ILE . . . . . 0.615 ' H ' HD13 ' A' ' 40' ' ' ILE . 0.0 OUTLIER -72.63 -16.99 18.3 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.54 0 CA-C-O 118.965 -0.54 . . . . 0.0 110.816 176.8 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 3.8 m-20 -57.68 -22.7 47.55 Favored 'General case' 0 N--CA 1.456 -0.16 0 N-CA-C 112.864 0.69 . . . . 0.0 112.864 -176.264 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -102.57 14.79 5.94 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.159 0 C-N-CA 122.636 0.374 . . . . 0.0 111.876 177.098 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 2.8 pp20? -51.51 -34.02 34.2 Favored 'General case' 0 C--O 1.226 -0.153 0 O-C-N 121.475 -0.765 . . . . 0.0 111.23 178.042 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 30.9 t -58.39 -49.88 75.67 Favored 'General case' 0 CA--C 1.531 0.225 0 N-CA-C 112.279 0.474 . . . . 0.0 112.279 -176.853 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . 0.513 ' HD3' ' CD1' ' A' ' 7' ' ' PHE . 19.4 ptpt -71.13 -23.22 62.04 Favored 'General case' 0 CA--C 1.529 0.153 0 O-C-N 121.959 -0.463 . . . . 0.0 110.326 -179.913 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 46' ' ' ILE . . . . . 0.477 HG12 ' CZ ' ' A' ' 10' ' ' PHE . 94.4 mt -75.2 -41.72 44.28 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.256 0 C-N-CA 122.888 0.475 . . . . 0.0 109.899 179.979 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 32.1 mm -62.61 -35.47 70.47 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.212 0 N-CA-C 109.185 -0.672 . . . . 0.0 109.185 175.672 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 17.9 t -63.59 -47.78 80.07 Favored 'General case' 0 N--CA 1.456 -0.152 0 C-N-CA 119.872 -0.731 . . . . 0.0 110.454 177.443 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 20.6 mt -64.5 -33.54 76.12 Favored 'General case' 0 N--CA 1.449 -0.496 0 CA-C-O 118.708 -0.663 . . . . 0.0 112.451 -175.788 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 24.6 pt -70.18 -42.71 79.12 Favored 'Isoleucine or valine' 0 C--O 1.226 -0.17 0 C-N-CA 119.366 -0.933 . . . . 0.0 110.669 178.554 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 43.3 pt -70.92 -39.96 75.85 Favored 'Isoleucine or valine' 0 C--N 1.342 0.264 0 CA-C-N 118.916 0.78 . . . . 0.0 110.68 179.756 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 76.3 m-20 -63.31 -48.86 76.29 Favored 'General case' 0 N--CA 1.454 -0.265 0 CA-C-N 117.783 0.265 . . . . 0.0 110.8 -179.987 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 53' ' ' TYR . . . . . 0.474 ' CE1' ' HG2' ' A' ' 18' ' ' LYS . 16.9 t80 -66.13 -47.14 75.08 Favored 'General case' 0 N--CA 1.454 -0.255 0 CA-C-O 119.443 -0.313 . . . . 0.0 110.41 -179.538 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 19.4 t -65.0 -27.91 69.15 Favored 'General case' 0 N--CA 1.454 -0.272 0 O-C-N 123.205 0.316 . . . . 0.0 111.796 -173.968 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . 0.43 HH22 ' CD ' ' A' ' 107' ' ' GLU . 90.2 mtt-85 -75.49 -51.29 13.34 Favored 'General case' 0 N--CA 1.455 -0.205 0 O-C-N 122.211 -0.306 . . . . 0.0 110.996 178.057 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 44.0 mt -75.17 -43.53 51.71 Favored 'General case' 0 N--CA 1.457 -0.112 0 N-CA-C 113.034 0.753 . . . . 0.0 113.034 -172.884 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 57' ' ' CYS . . . . . 0.461 ' O ' ' HE2' ' A' ' 62' ' ' LYS . 12.6 p -65.39 154.07 88.55 Favored Pre-proline 0 CA--C 1.538 0.483 0 N-CA-C 112.985 0.735 . . . . 0.0 112.985 -173.633 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 45.6 Cg_endo -80.23 -175.53 2.75 Favored 'Trans proline' 0 N--CA 1.458 -0.612 1 C-N-CA 125.381 4.054 . . . . 0.0 112.371 -179.557 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 59' ' ' ASP . . . . . 0.403 ' CG ' ' HA ' ' A' ' 116' ' ' SER . 35.4 t0 -36.86 -73.29 0.05 OUTLIER 'General case' 0 C--N 1.341 0.206 0 C-N-CA 126.422 1.889 . . . . 0.0 114.357 -174.134 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 19.7 m -61.88 -29.43 70.19 Favored 'General case' 0 C--O 1.232 0.138 0 O-C-N 122.079 -0.388 . . . . 0.0 111.544 -171.643 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 60.2 m80 -75.66 -29.2 59.0 Favored 'General case' 0 N--CA 1.45 -0.444 0 C-N-CA 122.467 0.307 . . . . 0.0 110.62 178.516 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . 0.461 ' HE2' ' O ' ' A' ' 57' ' ' CYS . 66.4 mttm -68.33 -37.85 80.96 Favored 'General case' 0 C--N 1.34 0.182 0 N-CA-C 109.092 -0.707 . . . . 0.0 109.092 174.241 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -61.61 -44.66 96.59 Favored 'General case' 0 C--N 1.341 0.213 0 N-CA-C 108.437 -0.949 . . . . 0.0 108.437 177.321 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -68.76 -28.31 73.2 Favored Glycine 0 CA--C 1.526 0.733 0 N-CA-C 111.609 -0.596 . . . . 0.0 111.609 -179.539 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 37.0 p -67.73 -36.94 81.49 Favored 'General case' 0 N--CA 1.452 -0.326 0 CA-C-N 117.965 0.883 . . . . 0.0 109.497 177.71 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 79.0 mt -75.47 -26.81 58.54 Favored 'General case' 0 N--CA 1.449 -0.5 0 CA-C-N 116.506 -0.315 . . . . 0.0 110.935 179.573 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 10.0 m-30 -69.29 -37.72 77.97 Favored 'General case' 0 CA--C 1.513 -0.476 0 CA-C-N 118.367 0.531 . . . . 0.0 110.97 174.231 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 68' ' ' ILE . . . . . 0.469 HD11 ' CE1' ' A' ' 17' ' ' PHE . 18.2 mt -63.87 -47.83 88.99 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.764 0 N-CA-C 107.501 -1.296 . . . . 0.0 107.501 178.907 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 97.0 mt -59.4 -32.56 48.93 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.155 0 C-N-CA 123.832 0.853 . . . . 0.0 111.34 177.056 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 15.2 t70 -68.89 -54.9 12.99 Favored 'General case' 0 CA--C 1.52 -0.196 0 CA-C-N 118.26 0.482 . . . . 0.0 111.134 179.183 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 32.3 t -70.02 -42.33 73.11 Favored 'General case' 0 N--CA 1.452 -0.342 0 C-N-CA 120.829 -0.348 . . . . 0.0 110.795 -174.353 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -74.99 -34.89 33.67 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.233 0 N-CA-C 109.583 -0.525 . . . . 0.0 109.583 179.851 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -70.15 -52.0 20.25 Favored Glycine 0 C--N 1.338 0.667 0 N-CA-C 111.619 -0.592 . . . . 0.0 111.619 -176.531 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 38.6 mtm180 -65.95 -41.79 90.83 Favored 'General case' 0 N--CA 1.45 -0.466 0 C-N-CA 120.306 -0.558 . . . . 0.0 109.608 178.839 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -67.44 -31.29 71.36 Favored 'General case' 0 N--CA 1.45 -0.442 0 C-N-CA 119.703 -0.799 . . . . 0.0 110.865 -177.645 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 1.4 m-30 -66.52 -44.84 81.38 Favored 'General case' 0 CA--C 1.52 -0.199 0 CA-C-N 118.801 0.728 . . . . 0.0 110.348 177.368 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 42.9 tp -70.62 -45.74 64.65 Favored 'General case' 0 N--CA 1.447 -0.6 0 C-N-CA 117.914 -1.514 . . . . 0.0 109.281 179.387 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 83.1 m-20 -56.91 -45.91 82.31 Favored 'General case' 0 CA--C 1.531 0.247 0 N-CA-C 113.164 0.802 . . . . 0.0 113.164 179.017 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 4.7 tm-20 -64.79 -48.62 73.78 Favored 'General case' 0 N--CA 1.453 -0.323 0 CA-C-N 119.115 0.87 . . . . 0.0 110.994 -179.66 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 68.9 p -67.41 -25.91 66.17 Favored 'General case' 0 CA--C 1.528 0.125 0 O-C-N 122.219 -0.301 . . . . 0.0 110.694 179.133 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 35.3 ttp180 -75.93 -20.36 58.04 Favored 'General case' 0 N--CA 1.452 -0.361 0 C-N-CA 124.155 0.982 . . . . 0.0 111.757 171.98 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 53.4 m -83.21 -26.71 30.55 Favored 'General case' 0 CA--C 1.529 0.135 0 CA-C-O 119.364 -0.35 . . . . 0.0 111.77 -179.4 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 58.0 t30 -159.2 158.41 32.62 Favored 'General case' 0 N--CA 1.454 -0.257 0 CA-C-N 118.132 0.424 . . . . 0.0 110.255 177.709 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 36.9 t -70.23 35.75 0.04 OUTLIER 'General case' 0 CA--C 1.535 0.387 0 C-N-CA 124.02 0.928 . . . . 0.0 112.948 -177.396 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 74.3 m-20 -65.65 141.29 58.44 Favored 'General case' 0 N--CA 1.453 -0.278 0 O-C-N 121.922 -0.487 . . . . 0.0 110.169 179.457 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 37.3 t -160.99 149.9 16.53 Favored 'General case' 0 N--CA 1.454 -0.25 0 CA-C-O 120.374 0.131 . . . . 0.0 110.76 179.508 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 27.9 t -81.67 -179.35 7.35 Favored 'General case' 0 N--CA 1.452 -0.335 0 N-CA-C 108.855 -0.794 . . . . 0.0 108.855 171.62 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 93.5 p -74.77 2.94 8.9 Favored 'General case' 0 CA--C 1.533 0.323 0 N-CA-C 112.882 0.697 . . . . 0.0 112.882 -177.37 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 25.6 t-20 -156.83 178.2 10.62 Favored 'General case' 0 CA--C 1.531 0.215 0 CA-C-N 118.541 0.61 . . . . 0.0 110.505 -176.226 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 90' ' ' LYS . . . . . 0.421 ' N ' ' HD2' ' A' ' 91' ' ' PRO . 28.6 tptp -59.91 -51.56 79.82 Favored Pre-proline 0 CA--C 1.536 0.41 0 CA-C-O 118.403 -0.808 . . . . 0.0 110.694 177.614 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 91' ' ' PRO . . . . . 0.421 ' HD2' ' N ' ' A' ' 90' ' ' LYS . 58.3 Cg_endo -65.92 151.18 84.77 Favored 'Trans proline' 0 N--CA 1.453 -0.906 0 C-N-CA 122.149 1.899 . . . . 0.0 108.647 169.365 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 96.1 19.56 28.19 Favored Glycine 0 CA--C 1.525 0.683 0 CA-C-O 119.466 -0.63 . . . . 0.0 112.569 -176.841 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 37.3 p -151.62 171.33 17.79 Favored 'General case' 0 CA--C 1.521 -0.17 0 CA-C-N 118.327 1.064 . . . . 0.0 110.922 178.595 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 94' ' ' CYS . . . . . 0.451 ' HB2' HD13 ' A' ' 98' ' ' ILE . 29.6 p -59.23 -24.79 63.47 Favored 'General case' 0 N--CA 1.451 -0.394 0 CA-C-N 115.404 -0.816 . . . . 0.0 109.287 175.133 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -60.69 -57.99 10.37 Favored 'General case' 0 N--CA 1.446 -0.675 0 N-CA-C 109.381 -0.6 . . . . 0.0 109.381 -176.814 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 63.0 t60 -75.4 -30.18 60.01 Favored 'General case' 0 N--CA 1.451 -0.406 0 N-CA-C 111.603 0.223 . . . . 0.0 111.603 -179.03 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -68.53 -51.36 43.84 Favored 'General case' 0 N--CA 1.448 -0.539 0 O-C-N 123.029 0.206 . . . . 0.0 111.127 -178.473 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 98' ' ' ILE . . . . . 0.451 HD13 ' HB2' ' A' ' 94' ' ' CYS . 2.0 mp -72.01 -29.62 33.66 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.198 0 C-N-CA 120.785 -0.366 . . . . 0.0 110.323 179.874 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 4.5 m120 -64.65 -48.78 73.56 Favored 'General case' 0 N--CA 1.455 -0.19 0 CA-C-N 118.373 0.533 . . . . 0.0 110.322 175.663 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 43.9 m -71.79 -33.94 69.0 Favored 'General case' 0 N--CA 1.456 -0.126 0 O-C-N 122.322 -0.236 . . . . 0.0 110.61 -175.717 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -71.04 -40.85 71.45 Favored 'General case' 0 N--CA 1.447 -0.578 0 N-CA-C 110.225 -0.287 . . . . 0.0 110.225 -179.794 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -64.27 -22.54 67.38 Favored Glycine 0 CA--C 1.528 0.906 0 CA-C-O 119.185 -0.786 . . . . 0.0 114.045 -172.333 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 16.0 mt-10 -95.16 -13.8 24.7 Favored 'General case' 0 C--O 1.231 0.116 0 CA-C-N 118.649 1.225 . . . . 0.0 112.015 -178.492 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 48.2 t -113.18 -23.45 4.34 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.198 0 CA-C-N 116.691 -0.231 . . . . 0.0 111.289 -173.543 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 105' ' ' ILE . . . . . . . . . . . . . 10.0 tp -59.98 -23.3 26.52 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.146 0 C-N-CA 122.922 0.489 . . . . 0.0 111.369 -178.34 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 26.5 pt20 -65.58 -29.53 70.14 Favored 'General case' 0 N--CA 1.452 -0.373 0 N-CA-C 110.288 -0.264 . . . . 0.0 110.288 179.351 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 107' ' ' GLU . . . . . 0.43 ' CD ' HH22 ' A' ' 55' ' ' ARG . 37.8 mt-10 -75.88 -39.91 55.54 Favored 'General case' 0 N--CA 1.455 -0.19 0 CA-C-N 118.079 0.4 . . . . 0.0 110.164 177.445 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 9.8 mp -67.95 -42.37 81.07 Favored 'General case' 0 N--CA 1.453 -0.314 0 N-CA-C 110.066 -0.346 . . . . 0.0 110.066 -178.462 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 90.2 mt -69.52 -59.17 3.15 Favored 'General case' 0 N--CA 1.454 -0.27 0 CA-C-O 119.113 -0.47 . . . . 0.0 110.583 -179.285 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 12.1 p -45.5 -52.74 9.88 Favored 'General case' 0 C--O 1.232 0.17 0 CA-C-N 118.163 0.438 . . . . 0.0 111.806 -179.696 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 34.2 t0 -64.34 -38.93 92.76 Favored 'General case' 0 N--CA 1.445 -0.706 0 N-CA-C 110.099 -0.334 . . . . 0.0 110.099 -178.271 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -70.41 -32.98 70.82 Favored 'General case' 0 N--CA 1.448 -0.568 0 CA-C-O 119.244 -0.407 . . . . 0.0 110.671 -177.914 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 113' ' ' ILE . . . . . . . . . . . . . 46.1 mm -65.23 -41.3 91.21 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.133 0 N-CA-C 108.525 -0.917 . . . . 0.0 108.525 178.175 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -74.6 -38.46 62.6 Favored 'General case' 0 N--CA 1.454 -0.27 0 N-CA-C 112.13 0.418 . . . . 0.0 112.13 179.89 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -75.5 -34.17 60.82 Favored 'General case' 0 C--N 1.339 0.138 0 N-CA-C 112.784 0.661 . . . . 0.0 112.784 -176.53 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 116' ' ' SER . . . . . 0.479 ' HB2' ' HB2' ' A' ' 120' ' ' HIS . 86.5 p -82.13 154.08 25.71 Favored 'General case' 0 N--CA 1.452 -0.352 0 N-CA-C 113.739 1.014 . . . . 0.0 113.739 -168.718 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 48.8 t30 -72.01 165.46 24.2 Favored 'General case' 0 CA--C 1.533 0.296 0 C-N-CA 124.036 0.935 . . . . 0.0 110.329 176.27 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 118' ' ' GLN . . . . . . . . . . . . . 25.6 mm100 -52.71 -40.78 63.31 Favored 'General case' 0 N--CA 1.456 -0.141 0 N-CA-C 113.239 0.829 . . . . 0.0 113.239 -171.633 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 20.4 p-10 -72.44 -41.06 66.56 Favored 'General case' 0 N--CA 1.456 -0.151 0 C-N-CA 120.606 -0.437 . . . . 0.0 109.828 -179.613 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 120' ' ' HIS . . . . . 0.479 ' HB2' ' HB2' ' A' ' 116' ' ' SER . 14.6 m-70 -65.22 -34.83 79.3 Favored 'General case' 0 N--CA 1.452 -0.334 0 C-N-CA 123.11 0.564 . . . . 0.0 110.366 178.226 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 55.8 mttm -61.15 -46.26 91.26 Favored 'General case' 0 C--N 1.341 0.208 0 N-CA-C 108.638 -0.875 . . . . 0.0 108.638 175.062 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 40.7 tp10 -67.39 -36.79 82.02 Favored 'General case' 0 N--CA 1.452 -0.336 0 CA-C-N 116.513 -0.312 . . . . 0.0 111.108 -176.313 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 34.1 mtmt -64.36 -31.68 72.98 Favored 'General case' 0 N--CA 1.452 -0.332 0 N-CA-C 109.61 -0.515 . . . . 0.0 109.61 176.912 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 124' ' ' ILE . . . . . . . . . . . . . 53.7 mt -74.0 -35.86 43.13 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.319 0 O-C-N 121.642 -0.661 . . . . 0.0 109.785 175.696 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 11.7 mmm180 -63.79 -39.74 94.97 Favored 'General case' 0 C--N 1.34 0.174 0 CA-C-N 118.522 0.601 . . . . 0.0 110.353 -179.778 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 126' ' ' MET . . . . . . . . . . . . . 18.6 ptp -68.9 -32.26 71.77 Favored 'General case' 0 N--CA 1.455 -0.189 0 C-N-CA 119.623 -0.831 . . . . 0.0 109.354 176.736 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 2.0 mp -60.52 -33.06 72.09 Favored 'General case' 0 CA--C 1.531 0.221 0 CA-C-N 118.647 0.658 . . . . 0.0 110.277 175.787 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 128' ' ' LEU . . . . . 0.435 ' HA ' HD13 ' A' ' 128' ' ' LEU . 3.1 mm? -70.27 -42.11 72.56 Favored 'General case' 0 CA--C 1.523 -0.064 0 CA-C-N 118.701 0.682 . . . . 0.0 109.992 177.196 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 15.6 t0 -61.0 -45.03 96.49 Favored 'General case' 0 N--CA 1.455 -0.211 0 CA-C-O 121.085 0.469 . . . . 0.0 109.797 177.124 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 130' ' ' ILE . . . . . 0.413 ' HA ' ' HD3' ' A' ' 133' ' ' ARG . 53.6 mt -61.05 -36.89 75.6 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.348 0 C-N-CA 123.575 0.75 . . . . 0.0 110.511 -178.29 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 131' ' ' TRP . . . . . . . . . . . . . 51.3 m0 -77.98 -31.32 50.7 Favored 'General case' 0 N--CA 1.451 -0.383 0 N-CA-C 112.897 0.703 . . . . 0.0 112.897 -179.834 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 88.6 m-20 -75.1 -22.77 58.04 Favored 'General case' 0 N--CA 1.454 -0.246 0 CA-C-N 118.258 0.481 . . . . 0.0 110.803 176.965 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 133' ' ' ARG . . . . . 0.466 HH21 ' C ' ' B' 2063 ' ' SER . 16.0 mtp180 -75.56 -35.99 60.52 Favored 'General case' 0 C--N 1.339 0.136 0 C-N-CA 123.099 0.56 . . . . 0.0 110.411 172.783 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 44.6 t -72.69 -16.22 61.68 Favored 'General case' 0 N--CA 1.455 -0.203 0 C-N-CA 122.594 0.358 . . . . 0.0 111.714 -179.692 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 135' ' ' GLY . . . . . . . . . . . . . . . 78.94 15.3 80.87 Favored Glycine 0 CA--C 1.527 0.83 0 CA-C-O 119.519 -0.601 . . . . 0.0 111.962 -179.451 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 136' ' ' LEU . . . . . . . . . . . . . 25.5 mt -60.84 156.94 16.13 Favored 'General case' 0 N--CA 1.456 -0.133 0 CA-C-N 117.793 0.796 . . . . 0.0 109.645 176.204 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 137' ' ' PHE . . . . . . . . . . . . . 79.7 t80 -66.99 -34.41 77.69 Favored 'General case' 0 C--O 1.232 0.177 0 N-CA-C 112.919 0.711 . . . . 0.0 112.919 -171.46 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 138' ' ' GLN . . . . . . . . . . . . . 18.5 pm0 -71.27 152.24 43.47 Favored 'General case' 0 N--CA 1.455 -0.21 0 CA-C-N 118.497 0.589 . . . . 0.0 109.683 178.253 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 139' ' ' LYS . . . . . . . . . . . . . 13.4 mmtm -138.83 143.81 39.0 Favored 'General case' 0 N--CA 1.456 -0.135 0 CA-C-O 121.184 0.516 . . . . 0.0 111.222 -175.304 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 140' ' ' SER . . . . . . . . . . . . . 88.1 p -74.63 -4.51 37.59 Favored 'General case' 0 N--CA 1.456 -0.171 0 C-N-CA 123.976 0.91 . . . . 0.0 112.368 -179.162 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 141' ' ' TYR . . . . . . . . . . . . . 6.4 m-30 -76.23 -17.49 59.48 Favored 'General case' 0 N--CA 1.455 -0.213 0 N-CA-C 113.033 0.753 . . . . 0.0 113.033 -173.272 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 142' ' ' LEU . . . . . . . . . . . . . 79.3 mt -74.03 139.75 44.94 Favored 'General case' 0 N--CA 1.456 -0.164 0 CA-C-N 118.771 0.714 . . . . 0.0 110.285 -175.859 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 17.6 p30 -67.53 -14.9 63.34 Favored 'General case' 0 CA--C 1.531 0.226 0 CA-C-N 116.822 -0.172 . . . . 0.0 111.386 -176.977 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . -67.96 -34.47 76.62 Favored 'General case' 0 N--CA 1.447 -0.585 0 N-CA-C 109.409 -0.589 . . . . 0.0 109.409 175.182 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 145' ' ' ILE . . . . . . . . . . . . . 19.5 mm -78.33 -25.21 13.83 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.236 0 CA-C-O 120.588 0.233 . . . . 0.0 110.389 -179.871 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 146' ' ' ARG . . . . . . . . . . . . . 37.2 mtt180 -73.4 -23.93 60.23 Favored 'General case' 0 N--CA 1.456 -0.152 0 N-CA-C 109.718 -0.475 . . . . 0.0 109.718 175.425 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 147' ' ' SER . . . . . . . . . . . . . 84.1 p 46.69 57.1 5.83 Favored 'General case' 0 C--N 1.339 0.148 0 C-N-CA 124.604 1.162 . . . . 0.0 111.399 172.003 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 148' ' ' LYS . . . . . 0.615 ' HD3' ' H ' ' A' ' 148' ' ' LYS . 0.0 OUTLIER -54.72 -14.99 1.56 Allowed 'General case' 0 CA--C 1.532 0.283 0 C-N-CA 124.229 1.012 . . . . 0.0 112.408 -178.566 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 149' ' ' CYS . . . . . . . . . . . . . 26.1 p -63.13 -29.81 71.09 Favored 'General case' 0 N--CA 1.452 -0.374 0 CA-C-N 118.345 0.52 . . . . 0.0 109.757 177.432 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 150' ' ' PHE . . . . . . . . . . . . . 43.4 t80 -70.71 -24.62 62.68 Favored 'General case' 0 N--CA 1.453 -0.285 0 CA-C-N 118.142 0.428 . . . . 0.0 110.265 179.224 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 151' ' ' ALA . . . . . . . . . . . . . . . -76.62 -30.54 56.95 Favored 'General case' 0 N--CA 1.45 -0.46 0 N-CA-C 109.67 -0.493 . . . . 0.0 109.67 174.555 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 152' ' ' MET . . . . . . . . . . . . . 96.7 mmm -73.3 -23.49 60.28 Favored 'General case' 0 CA--C 1.531 0.212 0 CA-C-O 119.746 -0.168 . . . . 0.0 111.121 176.711 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 153' ' ' ASP . . . . . . . . . . . . . 71.1 m-20 -68.18 -14.14 62.76 Favored 'General case' 0 CA--C 1.531 0.22 0 C-N-CA 122.455 0.302 . . . . 0.0 111.552 175.209 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 154' ' ' LEU . . . . . . . . . . . . . 52.7 mt -78.44 38.95 0.32 Allowed 'General case' 0 CA--C 1.53 0.175 0 C-N-CA 123.117 0.567 . . . . 0.0 111.666 -179.934 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 155' ' ' GLU . . . . . . . . . . . . . 17.2 pt-20 -73.69 -174.73 1.84 Allowed 'General case' 0 CA--C 1.535 0.393 0 C-N-CA 123.056 0.542 . . . . 0.0 111.087 -178.965 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 156' ' ' HIS . . . . . . . . . . . . . 80.3 t60 -64.88 -1.17 1.82 Allowed 'General case' 0 CA--C 1.534 0.35 0 N-CA-C 113.682 0.993 . . . . 0.0 113.682 -174.105 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 157' ' ' HIS . . . . . . . . . . . . . 35.3 p-80 -152.26 156.14 39.1 Favored 'General case' 0 N--CA 1.453 -0.314 0 CA-C-N 118.158 0.436 . . . . 0.0 109.878 -179.676 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 158' ' ' HIS . . . . . . . . . . . . . 53.2 p-80 -83.24 164.68 19.96 Favored 'General case' 0 N--CA 1.453 -0.304 0 C-N-CA 122.649 0.38 . . . . 0.0 110.463 178.111 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 159' ' ' HIS . . . . . . . . . . . . . 59.5 m170 . . . . . 0 C--O 1.251 1.151 0 CA-C-O 117.251 -1.357 . . . . 0.0 110.013 176.654 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' B' B 2052 ' ' ASP . . . . . 0.493 ' OD2' ' HE2' ' A' ' 21' ' ' LYS . 0.7 OUTLIER . . . . . 0 N--CA 1.473 0.714 0 CA-C-O 120.274 0.083 . . . . 0.0 111.094 . . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B 2053 ' ' ASP . . . . . . . . . . . . . 50.2 p-10 -124.22 20.31 8.95 Favored 'General case' 0 CA--C 1.53 0.174 0 C-N-CA 123.523 0.729 . . . . 0.0 110.664 -177.041 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B 2054 ' ' ASP . . . . . . . . . . . . . 38.5 t0 -142.74 179.48 6.97 Favored 'General case' 0 N--CA 1.451 -0.397 0 N-CA-C 109.394 -0.595 . . . . 0.0 109.394 -175.606 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B 2055 ' ' GLU . . . . . . . . . . . . . 86.4 mt-10 -57.87 -13.16 3.9 Favored 'General case' 0 N--CA 1.454 -0.232 0 C-N-CA 124.24 1.016 . . . . 0.0 111.934 179.379 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B 2056 ' ' ASP . . . . . . . . . . . . . 91.3 m-20 47.72 -126.27 1.76 Allowed 'General case' 0 N--CA 1.452 -0.335 0 C-N-CA 123.164 0.586 . . . . 0.0 110.708 -177.298 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B 2057 ' ' ASP . . . . . . . . . . . . . 28.5 t0 -57.06 89.64 0.01 OUTLIER 'General case' 0 CA--C 1.533 0.316 0 C-N-CA 123.858 0.863 . . . . 0.0 112.429 -173.293 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B 2058 ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -62.78 142.57 58.12 Favored 'General case' 0 N--CA 1.454 -0.252 0 C-N-CA 124.967 1.307 . . . . 0.0 110.994 178.628 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B 2059 ' ' THR . . . . . . . . . . . . . 52.5 m -112.13 117.89 47.01 Favored Pre-proline 0 N--CA 1.452 -0.326 0 N-CA-C 108.633 -0.877 . . . . 0.0 108.633 178.216 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B 2060 ' ' PRO . . . . . . . . . . . . . 88.9 Cg_endo -75.5 167.66 26.1 Favored 'Trans proline' 0 N--CA 1.45 -1.062 0 C-N-CA 123.678 2.919 . . . . 0.0 111.378 -178.39 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B 2061 ' ' SER . . . . . . . . . . . . . 39.9 t -150.41 142.76 24.3 Favored 'General case' 0 N--CA 1.453 -0.282 0 N-CA-C 109.364 -0.606 . . . . 0.0 109.364 175.861 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B 2062 ' ' ILE . . . . . 0.409 HD13 ' HB2' ' A' ' 133' ' ' ARG . 16.7 tt -167.06 155.34 1.29 Allowed 'Isoleucine or valine' 0 N--CA 1.455 -0.217 0 C-N-CA 123.508 0.723 . . . . 0.0 110.052 -178.181 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B 2063 ' ' SER . . . . . 0.466 ' C ' HH21 ' A' ' 133' ' ' ARG . 80.3 p . . . . . 0 C--O 1.247 0.96 0 CA-C-O 117.211 -1.376 . . . . 0.0 109.722 174.453 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.473 0.697 0 N-CA-C 110.286 -0.264 . . . . 0.0 110.286 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' GLN . . . . . 0.595 ' HG2' ' H ' ' A' ' 4' ' ' ASP . 14.5 pm0 -157.52 -165.37 1.77 Allowed 'General case' 0 N--CA 1.453 -0.293 0 N-CA-C 108.709 -0.849 . . . . 0.0 108.709 -178.62 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 4.6 pm0 -61.38 -10.75 7.97 Favored 'General case' 0 CA--C 1.532 0.268 0 O-C-N 121.519 -0.738 . . . . 0.0 112.547 -178.236 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' ASP . . . . . 0.595 ' H ' ' HG2' ' A' ' 2' ' ' GLN . 4.8 m-20 -86.24 8.46 21.15 Favored 'General case' 0 C--N 1.341 0.219 0 N-CA-C 112.467 0.543 . . . . 0.0 112.467 179.606 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 25.3 m-20 -81.67 11.31 4.88 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.927 -0.579 . . . . 0.0 111.998 -176.634 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 18.8 p-10 -76.83 -32.18 57.39 Favored 'General case' 0 N--CA 1.453 -0.32 0 N-CA-C 107.443 -1.317 . . . . 0.0 107.443 173.599 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER -62.34 -34.42 76.6 Favored 'General case' 0 N--CA 1.443 -0.816 0 C-N-CA 125.515 1.526 . . . . 0.0 111.174 -176.427 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 17.4 tp60 -50.56 -36.2 33.38 Favored 'General case' 0 N--CA 1.456 -0.135 0 C-N-CA 123.141 0.576 . . . . 0.0 111.325 -178.455 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 26.5 m-80 -70.99 -39.69 72.31 Favored 'General case' 0 N--CA 1.454 -0.248 0 N-CA-C 110.194 -0.298 . . . . 0.0 110.194 -179.389 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' PHE . . . . . 0.526 ' CE2' ' HB2' ' A' ' 32' ' ' LEU . 3.7 t80 -68.56 -37.51 79.96 Favored 'General case' 0 N--CA 1.451 -0.408 0 C-N-CA 123.476 0.71 . . . . 0.0 109.873 178.089 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 94.7 t -66.28 -51.19 61.67 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.219 0 N-CA-C 108.221 -1.029 . . . . 0.0 108.221 178.601 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -61.64 -25.76 67.57 Favored 'General case' 0 N--CA 1.452 -0.344 0 C-N-CA 122.844 0.458 . . . . 0.0 111.717 179.789 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 59.3 m -74.61 -37.02 62.96 Favored 'General case' 0 N--CA 1.456 -0.155 0 N-CA-C 108.972 -0.751 . . . . 0.0 108.972 175.613 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -66.49 -44.25 83.16 Favored 'General case' 0 N--CA 1.448 -0.54 0 N-CA-C 108.617 -0.883 . . . . 0.0 108.617 177.088 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 68.2 mm-40 -66.53 -27.03 67.44 Favored 'General case' 0 N--CA 1.451 -0.41 0 C-N-CA 123.952 0.901 . . . . 0.0 110.001 177.864 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 22.0 t -67.93 -35.16 77.97 Favored 'General case' 0 N--CA 1.451 -0.379 0 N-CA-C 109.316 -0.624 . . . . 0.0 109.316 177.521 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' PHE . . . . . 0.519 ' HA ' HD12 ' A' ' 20' ' ' LEU . 46.6 m-85 -67.9 -39.32 83.64 Favored 'General case' 0 CA--C 1.518 -0.267 0 C-N-CA 120.304 -0.558 . . . . 0.0 110.439 173.977 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 72.1 mttt -58.7 -32.81 69.5 Favored 'General case' 0 C--N 1.339 0.11 0 C-N-CA 120.46 -0.496 . . . . 0.0 109.714 178.849 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 24.9 t0 -76.33 -45.73 30.84 Favored 'General case' 0 N--CA 1.456 -0.151 0 C-N-CA 123.27 0.628 . . . . 0.0 111.05 176.292 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . 0.519 HD12 ' HA ' ' A' ' 17' ' ' PHE . 3.8 mt -46.99 136.49 8.38 Favored 'General case' 0 N--CA 1.454 -0.231 0 C-N-CA 123.224 0.61 . . . . 0.0 112.073 -173.473 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.49 -13.0 60.26 Favored 'General case' 0 CA--C 1.53 0.205 0 CA-C-N 115.252 -0.886 . . . . 0.0 111.88 -174.621 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' SER . . . . . 0.418 ' C ' ' H ' ' A' ' 24' ' ' ILE . 67.3 m -120.96 -10.85 9.02 Favored 'General case' 0 CA--C 1.528 0.122 0 C-N-CA 123.692 0.797 . . . . 0.0 112.005 -178.397 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 74.39 -21.66 1.43 Allowed Glycine 0 CA--C 1.531 1.059 0 N-CA-C 111.344 -0.702 . . . . 0.0 111.344 -174.824 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . 0.418 ' H ' ' C ' ' A' ' 22' ' ' SER . 81.0 mt -94.19 154.22 3.34 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.136 0 C-N-CA 124.498 1.119 . . . . 0.0 109.604 174.301 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . 0.507 ' HB2' HD13 ' A' ' 20' ' ' LEU . 30.3 t -168.44 107.38 0.49 Allowed 'General case' 0 CA--C 1.517 -0.306 0 CA-C-O 119.451 -0.309 . . . . 0.0 110.289 168.933 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . 0.421 ' O ' ' HE2' ' A' ' 30' ' ' LYS . . . -54.61 -39.57 67.13 Favored Glycine 0 CA--C 1.524 0.634 0 C-N-CA 120.091 -1.052 . . . . 0.0 110.618 179.924 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 29.0 t -63.08 -52.31 63.21 Favored 'General case' 0 N--CA 1.455 -0.193 0 CA-C-N 117.866 0.833 . . . . 0.0 110.745 -178.075 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 74.2 mmt-85 -68.17 -39.46 82.56 Favored 'General case' 0 C--O 1.231 0.129 0 O-C-N 122.103 -0.373 . . . . 0.0 110.265 -178.971 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 72.9 mt -61.01 -47.59 92.89 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.511 0 N-CA-C 109.595 -0.52 . . . . 0.0 109.595 178.789 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . 0.421 ' HE2' ' O ' ' A' ' 26' ' ' GLY . 51.2 mtmt -64.75 -28.97 69.94 Favored 'General case' 0 C--N 1.341 0.2 0 CA-C-O 119.289 -0.386 . . . . 0.0 111.151 -179.782 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . 0.434 ' HA ' ' HE2' ' A' ' 31' ' ' LYS . 4.6 mmpt? -65.63 -58.74 5.01 Favored 'General case' 0 C--O 1.231 0.085 0 CA-C-N 118.362 0.528 . . . . 0.0 110.839 179.547 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.556 HD12 ' N ' ' A' ' 33' ' ' THR . 1.6 pp -72.21 -20.97 61.48 Favored 'General case' 0 CA--C 1.528 0.115 0 C-N-CA 118.967 -1.093 . . . . 0.0 111.249 -177.642 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . 0.556 ' N ' HD12 ' A' ' 32' ' ' LEU . 55.2 m -72.51 -40.7 66.65 Favored 'General case' 0 N--CA 1.455 -0.215 0 N-CA-C 109.364 -0.606 . . . . 0.0 109.364 178.169 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 99.9 m -69.31 -38.29 78.17 Favored 'General case' 0 N--CA 1.451 -0.389 0 C-N-CA 121.008 -0.277 . . . . 0.0 110.392 -177.671 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 42.9 t80 -66.44 -34.33 77.7 Favored 'General case' 0 N--CA 1.455 -0.223 0 C-N-CA 119.821 -0.752 . . . . 0.0 110.047 176.547 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -71.49 -32.18 67.95 Favored 'General case' 0 N--CA 1.452 -0.347 0 CA-C-O 119.376 -0.345 . . . . 0.0 111.477 179.094 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -75.07 -34.1 61.77 Favored 'General case' 0 N--CA 1.457 -0.103 0 CA-C-N 118.129 0.422 . . . . 0.0 110.544 179.003 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 44.1 t0 -67.71 -22.74 65.24 Favored 'General case' 0 N--CA 1.455 -0.212 0 N-CA-C 110.403 -0.221 . . . . 0.0 110.403 175.86 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 98.1 m-70 -151.44 99.01 2.59 Favored 'General case' 0 C--N 1.342 0.263 0 C-N-CA 122.871 0.468 . . . . 0.0 111.461 -175.157 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 40' ' ' ILE . . . . . 0.505 ' H ' HD13 ' A' ' 40' ' ' ILE . 0.0 OUTLIER -75.91 -14.59 15.2 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.322 0 CA-C-O 119.268 -0.396 . . . . 0.0 110.478 175.14 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 89.4 m-20 -58.58 -16.88 17.76 Favored 'General case' 0 CA--C 1.531 0.232 0 N-CA-C 112.723 0.638 . . . . 0.0 112.723 -178.204 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -106.71 13.19 8.33 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.159 0 C-N-CA 122.803 0.441 . . . . 0.0 111.859 177.473 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 3.0 pp20? -52.49 -30.07 28.24 Favored 'General case' 0 CA--C 1.527 0.085 0 O-C-N 121.755 -0.591 . . . . 0.0 111.557 177.532 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 40.3 t -62.4 -48.19 80.79 Favored 'General case' 0 CA--C 1.53 0.209 0 N-CA-C 112.299 0.481 . . . . 0.0 112.299 -179.326 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 18.2 ptpt -71.93 -25.58 61.95 Favored 'General case' 0 C--N 1.339 0.139 0 N-CA-C 109.494 -0.558 . . . . 0.0 109.494 179.32 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 46' ' ' ILE . . . . . 0.467 HG12 ' CZ ' ' A' ' 10' ' ' PHE . 88.7 mt -71.01 -50.38 42.93 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.297 0 C-N-CA 122.798 0.439 . . . . 0.0 110.064 -178.96 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 35.5 mm -63.75 -35.03 71.58 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.169 0 N-CA-C 109.402 -0.592 . . . . 0.0 109.402 179.237 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 50.1 m -63.68 -39.4 94.22 Favored 'General case' 0 N--CA 1.452 -0.332 0 O-C-N 122.429 -0.17 . . . . 0.0 111.073 -179.192 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -78.46 -30.58 47.5 Favored 'General case' 0 N--CA 1.456 -0.163 0 N-CA-C 113.465 0.913 . . . . 0.0 113.465 -178.728 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 13.5 pt -70.15 -40.32 78.08 Favored 'Isoleucine or valine' 0 C--N 1.34 0.161 0 CA-C-N 119.963 1.256 . . . . 0.0 110.259 177.994 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 22.1 pt -69.11 -39.91 80.01 Favored 'Isoleucine or valine' 0 C--N 1.338 0.103 0 C-N-CA 120.138 -0.625 . . . . 0.0 110.315 179.584 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 44.4 t0 -65.42 -49.34 69.58 Favored 'General case' 0 N--CA 1.456 -0.174 0 CA-C-N 117.906 0.321 . . . . 0.0 110.841 178.492 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 44.5 t80 -62.74 -43.22 99.36 Favored 'General case' 0 N--CA 1.453 -0.31 0 N-CA-C 109.538 -0.542 . . . . 0.0 109.538 179.671 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 34.7 t -62.49 -30.83 71.55 Favored 'General case' 0 N--CA 1.454 -0.237 0 CA-C-N 118.175 0.443 . . . . 0.0 111.492 -177.786 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 7.1 tpt180 -81.34 -44.53 17.49 Favored 'General case' 0 N--CA 1.454 -0.25 0 CA-C-N 118.126 0.421 . . . . 0.0 111.271 -178.942 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 95.0 mt -77.37 -47.51 19.69 Favored 'General case' 0 N--CA 1.456 -0.146 0 N-CA-C 114.032 1.123 . . . . 0.0 114.032 -175.56 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 57' ' ' CYS . . . . . 0.425 ' HA ' ' HD3' ' A' ' 58' ' ' PRO . 13.5 p -61.39 158.46 38.09 Favored Pre-proline 0 CA--C 1.536 0.408 0 N-CA-C 113.957 1.095 . . . . 0.0 113.957 -169.718 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 58' ' ' PRO . . . . . 0.425 ' HD3' ' HA ' ' A' ' 57' ' ' CYS . 31.7 Cg_exo -59.12 174.05 1.09 Allowed 'Trans proline' 0 N--CA 1.455 -0.774 1 C-N-CA 125.801 4.334 . . . . 0.0 113.439 176.442 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 27.3 p30 -58.48 -47.75 83.06 Favored 'General case' 0 CA--C 1.531 0.225 0 CA-C-N 115.179 -0.919 . . . . 0.0 112.624 -173.695 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 34.3 m -70.66 -29.77 66.2 Favored 'General case' 0 N--CA 1.453 -0.299 0 CA-C-O 120.927 0.394 . . . . 0.0 110.18 -179.0 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 62.9 m80 -75.34 -27.16 59.1 Favored 'General case' 0 N--CA 1.45 -0.468 0 C-N-CA 122.812 0.445 . . . . 0.0 110.313 177.701 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . 0.416 ' HE2' ' O ' ' A' ' 57' ' ' CYS . 64.1 mttm -67.79 -37.46 82.05 Favored 'General case' 0 N--CA 1.457 -0.084 0 N-CA-C 109.668 -0.493 . . . . 0.0 109.668 171.613 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -62.79 -42.84 99.88 Favored 'General case' 0 CA--C 1.53 0.199 0 N-CA-C 108.045 -1.095 . . . . 0.0 108.045 173.341 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -66.83 -30.99 76.99 Favored Glycine 0 C--N 1.34 0.75 0 N-CA-C 111.811 -0.515 . . . . 0.0 111.811 -179.423 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 30.0 t -68.62 -40.45 80.37 Favored 'General case' 0 N--CA 1.45 -0.443 0 CA-C-N 117.665 0.732 . . . . 0.0 109.884 178.317 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 77.0 mt -70.99 -24.12 62.32 Favored 'General case' 0 N--CA 1.45 -0.438 0 N-CA-C 109.767 -0.457 . . . . 0.0 109.767 178.922 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -73.49 -38.85 65.25 Favored 'General case' 0 N--CA 1.456 -0.169 0 C-N-CA 122.822 0.449 . . . . 0.0 110.698 174.765 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 68' ' ' ILE . . . . . 0.443 HD11 ' CD1' ' A' ' 17' ' ' PHE . 19.6 mt -65.59 -51.06 67.61 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.295 0 N-CA-C 108.594 -0.891 . . . . 0.0 108.594 175.211 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 86.0 mt -55.89 -32.01 31.63 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.303 0 C-N-CA 123.662 0.785 . . . . 0.0 111.4 176.588 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 15.0 t70 -69.31 -51.41 37.43 Favored 'General case' 0 N--CA 1.454 -0.264 0 O-C-N 121.757 -0.589 . . . . 0.0 111.157 178.757 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 90.2 p -67.64 -48.06 67.79 Favored 'General case' 0 N--CA 1.452 -0.368 0 O-C-N 122.987 0.18 . . . . 0.0 111.059 -175.128 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -75.72 -34.79 29.32 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.168 0 N-CA-C 109.818 -0.438 . . . . 0.0 109.818 -179.672 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -67.82 -48.21 56.48 Favored Glycine 0 C--N 1.336 0.569 0 N-CA-C 110.811 -0.916 . . . . 0.0 110.811 -176.376 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 39.5 mtm180 -68.41 -42.9 78.33 Favored 'General case' 0 N--CA 1.448 -0.526 0 CA-C-N 117.408 0.604 . . . . 0.0 109.899 178.394 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -62.38 -31.31 71.96 Favored 'General case' 0 N--CA 1.449 -0.498 0 C-N-CA 120.302 -0.559 . . . . 0.0 110.498 -178.462 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 1.9 m-30 -70.86 -51.97 23.14 Favored 'General case' 0 N--CA 1.456 -0.169 0 CA-C-N 118.46 0.573 . . . . 0.0 110.934 176.413 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 43.6 tp -68.34 -36.92 79.96 Favored 'General case' 0 N--CA 1.449 -0.493 0 C-N-CA 118.212 -1.395 . . . . 0.0 110.092 -176.952 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 83.8 m-20 -64.89 -45.41 86.07 Favored 'General case' 0 N--CA 1.454 -0.274 0 CA-C-O 119.645 -0.217 . . . . 0.0 111.507 179.052 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 16.0 tm-20 -64.92 -49.04 71.95 Favored 'General case' 0 N--CA 1.446 -0.661 0 CA-C-N 118.17 0.441 . . . . 0.0 111.575 179.378 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 80' ' ' THR . . . . . 0.541 HG21 ' CB ' ' A' ' 94' ' ' CYS . 79.9 p -68.32 -25.45 65.12 Favored 'General case' 0 CA--C 1.531 0.243 0 CA-C-N 117.933 0.333 . . . . 0.0 110.577 -178.538 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 37.3 ttp-105 -74.73 -30.7 61.6 Favored 'General case' 0 CA--C 1.53 0.2 0 C-N-CA 122.813 0.445 . . . . 0.0 111.42 173.023 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 58.0 m -75.74 -28.01 58.34 Favored 'General case' 0 N--CA 1.458 -0.063 0 N-CA-C 112.65 0.611 . . . . 0.0 112.65 -175.839 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -159.95 158.47 30.77 Favored 'General case' 0 N--CA 1.456 -0.15 0 CA-C-N 118.093 0.406 . . . . 0.0 110.951 -179.964 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 32.2 t -71.6 22.12 0.05 OUTLIER 'General case' 0 CA--C 1.535 0.399 0 N-CA-C 113.99 1.108 . . . . 0.0 113.99 -173.308 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 93.3 m-20 -61.62 134.31 56.65 Favored 'General case' 0 N--CA 1.454 -0.231 0 N-CA-C 109.078 -0.712 . . . . 0.0 109.078 177.986 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 77.9 p -160.41 161.45 33.02 Favored 'General case' 0 N--CA 1.452 -0.342 0 CA-C-N 116.508 -0.315 . . . . 0.0 110.341 -176.878 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 87' ' ' SER . . . . . 0.444 ' H ' ' CG2' ' A' ' 93' ' ' THR . 11.1 t -92.62 178.71 5.72 Favored 'General case' 0 N--CA 1.453 -0.304 0 C-N-CA 123.247 0.619 . . . . 0.0 110.533 -179.988 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 79.4 p -73.98 -5.23 40.08 Favored 'General case' 0 N--CA 1.455 -0.224 0 C-N-CA 123.186 0.594 . . . . 0.0 112.455 -178.001 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 11.2 m120 -148.26 178.12 8.84 Favored 'General case' 0 CA--C 1.528 0.126 0 CA-C-N 118.314 0.506 . . . . 0.0 110.294 -175.748 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 90' ' ' LYS . . . . . 0.432 ' HE3' ' HB1' ' A' ' 95' ' ' ALA . 22.0 tptm -59.93 -53.35 66.22 Favored Pre-proline 0 CA--C 1.53 0.183 0 CA-C-O 118.552 -0.737 . . . . 0.0 110.197 176.159 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 91' ' ' PRO . . . . . 0.424 ' HD2' ' N ' ' A' ' 90' ' ' LYS . 55.4 Cg_endo -64.16 152.64 80.3 Favored 'Trans proline' 0 N--CA 1.454 -0.833 0 C-N-CA 122.359 2.039 . . . . 0.0 108.352 171.007 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 95.76 15.53 42.51 Favored Glycine 0 CA--C 1.524 0.645 0 CA-C-O 119.464 -0.631 . . . . 0.0 112.314 -177.165 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 93' ' ' THR . . . . . 0.444 ' CG2' ' H ' ' A' ' 87' ' ' SER . 42.0 p -150.33 168.65 23.47 Favored 'General case' 0 C--N 1.34 0.157 0 CA-C-N 118.446 1.123 . . . . 0.0 111.436 177.825 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 94' ' ' CYS . . . . . 0.657 ' SG ' HD13 ' A' ' 98' ' ' ILE . 7.5 t -54.96 -28.12 48.99 Favored 'General case' 0 N--CA 1.449 -0.48 0 CA-C-N 115.021 -0.991 . . . . 0.0 109.653 173.262 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 95' ' ' ALA . . . . . 0.432 ' HB1' ' HE3' ' A' ' 90' ' ' LYS . . . -57.84 -57.32 13.29 Favored 'General case' 0 N--CA 1.445 -0.71 0 N-CA-C 109.244 -0.65 . . . . 0.0 109.244 -178.324 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 61.0 t60 -75.64 -31.69 59.93 Favored 'General case' 0 N--CA 1.452 -0.35 0 C-N-CA 121.103 -0.239 . . . . 0.0 111.598 -179.193 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -67.4 -48.69 66.62 Favored 'General case' 0 N--CA 1.451 -0.422 0 O-C-N 122.92 0.138 . . . . 0.0 111.039 -177.255 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 98' ' ' ILE . . . . . 0.657 HD13 ' SG ' ' A' ' 94' ' ' CYS . 1.7 mp -73.69 -30.74 29.85 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.208 0 N-CA-C 109.903 -0.406 . . . . 0.0 109.903 179.998 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 3.5 m120 -64.68 -47.93 76.58 Favored 'General case' 0 N--CA 1.457 -0.09 0 CA-C-N 118.423 0.556 . . . . 0.0 110.942 175.104 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 47.5 m -72.39 -25.96 61.7 Favored 'General case' 0 N--CA 1.456 -0.157 0 C-N-CA 122.334 0.254 . . . . 0.0 110.563 -175.259 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 57.5 tp -80.33 -37.5 32.42 Favored 'General case' 0 N--CA 1.447 -0.595 0 C-N-CA 122.794 0.438 . . . . 0.0 110.867 178.876 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -75.02 -24.84 70.61 Favored Glycine 0 CA--C 1.527 0.809 0 CA-C-O 119.485 -0.619 . . . . 0.0 112.74 -175.954 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 24.1 pt-20 -78.14 -2.48 37.71 Favored 'General case' 0 CA--C 1.532 0.27 0 CA-C-N 117.98 0.89 . . . . 0.0 111.604 -179.928 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 36.0 m -138.47 9.56 0.69 Allowed 'Isoleucine or valine' 0 CA--C 1.529 0.167 0 N-CA-C 111.996 0.369 . . . . 0.0 111.996 176.288 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 105' ' ' ILE . . . . . . . . . . . . . 11.2 tp -62.28 -26.18 39.63 Favored 'Isoleucine or valine' 0 N--CA 1.458 -0.065 0 CA-C-N 118.697 0.681 . . . . 0.0 111.408 -175.367 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 10.2 pt20 -67.9 -28.47 67.53 Favored 'General case' 0 N--CA 1.453 -0.287 0 N-CA-C 110.154 -0.313 . . . . 0.0 110.154 178.617 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 74.6 mm-40 -75.55 -42.8 51.45 Favored 'General case' 0 N--CA 1.453 -0.283 0 N-CA-C 110.007 -0.368 . . . . 0.0 110.007 -178.017 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 7.3 mp -69.83 -43.77 71.3 Favored 'General case' 0 N--CA 1.448 -0.525 0 N-CA-C 109.703 -0.48 . . . . 0.0 109.703 -179.119 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 96.2 mt -66.72 -64.14 0.92 Allowed 'General case' 0 N--CA 1.452 -0.348 0 C-N-CA 120.592 -0.443 . . . . 0.0 110.261 178.788 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 21.1 t -50.86 -39.82 54.69 Favored 'General case' 0 C--O 1.233 0.199 0 N-CA-C 112.535 0.569 . . . . 0.0 112.535 -173.593 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 49.7 t0 -68.4 -43.8 76.44 Favored 'General case' 0 N--CA 1.456 -0.146 0 N-CA-C 110.206 -0.294 . . . . 0.0 110.206 178.914 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -69.21 -34.68 75.26 Favored 'General case' 0 N--CA 1.448 -0.569 0 CA-C-N 116.836 -0.166 . . . . 0.0 110.744 -178.137 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 113' ' ' ILE . . . . . . . . . . . . . 46.7 mm -66.96 -36.06 76.23 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.333 0 N-CA-C 109.334 -0.617 . . . . 0.0 109.334 179.204 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -74.81 -42.28 58.34 Favored 'General case' 0 N--CA 1.453 -0.31 0 N-CA-C 111.828 0.307 . . . . 0.0 111.828 178.03 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -78.14 -35.73 48.61 Favored 'General case' 0 N--CA 1.456 -0.163 0 N-CA-C 112.514 0.561 . . . . 0.0 112.514 -174.964 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 116' ' ' SER . . . . . 0.483 ' HB2' ' CB ' ' A' ' 120' ' ' HIS . 54.3 p -81.84 157.13 24.53 Favored 'General case' 0 N--CA 1.456 -0.172 0 N-CA-C 112.892 0.701 . . . . 0.0 112.892 -171.15 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 53.1 t30 -77.03 166.35 23.43 Favored 'General case' 0 C--O 1.226 -0.146 0 C-N-CA 123.203 0.601 . . . . 0.0 110.564 -178.563 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 118' ' ' GLN . . . . . . . . . . . . . 12.8 mt-30 -54.71 -36.54 64.83 Favored 'General case' 0 CA--C 1.531 0.221 0 N-CA-C 112.649 0.611 . . . . 0.0 112.649 -172.663 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 11.2 p-10 -70.99 -39.12 72.65 Favored 'General case' 0 C--O 1.226 -0.144 0 CA-C-O 121.099 0.476 . . . . 0.0 109.877 178.767 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 120' ' ' HIS . . . . . 0.483 ' CB ' ' HB2' ' A' ' 116' ' ' SER . 36.9 m170 -64.74 -38.89 92.53 Favored 'General case' 0 N--CA 1.45 -0.43 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.223 176.473 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 121' ' ' LYS . . . . . 0.614 ' HE3' ' CE2' ' A' ' 150' ' ' PHE . 46.2 mttm -58.95 -43.4 91.23 Favored 'General case' 0 C--N 1.342 0.274 0 N-CA-C 108.719 -0.845 . . . . 0.0 108.719 177.196 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 41.6 tp10 -66.34 -38.73 88.3 Favored 'General case' 0 N--CA 1.454 -0.25 0 CA-C-O 119.459 -0.305 . . . . 0.0 111.358 -176.982 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 53.2 mtpt -65.74 -28.88 69.36 Favored 'General case' 0 N--CA 1.452 -0.341 0 CA-C-N 118.511 0.596 . . . . 0.0 110.225 177.729 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 124' ' ' ILE . . . . . . . . . . . . . 61.6 mt -74.44 -37.18 44.03 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.24 0 N-CA-C 109.544 -0.539 . . . . 0.0 109.544 176.822 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 55.8 mmm-85 -65.53 -42.81 91.57 Favored 'General case' 0 C--O 1.23 0.076 0 O-C-N 122.215 -0.303 . . . . 0.0 110.969 179.851 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 126' ' ' MET . . . . . . . . . . . . . 28.6 ptm -67.57 -29.54 68.93 Favored 'General case' 0 N--CA 1.454 -0.273 0 C-N-CA 119.747 -0.781 . . . . 0.0 109.237 176.563 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 1.7 mp -63.15 -29.61 70.93 Favored 'General case' 0 N--CA 1.455 -0.208 0 CA-C-O 118.993 -0.527 . . . . 0.0 110.29 172.849 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 76.0 mt -69.16 -43.2 74.76 Favored 'General case' 0 C--N 1.34 0.163 0 CA-C-N 119.23 0.923 . . . . 0.0 109.935 175.691 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 67.0 m-20 -60.17 -39.37 86.2 Favored 'General case' 0 N--CA 1.463 0.18 0 CA-C-N 118.331 0.514 . . . . 0.0 110.041 176.514 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 130' ' ' ILE . . . . . 0.439 ' HA ' ' HD3' ' A' ' 133' ' ' ARG . 62.7 mt -66.15 -36.66 77.96 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.401 0 C-N-CA 122.911 0.484 . . . . 0.0 110.063 179.118 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 131' ' ' TRP . . . . . . . . . . . . . 49.4 m0 -75.7 -29.7 59.08 Favored 'General case' 0 N--CA 1.455 -0.197 0 N-CA-C 112.56 0.578 . . . . 0.0 112.56 177.9 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 65.3 m-20 -67.74 -31.5 71.46 Favored 'General case' 0 N--CA 1.454 -0.228 0 CA-C-N 118.243 0.474 . . . . 0.0 109.903 175.975 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 133' ' ' ARG . . . . . 0.439 ' HD3' ' HA ' ' A' ' 130' ' ' ILE . 20.8 mtp180 -73.99 -37.95 64.28 Favored 'General case' 0 C--N 1.338 0.104 0 C-N-CA 122.907 0.483 . . . . 0.0 111.164 178.905 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 43.3 t -75.88 -15.24 60.24 Favored 'General case' 0 CA--C 1.531 0.227 0 O-C-N 122.083 -0.386 . . . . 0.0 110.826 176.045 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 135' ' ' GLY . . . . . . . . . . . . . . . 85.96 12.11 71.98 Favored Glycine 0 CA--C 1.528 0.857 0 CA-C-O 119.557 -0.58 . . . . 0.0 112.648 179.003 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 136' ' ' LEU . . . . . . . . . . . . . 65.3 mt -69.52 -34.58 74.47 Favored 'General case' 0 N--CA 1.454 -0.242 0 CA-C-N 118.034 0.917 . . . . 0.0 111.201 -179.624 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 137' ' ' PHE . . . . . . . . . . . . . 73.5 m-85 -153.78 -169.3 3.24 Favored 'General case' 0 N--CA 1.456 -0.139 0 CA-C-O 120.905 0.383 . . . . 0.0 110.54 -173.017 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 138' ' ' GLN . . . . . . . . . . . . . 4.1 pt20 -147.97 171.59 15.55 Favored 'General case' 0 N--CA 1.45 -0.474 0 C-N-CA 124.437 1.095 . . . . 0.0 108.431 177.562 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 139' ' ' LYS . . . . . . . . . . . . . 57.7 mttp -72.73 61.37 0.53 Allowed 'General case' 0 CA--C 1.53 0.199 0 C-N-CA 123.238 0.615 . . . . 0.0 112.347 -177.786 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 140' ' ' SER . . . . . . . . . . . . . 39.5 t -73.55 49.91 0.31 Allowed 'General case' 0 CA--C 1.533 0.296 0 C-N-CA 124.449 1.1 . . . . 0.0 109.645 172.704 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 141' ' ' TYR . . . . . . . . . . . . . 35.7 t80 -70.54 46.74 0.09 Allowed 'General case' 0 N--CA 1.449 -0.51 0 C-N-CA 126.171 1.789 . . . . 0.0 113.708 -174.185 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 142' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -67.02 169.87 7.68 Favored 'General case' 0 N--CA 1.453 -0.281 0 N-CA-C 109.126 -0.694 . . . . 0.0 109.126 175.427 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 16.6 p30 -60.03 -15.09 19.85 Favored 'General case' 0 CA--C 1.531 0.241 0 O-C-N 122.056 -0.403 . . . . 0.0 111.5 -177.28 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . -70.83 -51.92 23.65 Favored 'General case' 0 N--CA 1.452 -0.334 0 N-CA-C 109.607 -0.516 . . . . 0.0 109.607 175.885 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 145' ' ' ILE . . . . . . . . . . . . . 40.6 mm -72.55 -30.7 35.03 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.135 0 N-CA-C 109.995 -0.372 . . . . 0.0 109.995 178.574 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 146' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -66.21 -24.85 66.69 Favored 'General case' 0 N--CA 1.454 -0.243 0 N-CA-C 108.226 -1.028 . . . . 0.0 108.226 172.498 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 147' ' ' SER . . . . . . . . . . . . . 12.3 t 55.28 77.05 0.23 Allowed 'General case' 0 N--CA 1.449 -0.483 0 C-N-CA 125.015 1.326 . . . . 0.0 111.612 177.305 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.28 -11.72 7.15 Favored 'General case' 0 CA--C 1.532 0.28 0 CA-C-N 115.28 -0.873 . . . . 0.0 111.082 172.959 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 149' ' ' CYS . . . . . . . . . . . . . 49.1 t -61.38 -33.12 73.13 Favored 'General case' 0 N--CA 1.448 -0.526 0 N-CA-C 109.415 -0.587 . . . . 0.0 109.415 178.081 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 150' ' ' PHE . . . . . 0.614 ' CE2' ' HE3' ' A' ' 121' ' ' LYS . 28.1 t80 -64.47 -30.42 71.46 Favored 'General case' 0 N--CA 1.452 -0.351 0 N-CA-C 110.214 -0.291 . . . . 0.0 110.214 -178.67 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 151' ' ' ALA . . . . . . . . . . . . . . . -76.52 -28.79 56.5 Favored 'General case' 0 N--CA 1.454 -0.23 0 N-CA-C 110.293 -0.262 . . . . 0.0 110.293 177.576 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 152' ' ' MET . . . . . . . . . . . . . 87.9 mtp -77.09 -29.43 54.92 Favored 'General case' 0 CA--C 1.53 0.188 0 N-CA-C 110.721 -0.103 . . . . 0.0 110.721 173.845 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 153' ' ' ASP . . . . . . . . . . . . . 79.2 m-20 -75.68 -44.39 42.54 Favored 'General case' 0 N--CA 1.453 -0.277 0 C-N-CA 123.76 0.824 . . . . 0.0 112.462 -179.239 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 154' ' ' LEU . . . . . . . . . . . . . 50.8 mt -141.74 169.5 17.47 Favored 'General case' 0 C--N 1.339 0.133 0 C-N-CA 123.079 0.552 . . . . 0.0 111.5 -175.888 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 155' ' ' GLU . . . . . . . . . . . . . 39.5 mp0 -66.26 -12.03 53.85 Favored 'General case' 0 N--CA 1.455 -0.198 0 C-N-CA 123.609 0.764 . . . . 0.0 110.567 176.759 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 156' ' ' HIS . . . . . . . . . . . . . 49.2 m80 -72.86 73.41 1.12 Allowed 'General case' 0 N--CA 1.452 -0.331 0 C-N-CA 123.682 0.793 . . . . 0.0 109.045 174.7 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 157' ' ' HIS . . . . . . . . . . . . . 57.7 m170 -65.55 -1.67 2.8 Favored 'General case' 0 N--CA 1.453 -0.296 0 N-CA-C 113.05 0.759 . . . . 0.0 113.05 -178.448 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 158' ' ' HIS . . . . . . . . . . . . . 97.0 m-70 -140.66 167.52 21.97 Favored 'General case' 0 N--CA 1.455 -0.183 0 C-N-CA 123.282 0.633 . . . . 0.0 110.013 -179.525 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 159' ' ' HIS . . . . . . . . . . . . . 44.9 m170 . . . . . 0 C--O 1.249 1.053 0 CA-C-O 117.751 -1.119 . . . . 0.0 110.591 -178.94 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' B' B 2052 ' ' ASP . . . . . . . . . . . . . 14.4 p-10 . . . . . 0 N--CA 1.471 0.585 0 N-CA-C 109.995 -0.372 . . . . 0.0 109.995 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' B' B 2053 ' ' ASP . . . . . . . . . . . . . 47.2 m-20 -77.61 140.99 39.73 Favored 'General case' 0 N--CA 1.452 -0.329 0 CA-C-O 121.093 0.473 . . . . 0.0 112.132 -174.742 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B 2054 ' ' ASP . . . . . . . . . . . . . 41.6 t0 -165.97 -160.2 0.43 Allowed 'General case' 0 CA--C 1.535 0.38 0 C-N-CA 125.397 1.479 . . . . 0.0 107.178 -178.283 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B 2055 ' ' GLU . . . . . . . . . . . . . 61.7 tt0 -43.77 136.15 3.63 Favored 'General case' 0 C--N 1.34 0.163 0 C-N-CA 123.546 0.739 . . . . 0.0 109.68 173.959 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B 2056 ' ' ASP . . . . . . . . . . . . . 55.6 t0 -105.08 -115.41 0.24 Allowed 'General case' 0 CA--C 1.532 0.268 0 C-N-CA 123.153 0.581 . . . . 0.0 111.73 -174.26 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B 2057 ' ' ASP . . . . . . . . . . . . . 33.0 t0 -60.03 98.68 0.06 Allowed 'General case' 0 N--CA 1.454 -0.236 0 C-N-CA 124.03 0.932 . . . . 0.0 112.149 -171.084 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B 2058 ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -75.82 145.77 40.41 Favored 'General case' 0 N--CA 1.453 -0.305 0 C-N-CA 122.92 0.488 . . . . 0.0 109.847 177.688 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B 2059 ' ' THR . . . . . . . . . . . . . 54.0 m -85.72 116.14 64.45 Favored Pre-proline 0 N--CA 1.455 -0.204 0 N-CA-C 109.61 -0.515 . . . . 0.0 109.61 179.006 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B 2060 ' ' PRO . . . . . . . . . . . . . 47.8 Cg_endo -77.73 62.03 7.7 Favored 'Trans proline' 0 N--CA 1.45 -1.038 0 C-N-CA 123.859 3.039 . . . . 0.0 110.201 179.573 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B 2061 ' ' SER . . . . . . . . . . . . . 88.2 p -62.31 143.46 56.9 Favored 'General case' 0 N--CA 1.455 -0.219 0 CA-C-O 121.021 0.438 . . . . 0.0 111.059 -177.865 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B 2062 ' ' ILE . . . . . . . . . . . . . 16.7 tt -164.63 155.93 1.82 Allowed 'Isoleucine or valine' 0 N--CA 1.453 -0.319 0 C-N-CA 123.747 0.819 . . . . 0.0 109.748 -179.378 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B 2063 ' ' SER . . . . . . . . . . . . . 82.5 p . . . . . 0 C--O 1.248 0.988 0 CA-C-O 117.097 -1.43 . . . . 0.0 109.632 174.865 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 63.2 ttp . . . . . 0 N--CA 1.474 0.743 0 N-CA-C 109.969 -0.382 . . . . 0.0 109.969 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 27.2 tp60 -153.7 135.98 14.91 Favored 'General case' 0 N--CA 1.451 -0.379 0 CA-C-O 120.973 0.415 . . . . 0.0 110.539 -179.929 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 35.6 tp60 -164.38 128.26 2.57 Favored 'General case' 0 N--CA 1.455 -0.184 0 N-CA-C 108.056 -1.09 . . . . 0.0 108.056 173.99 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' ASP . . . . . 0.425 ' C ' ' H ' ' A' ' 6' ' ' ASP . 47.7 t0 -162.37 -174.23 3.94 Favored 'General case' 0 N--CA 1.453 -0.309 0 N-CA-C 108.238 -1.023 . . . . 0.0 108.238 -177.798 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 42.3 m-20 -74.38 15.83 0.31 Allowed 'General case' 0 N--CA 1.454 -0.264 0 O-C-N 121.974 -0.454 . . . . 0.0 110.922 171.711 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' ASP . . . . . 0.425 ' H ' ' C ' ' A' ' 4' ' ' ASP . 36.2 p-10 -73.8 -28.06 61.44 Favored 'General case' 0 N--CA 1.453 -0.283 0 N-CA-C 108.788 -0.819 . . . . 0.0 108.788 179.328 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' PHE . . . . . 0.522 ' CE1' ' HD3' ' A' ' 45' ' ' LYS . 1.6 t80 -51.12 -37.31 45.3 Favored 'General case' 0 N--CA 1.448 -0.54 0 C-N-CA 124.375 1.07 . . . . 0.0 110.71 177.36 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 51.1 tp60 -53.64 -34.64 59.26 Favored 'General case' 0 N--CA 1.454 -0.268 0 C-N-CA 123.281 0.632 . . . . 0.0 111.579 -178.515 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 32.0 m-80 -72.49 -31.46 65.39 Favored 'General case' 0 N--CA 1.448 -0.528 0 N-CA-C 109.992 -0.373 . . . . 0.0 109.992 -179.587 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' PHE . . . . . 0.452 ' CE2' ' HB2' ' A' ' 32' ' ' LEU . 13.0 t80 -69.44 -40.94 76.89 Favored 'General case' 0 N--CA 1.449 -0.519 0 N-CA-C 108.986 -0.746 . . . . 0.0 108.986 175.412 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 62.6 t -64.35 -53.62 40.86 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.23 0 N-CA-C 108.657 -0.868 . . . . 0.0 108.657 179.467 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -59.84 -26.88 66.17 Favored 'General case' 0 N--CA 1.453 -0.279 0 C-N-CA 122.597 0.359 . . . . 0.0 111.808 179.534 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 91.2 m -74.25 -39.46 63.02 Favored 'General case' 0 CA--C 1.529 0.166 0 N-CA-C 109.077 -0.712 . . . . 0.0 109.077 176.703 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.495 ' HA ' ' CD1' ' A' ' 17' ' ' PHE . 10.9 tp -64.42 -45.31 88.09 Favored 'General case' 0 N--CA 1.452 -0.367 0 CA-C-O 121.374 0.607 . . . . 0.0 109.371 177.402 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 68.6 mm-40 -63.85 -28.28 69.74 Favored 'General case' 0 N--CA 1.453 -0.312 0 C-N-CA 124.069 0.948 . . . . 0.0 110.005 178.393 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 74.5 m -70.62 -28.19 64.66 Favored 'General case' 0 N--CA 1.453 -0.325 0 N-CA-C 109.616 -0.513 . . . . 0.0 109.616 177.281 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' PHE . . . . . 0.515 ' CE1' HD11 ' A' ' 68' ' ' ILE . 16.6 m-85 -69.74 -40.94 75.87 Favored 'General case' 0 N--CA 1.454 -0.243 0 C-N-CA 119.648 -0.821 . . . . 0.0 110.267 171.554 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 81.0 mttt -61.96 -28.51 69.6 Favored 'General case' 0 C--N 1.34 0.18 0 CA-C-O 120.617 0.246 . . . . 0.0 110.691 -178.575 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 46.3 t0 -71.42 -27.12 63.07 Favored 'General case' 0 CA--C 1.532 0.281 0 CA-C-N 115.826 -0.625 . . . . 0.0 112.192 -179.407 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 97.4 mt -74.02 152.92 39.89 Favored 'General case' 0 N--CA 1.455 -0.176 0 O-C-N 122.055 -0.403 . . . . 0.0 110.78 -177.563 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . 0.47 ' HE3' ' CA ' ' A' ' 21' ' ' LYS . 0.0 OUTLIER -77.13 -30.89 55.35 Favored 'General case' 0 C--N 1.339 0.135 0 N-CA-C 110.261 -0.274 . . . . 0.0 110.261 176.3 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 99.0 p -88.33 -22.47 23.82 Favored 'General case' 0 N--CA 1.457 -0.114 0 C-N-CA 122.983 0.513 . . . . 0.0 110.931 179.568 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 73.08 -22.04 0.98 Allowed Glycine 0 CA--C 1.527 0.801 0 C-N-CA 123.532 0.586 . . . . 0.0 112.752 178.919 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . 0.409 HD11 HD12 ' A' ' 63' ' ' LEU . 53.5 mt -78.93 149.38 5.57 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.212 0 N-CA-C 108.775 -0.824 . . . . 0.0 108.775 172.137 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 47.7 t -157.61 83.0 0.89 Allowed 'General case' 0 CA--C 1.517 -0.311 0 N-CA-C 110.146 -0.316 . . . . 0.0 110.146 177.355 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . 0.505 ' O ' ' HE2' ' A' ' 30' ' ' LYS . . . -48.58 -33.85 13.03 Favored Glycine 0 CA--C 1.526 0.741 0 N-CA-C 110.826 -0.91 . . . . 0.0 110.826 -178.89 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 4.7 t -67.76 -61.59 1.81 Allowed 'General case' 0 N--CA 1.452 -0.347 0 CA-C-N 117.407 0.604 . . . . 0.0 111.331 -178.084 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -72.68 -25.85 61.4 Favored 'General case' 0 N--CA 1.454 -0.256 0 CA-C-O 119.424 -0.322 . . . . 0.0 110.749 -175.615 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 56.7 mt -61.12 -46.51 96.49 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.332 0 N-CA-C 108.292 -1.003 . . . . 0.0 108.292 173.713 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . 0.505 ' HE2' ' O ' ' A' ' 26' ' ' GLY . 51.2 mtmt -64.74 -31.16 72.26 Favored 'General case' 0 C--N 1.34 0.154 0 CA-C-N 118.155 0.434 . . . . 0.0 111.258 178.268 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . 0.486 ' HA ' ' HE2' ' A' ' 31' ' ' LYS . 6.2 mmpt? -63.85 -59.93 3.92 Favored 'General case' 0 C--N 1.338 0.098 0 CA-C-O 119.215 -0.421 . . . . 0.0 111.61 -178.811 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.458 HD12 ' N ' ' A' ' 33' ' ' THR . 1.2 pp -75.51 -16.71 60.26 Favored 'General case' 0 CA--C 1.534 0.343 0 C-N-CA 119.539 -0.865 . . . . 0.0 111.942 -178.182 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . 0.458 ' N ' HD12 ' A' ' 32' ' ' LEU . 43.5 m -72.47 -38.36 68.23 Favored 'General case' 0 C--N 1.341 0.216 0 N-CA-C 108.656 -0.868 . . . . 0.0 108.656 174.58 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 80.4 m -70.03 -36.5 75.1 Favored 'General case' 0 N--CA 1.452 -0.371 0 N-CA-C 110.168 -0.308 . . . . 0.0 110.168 179.575 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 31.5 t80 -64.8 -36.11 83.26 Favored 'General case' 0 N--CA 1.456 -0.154 0 N-CA-C 109.791 -0.448 . . . . 0.0 109.791 176.045 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -71.36 -35.46 71.12 Favored 'General case' 0 N--CA 1.45 -0.451 0 CA-C-O 119.648 -0.215 . . . . 0.0 111.422 179.253 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 2.3 mm? -69.56 -32.37 71.12 Favored 'General case' 0 N--CA 1.455 -0.182 0 CA-C-O 119.74 -0.172 . . . . 0.0 110.578 179.858 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 40.2 t0 -69.44 -22.87 63.62 Favored 'General case' 0 N--CA 1.454 -0.246 0 O-C-N 122.9 0.125 . . . . 0.0 110.745 176.283 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 77.8 m80 -150.65 101.8 2.96 Favored 'General case' 0 N--CA 1.453 -0.305 0 N-CA-C 112.583 0.586 . . . . 0.0 112.583 -174.931 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 40' ' ' ILE . . . . . 0.606 ' H ' HD13 ' A' ' 40' ' ' ILE . 0.0 OUTLIER -74.56 -9.54 12.96 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.247 0 N-CA-C 109.701 -0.481 . . . . 0.0 109.701 170.865 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 34.0 m-20 -56.72 -17.64 9.69 Favored 'General case' 0 N--CA 1.457 -0.08 0 C-N-CA 124.3 1.04 . . . . 0.0 112.541 -178.92 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -120.08 17.96 6.37 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.267 0 C-N-CA 123.825 0.85 . . . . 0.0 111.461 -178.435 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 2.9 pp20? -52.64 -32.88 44.18 Favored 'General case' 0 CA--C 1.532 0.254 0 O-C-N 121.823 -0.548 . . . . 0.0 111.103 178.159 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 40.3 t -61.16 -46.66 89.6 Favored 'General case' 0 CA--C 1.531 0.242 0 N-CA-C 112.318 0.488 . . . . 0.0 112.318 -178.958 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . 0.522 ' HD3' ' CE1' ' A' ' 7' ' ' PHE . 19.1 ptpt -73.84 -24.13 59.73 Favored 'General case' 0 C--N 1.343 0.299 0 O-C-N 121.577 -0.702 . . . . 0.0 110.153 179.897 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 64.1 mt -71.65 -48.98 49.22 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.278 0 N-CA-C 109.733 -0.469 . . . . 0.0 109.733 -179.676 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 47' ' ' ILE . . . . . 0.455 HD13 HD11 ' A' ' 50' ' ' ILE . 39.4 mm -63.76 -35.93 74.8 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.237 0 N-CA-C 109.626 -0.509 . . . . 0.0 109.626 178.28 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 40.3 t -63.78 -43.48 96.24 Favored 'General case' 0 N--CA 1.455 -0.18 0 O-C-N 122.263 -0.273 . . . . 0.0 111.626 -178.985 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 33.3 mt -75.43 -33.22 60.89 Favored 'General case' 0 N--CA 1.449 -0.498 0 N-CA-C 113.23 0.826 . . . . 0.0 113.23 -176.286 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . 0.455 HD11 HD13 ' A' ' 47' ' ' ILE . 5.1 pt -72.65 -43.97 61.03 Favored 'Isoleucine or valine' 0 C--O 1.23 0.075 0 CA-C-N 119.284 0.947 . . . . 0.0 110.787 179.702 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 21.3 pt -62.21 -40.29 87.13 Favored 'Isoleucine or valine' 0 C--N 1.339 0.145 0 C-N-CA 119.628 -0.829 . . . . 0.0 109.962 178.366 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 94.0 m-20 -70.8 -33.62 70.91 Favored 'General case' 0 N--CA 1.455 -0.18 0 CA-C-N 118.061 0.392 . . . . 0.0 111.78 177.787 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 53' ' ' TYR . . . . . 0.455 ' CD2' ' HB2' ' A' ' 65' ' ' SER . 20.8 t80 -67.67 -34.26 76.57 Favored 'General case' 0 N--CA 1.454 -0.248 0 CA-C-N 118.535 0.607 . . . . 0.0 109.667 177.017 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 35.6 t -81.76 -18.26 44.84 Favored 'General case' 0 C--N 1.338 0.075 0 N-CA-C 111.882 0.327 . . . . 0.0 111.882 178.011 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 32.0 ttp180 -93.89 -42.86 8.86 Favored 'General case' 0 N--CA 1.453 -0.314 0 N-CA-C 112.797 0.666 . . . . 0.0 112.797 -178.19 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 41.8 mt -86.3 -49.37 7.72 Favored 'General case' 0 C--N 1.338 0.093 0 N-CA-C 113.407 0.892 . . . . 0.0 113.407 -175.222 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 57' ' ' CYS . . . . . 0.41 ' HB3' ' CD ' ' A' ' 58' ' ' PRO . 84.2 m -72.34 166.72 39.01 Favored Pre-proline 0 CA--C 1.533 0.326 0 N-CA-C 113.248 0.832 . . . . 0.0 113.248 -170.996 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 58' ' ' PRO . . . . . 0.41 ' CD ' ' HB3' ' A' ' 57' ' ' CYS . 35.6 Cg_exo -61.38 166.46 11.22 Favored 'Trans proline' 0 N--CA 1.453 -0.909 1 C-N-CA 125.816 4.344 . . . . 0.0 113.404 -175.178 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 31.8 p-10 -53.86 -44.66 70.56 Favored 'General case' 0 C--N 1.329 -0.314 0 C-N-CA 125.146 1.378 . . . . 0.0 113.618 -171.328 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 9.3 t -71.73 -29.13 64.19 Favored 'General case' 0 N--CA 1.452 -0.354 0 O-C-N 122.049 -0.407 . . . . 0.0 110.151 -179.623 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 52.8 m80 -75.82 -29.47 58.68 Favored 'General case' 0 N--CA 1.452 -0.361 0 C-N-CA 122.692 0.397 . . . . 0.0 109.965 176.104 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 59.1 mttm -61.93 -41.81 98.38 Favored 'General case' 0 C--N 1.341 0.197 0 N-CA-C 109.559 -0.534 . . . . 0.0 109.559 173.164 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . 0.466 HD23 HG13 ' A' ' 124' ' ' ILE . 3.0 tm? -63.03 -45.5 92.0 Favored 'General case' 0 N--CA 1.455 -0.222 0 N-CA-C 109.024 -0.732 . . . . 0.0 109.024 177.227 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -61.53 -27.17 67.55 Favored Glycine 0 C--N 1.339 0.729 0 N-CA-C 112.108 -0.397 . . . . 0.0 112.108 -178.95 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 65' ' ' SER . . . . . 0.455 ' HB2' ' CD2' ' A' ' 53' ' ' TYR . 30.1 t -74.66 -39.02 62.29 Favored 'General case' 0 N--CA 1.451 -0.397 0 CA-C-N 117.694 0.747 . . . . 0.0 110.561 176.795 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 82.9 mt -66.21 -23.49 66.44 Favored 'General case' 0 N--CA 1.452 -0.365 0 N-CA-C 109.721 -0.474 . . . . 0.0 109.721 177.546 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 2.3 m-30 -73.69 -39.33 64.44 Favored 'General case' 0 C--O 1.233 0.226 0 C-N-CA 122.397 0.279 . . . . 0.0 110.428 173.926 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 68' ' ' ILE . . . . . 0.515 HD11 ' CE1' ' A' ' 17' ' ' PHE . 31.5 mt -64.88 -51.19 70.0 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.543 0 N-CA-C 107.51 -1.293 . . . . 0.0 107.51 177.055 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 69' ' ' ILE . . . . . 0.451 HG12 HD12 ' A' ' 50' ' ' ILE . 43.5 mt -50.26 -36.84 13.45 Favored 'Isoleucine or valine' 0 CA--C 1.528 0.133 0 C-N-CA 124.21 1.004 . . . . 0.0 111.778 174.828 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 16.6 t70 -69.87 -53.86 16.1 Favored 'General case' 0 N--CA 1.455 -0.193 0 CA-C-N 118.774 0.715 . . . . 0.0 111.116 180.0 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 79.2 p -67.89 -46.72 70.83 Favored 'General case' 0 N--CA 1.451 -0.42 0 CA-C-N 116.717 -0.22 . . . . 0.0 110.772 -174.96 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -74.84 -35.03 35.1 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.133 0 N-CA-C 109.359 -0.608 . . . . 0.0 109.359 -179.172 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -65.82 -50.76 51.41 Favored Glycine 0 C--N 1.339 0.724 0 N-CA-C 111.58 -0.608 . . . . 0.0 111.58 -175.836 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 41.7 mtm105 -69.73 -38.56 76.91 Favored 'General case' 0 N--CA 1.451 -0.4 0 CA-C-N 117.267 0.533 . . . . 0.0 110.227 179.061 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -66.57 -32.68 74.17 Favored 'General case' 0 N--CA 1.451 -0.391 0 C-N-CA 120.714 -0.395 . . . . 0.0 110.743 -179.101 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 1.0 OUTLIER -68.72 -43.52 75.79 Favored 'General case' 0 CA--C 1.518 -0.28 0 CA-C-N 118.527 0.603 . . . . 0.0 110.297 176.091 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . 0.427 HD13 ' C ' ' A' ' 77' ' ' LEU . 3.0 tm? -64.89 -47.72 76.81 Favored 'General case' 0 N--CA 1.448 -0.534 0 C-N-CA 118.359 -1.336 . . . . 0.0 108.049 178.978 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 46.9 m-20 -58.25 -43.65 87.95 Favored 'General case' 0 C--O 1.23 0.065 0 N-CA-C 112.38 0.511 . . . . 0.0 112.38 -178.063 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 10.4 tm-20 -63.96 -45.06 90.78 Favored 'General case' 0 N--CA 1.447 -0.583 0 CA-C-N 118.186 0.448 . . . . 0.0 110.623 -177.81 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 61.2 p -69.8 -37.62 76.37 Favored 'General case' 0 N--CA 1.453 -0.321 0 CA-C-O 118.927 -0.559 . . . . 0.0 111.1 -177.136 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 7.4 ppt_? -75.85 -16.55 60.05 Favored 'General case' 0 C--N 1.341 0.211 0 CA-C-N 118.823 0.738 . . . . 0.0 111.627 178.05 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 36.9 m -90.72 -36.63 14.21 Favored 'General case' 0 N--CA 1.456 -0.145 0 N-CA-C 112.353 0.501 . . . . 0.0 112.353 179.132 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 66.9 m-20 -119.86 26.14 9.51 Favored 'General case' 0 CA--C 1.52 -0.19 0 N-CA-C 112.954 0.724 . . . . 0.0 112.954 -174.985 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 26.0 t 58.33 15.51 3.48 Favored 'General case' 0 N--CA 1.447 -0.576 0 N-CA-C 114.314 1.227 . . . . 0.0 114.314 173.722 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 80.5 m-20 -76.45 14.11 0.83 Allowed 'General case' 0 CA--C 1.532 0.278 0 CA-C-N 118.413 0.551 . . . . 0.0 111.135 177.887 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 79.2 p -71.7 162.1 29.97 Favored 'General case' 0 N--CA 1.453 -0.32 0 C-N-CA 123.431 0.692 . . . . 0.0 110.822 178.38 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 47.1 t -156.61 -178.96 7.73 Favored 'General case' 0 N--CA 1.452 -0.367 0 C-N-CA 123.145 0.578 . . . . 0.0 109.465 -179.349 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 96.9 p -138.78 8.68 2.58 Favored 'General case' 0 N--CA 1.455 -0.222 0 C-N-CA 123.264 0.625 . . . . 0.0 109.945 175.691 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 9.2 t-20 -161.2 159.2 28.53 Favored 'General case' 0 CA--C 1.531 0.238 0 C-N-CA 122.767 0.427 . . . . 0.0 110.269 -178.525 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 60.0 mttp 63.12 150.51 0.11 Allowed Pre-proline 0 CA--C 1.534 0.353 0 C-N-CA 126.028 1.731 . . . . 0.0 114.182 178.834 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_endo -69.09 170.03 16.71 Favored 'Trans proline' 0 N--CA 1.453 -0.875 0 C-N-CA 124.425 3.417 . . . . 0.0 110.384 175.71 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 96.04 17.29 35.41 Favored Glycine 0 CA--C 1.523 0.586 0 CA-C-O 119.363 -0.687 . . . . 0.0 112.908 177.071 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 35.2 p -151.77 169.24 22.7 Favored 'General case' 0 CA--C 1.518 -0.266 0 C-N-CA 123.907 0.883 . . . . 0.0 109.227 175.974 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 94' ' ' CYS . . . . . 0.432 ' HA ' ' HB3' ' A' ' 97' ' ' ALA . 1.8 p -67.16 -16.95 64.63 Favored 'General case' 0 N--CA 1.447 -0.612 0 N-CA-C 109.692 -0.485 . . . . 0.0 109.692 178.599 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -62.91 -57.24 11.46 Favored 'General case' 0 N--CA 1.449 -0.5 0 N-CA-C 109.833 -0.432 . . . . 0.0 109.833 -177.104 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 72.9 t60 -72.39 -31.25 65.4 Favored 'General case' 0 N--CA 1.451 -0.408 0 N-CA-C 110.208 -0.293 . . . . 0.0 110.208 179.243 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 97' ' ' ALA . . . . . 0.432 ' HB3' ' HA ' ' A' ' 94' ' ' CYS . . . -65.67 -56.56 11.5 Favored 'General case' 0 N--CA 1.451 -0.417 0 O-C-N 123.274 0.359 . . . . 0.0 111.517 -178.32 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 2.1 mp -67.72 -34.62 68.95 Favored 'Isoleucine or valine' 0 C--N 1.34 0.195 0 C-N-CA 120.494 -0.483 . . . . 0.0 110.456 -179.13 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 69.2 m-20 -66.71 -45.1 79.82 Favored 'General case' 0 N--CA 1.45 -0.448 0 CA-C-N 118.157 0.435 . . . . 0.0 111.509 179.534 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 98.3 m -69.12 -29.62 67.72 Favored 'General case' 0 C--N 1.338 0.088 0 CA-C-N 117.976 0.353 . . . . 0.0 110.455 -177.227 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 62.2 tp -74.11 -33.98 63.77 Favored 'General case' 0 N--CA 1.447 -0.607 0 C-N-CA 122.758 0.423 . . . . 0.0 110.431 179.558 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -67.59 -17.4 68.86 Favored Glycine 0 CA--C 1.526 0.774 0 CA-C-O 119.636 -0.536 . . . . 0.0 112.845 -177.232 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 25.5 mt-10 -79.5 -25.93 41.7 Favored 'General case' 0 C--N 1.338 0.096 0 CA-C-N 118.004 0.902 . . . . 0.0 111.316 -179.696 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 25.3 m -116.92 -6.67 11.91 Favored 'Isoleucine or valine' 0 C--O 1.23 0.061 0 N-CA-C 112.924 0.713 . . . . 0.0 112.924 -174.687 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 105' ' ' ILE . . . . . . . . . . . . . 17.5 tt -60.09 -23.07 26.17 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.25 0 CA-C-N 118.979 0.809 . . . . 0.0 111.635 -179.694 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 106' ' ' GLN . . . . . 0.4 ' HA ' HD11 ' A' ' 145' ' ' ILE . 25.7 pt20 -61.6 -35.0 76.62 Favored 'General case' 0 N--CA 1.45 -0.447 0 C-N-CA 122.867 0.467 . . . . 0.0 110.19 175.906 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 49.2 mt-10 -71.95 -40.88 68.39 Favored 'General case' 0 N--CA 1.454 -0.232 0 N-CA-C 109.454 -0.573 . . . . 0.0 109.454 -179.828 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 20.2 mt -73.0 -40.87 64.84 Favored 'General case' 0 N--CA 1.449 -0.512 0 CA-C-N 115.899 -0.592 . . . . 0.0 110.706 -173.283 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 84.7 mt -68.56 -63.17 1.11 Allowed 'General case' 0 N--CA 1.448 -0.539 0 N-CA-C 109.626 -0.509 . . . . 0.0 109.626 178.517 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 24.4 p -46.0 -48.37 16.63 Favored 'General case' 0 CA--C 1.52 -0.183 0 C-N-CA 122.613 0.365 . . . . 0.0 111.976 -177.329 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 39.3 t0 -70.66 -35.99 73.14 Favored 'General case' 0 N--CA 1.447 -0.579 0 CA-C-N 116.882 -0.144 . . . . 0.0 110.977 -176.148 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -72.88 -31.54 64.77 Favored 'General case' 0 N--CA 1.448 -0.528 0 C-N-CA 120.882 -0.327 . . . . 0.0 110.735 -178.487 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 113' ' ' ILE . . . . . . . . . . . . . 45.4 mm -68.33 -40.86 83.12 Favored 'Isoleucine or valine' 0 C--N 1.339 0.111 0 N-CA-C 108.892 -0.781 . . . . 0.0 108.892 176.316 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -72.78 -38.3 67.33 Favored 'General case' 0 N--CA 1.45 -0.441 0 CA-C-N 115.697 -0.683 . . . . 0.0 111.926 -177.562 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -90.46 -33.53 15.95 Favored 'General case' 0 N--CA 1.453 -0.283 0 N-CA-C 113.844 1.053 . . . . 0.0 113.844 -174.968 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 116' ' ' SER . . . . . 0.525 ' O ' ' HE3' ' A' ' 121' ' ' LYS . 1.0 OUTLIER -89.4 160.47 16.8 Favored 'General case' 0 C--N 1.339 0.111 0 N-CA-C 113.45 0.907 . . . . 0.0 113.45 -167.886 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 46.4 t30 -75.51 169.69 17.6 Favored 'General case' 0 C--O 1.226 -0.164 0 C-N-CA 123.983 0.913 . . . . 0.0 111.872 -173.941 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 118' ' ' GLN . . . . . . . . . . . . . 14.8 mm100 -54.37 -37.23 64.74 Favored 'General case' 0 C--N 1.338 0.094 0 C-N-CA 124.03 0.932 . . . . 0.0 112.954 -173.456 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 16.7 p-10 -69.28 -43.3 74.16 Favored 'General case' 0 N--CA 1.453 -0.301 0 N-CA-C 109.393 -0.595 . . . . 0.0 109.393 179.401 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 78.8 m-70 -69.22 -36.12 76.9 Favored 'General case' 0 N--CA 1.45 -0.444 0 CA-C-O 119.311 -0.376 . . . . 0.0 110.939 177.949 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 121' ' ' LYS . . . . . 0.525 ' HE3' ' O ' ' A' ' 116' ' ' SER . 89.8 mttt -58.49 -40.91 84.08 Favored 'General case' 0 C--O 1.231 0.129 0 N-CA-C 108.793 -0.817 . . . . 0.0 108.793 176.063 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 38.3 tp10 -73.99 -35.13 64.41 Favored 'General case' 0 N--CA 1.451 -0.378 0 C-N-CA 122.32 0.248 . . . . 0.0 110.93 179.849 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 84.9 mttt -63.95 -37.65 88.2 Favored 'General case' 0 N--CA 1.453 -0.296 0 N-CA-C 109.546 -0.538 . . . . 0.0 109.546 177.572 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 124' ' ' ILE . . . . . 0.466 HG13 HD23 ' A' ' 63' ' ' LEU . 56.4 mt -66.05 -38.92 83.11 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.182 0 N-CA-C 110.032 -0.359 . . . . 0.0 110.032 174.737 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 17.5 mtp180 -66.43 -42.31 87.91 Favored 'General case' 0 C--N 1.34 0.158 0 C-N-CA 122.404 0.282 . . . . 0.0 111.398 -177.356 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 126' ' ' MET . . . . . . . . . . . . . 17.8 ptp -68.42 -31.55 70.96 Favored 'General case' 0 N--CA 1.452 -0.325 0 C-N-CA 119.613 -0.835 . . . . 0.0 109.424 176.482 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 2.2 mp -63.25 -35.39 80.18 Favored 'General case' 0 N--CA 1.454 -0.267 0 N-CA-C 109.695 -0.483 . . . . 0.0 109.695 177.245 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 99.2 mt -68.34 -38.15 81.22 Favored 'General case' 0 N--CA 1.454 -0.256 0 CA-C-N 118.471 0.578 . . . . 0.0 110.049 177.687 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 14.9 t0 -65.49 -45.63 82.84 Favored 'General case' 0 CA--C 1.531 0.212 0 CA-C-N 118.055 0.389 . . . . 0.0 110.052 175.567 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 130' ' ' ILE . . . . . 0.406 ' HA ' ' HD3' ' A' ' 133' ' ' ARG . 51.5 mt -61.11 -34.11 58.86 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.296 0 C-N-CA 123.031 0.532 . . . . 0.0 110.202 -178.721 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 131' ' ' TRP . . . . . . . . . . . . . 50.5 m0 -79.45 -25.8 41.89 Favored 'General case' 0 N--CA 1.452 -0.371 0 N-CA-C 112.928 0.714 . . . . 0.0 112.928 179.271 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 76.8 m-20 -76.81 -27.82 55.33 Favored 'General case' 0 CA--C 1.526 0.048 0 CA-C-N 118.882 0.764 . . . . 0.0 111.329 175.113 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 133' ' ' ARG . . . . . 0.451 HH21 ' C ' ' B' 2063 ' ' SER . 14.7 mtp180 -73.69 -42.99 60.53 Favored 'General case' 0 N--CA 1.455 -0.191 0 C-N-CA 122.798 0.439 . . . . 0.0 110.069 176.952 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 31.6 p -79.86 -14.88 58.33 Favored 'General case' 0 CA--C 1.531 0.25 0 C-N-CA 123.239 0.615 . . . . 0.0 111.033 176.844 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 135' ' ' GLY . . . . . . . . . . . . . . . 76.64 -68.64 2.45 Favored Glycine 0 CA--C 1.526 0.761 0 C-N-CA 124.036 0.827 . . . . 0.0 113.047 174.709 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 136' ' ' LEU . . . . . . . . . . . . . 10.7 mp 56.56 8.66 0.47 Allowed 'General case' 0 CA--C 1.536 0.407 0 C-N-CA 124.914 1.286 . . . . 0.0 113.164 -175.092 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 137' ' ' PHE . . . . . . . . . . . . . 66.4 m-85 53.91 16.99 1.2 Allowed 'General case' 0 CA--C 1.533 0.294 0 N-CA-C 114.622 1.342 . . . . 0.0 114.622 175.887 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 138' ' ' GLN . . . . . . . . . . . . . 39.1 mm-40 -140.89 145.54 36.27 Favored 'General case' 0 N--CA 1.457 -0.091 0 C-N-CA 122.972 0.509 . . . . 0.0 109.7 177.624 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 139' ' ' LYS . . . . . 0.428 ' HA ' ' HD3' ' A' ' 139' ' ' LYS . 53.2 mmtt -145.96 162.16 38.45 Favored 'General case' 0 C--N 1.339 0.131 0 C-N-CA 123.558 0.743 . . . . 0.0 110.118 -178.133 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 140' ' ' SER . . . . . . . . . . . . . 47.1 t -150.66 34.56 0.62 Allowed 'General case' 0 N--CA 1.452 -0.339 0 CA-C-N 116.373 -0.376 . . . . 0.0 111.797 -174.971 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 141' ' ' TYR . . . . . . . . . . . . . 43.5 m-85 -71.61 44.73 0.1 Allowed 'General case' 0 CA--C 1.534 0.354 0 C-N-CA 123.345 0.658 . . . . 0.0 111.818 177.528 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 142' ' ' LEU . . . . . . . . . . . . . 75.7 mt -70.56 161.85 29.92 Favored 'General case' 0 N--CA 1.455 -0.22 0 C-N-CA 123.367 0.667 . . . . 0.0 109.764 176.796 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 72.3 m-20 -60.15 -20.89 60.57 Favored 'General case' 0 N--CA 1.455 -0.209 0 N-CA-C 112.137 0.421 . . . . 0.0 112.137 -176.976 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . -64.71 -34.62 78.74 Favored 'General case' 0 N--CA 1.451 -0.391 0 CA-C-N 117.724 0.238 . . . . 0.0 110.411 178.461 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 145' ' ' ILE . . . . . 0.4 HD11 ' HA ' ' A' ' 106' ' ' GLN . 23.4 mm -78.31 -32.78 17.03 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.159 0 CA-C-O 120.558 0.218 . . . . 0.0 110.622 177.114 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 146' ' ' ARG . . . . . 0.452 ' O ' ' HE2' ' A' ' 148' ' ' LYS . 85.6 mtt180 -75.63 -17.68 59.93 Favored 'General case' 0 CA--C 1.518 -0.282 0 CA-C-O 118.772 -0.632 . . . . 0.0 112.298 -176.671 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 147' ' ' SER . . . . . . . . . . . . . 39.0 t -70.64 61.76 0.25 Allowed 'General case' 0 N--CA 1.454 -0.228 0 CA-C-O 122.149 0.976 . . . . 0.0 111.249 177.264 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 148' ' ' LYS . . . . . 0.452 ' HE2' ' O ' ' A' ' 146' ' ' ARG . 0.0 OUTLIER -46.6 -15.8 0.03 OUTLIER 'General case' 0 CA--C 1.53 0.194 0 C-N-CA 126.067 1.747 . . . . 0.0 113.695 172.905 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 149' ' ' CYS . . . . . . . . . . . . . 61.0 m -58.93 -29.65 67.25 Favored 'General case' 0 N--CA 1.452 -0.326 0 CA-C-N 118.039 0.381 . . . . 0.0 111.403 -175.654 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 150' ' ' PHE . . . . . . . . . . . . . 9.7 m-85 -63.16 -30.96 72.0 Favored 'General case' 0 N--CA 1.455 -0.187 0 CA-C-N 118.215 0.461 . . . . 0.0 110.301 -179.506 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 151' ' ' ALA . . . . . . . . . . . . . . . -79.36 -42.51 25.45 Favored 'General case' 0 N--CA 1.448 -0.566 0 C-N-CA 122.429 0.292 . . . . 0.0 110.322 178.244 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 152' ' ' MET . . . . . . . . . . . . . 93.7 mtp -64.35 -29.94 71.0 Favored 'General case' 0 N--CA 1.456 -0.143 0 C-N-CA 122.993 0.517 . . . . 0.0 111.249 -176.71 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 153' ' ' ASP . . . . . . . . . . . . . 69.1 m-20 -75.71 -14.33 60.33 Favored 'General case' 0 N--CA 1.452 -0.353 0 C-N-CA 123.283 0.633 . . . . 0.0 111.765 176.653 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 154' ' ' LEU . . . . . . . . . . . . . 89.5 mt -130.94 40.34 3.49 Favored 'General case' 0 N--CA 1.455 -0.184 0 C-N-CA 123.648 0.779 . . . . 0.0 112.107 -172.57 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 155' ' ' GLU . . . . . . . . . . . . . 19.7 pt-20 -154.28 150.2 27.75 Favored 'General case' 0 N--CA 1.454 -0.227 0 CA-C-O 121.105 0.478 . . . . 0.0 111.611 177.405 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 156' ' ' HIS . . . . . . . . . . . . . 31.3 m80 -79.22 -14.45 59.06 Favored 'General case' 0 C--N 1.34 0.181 0 CA-C-N 115.882 -0.599 . . . . 0.0 111.835 -179.239 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 157' ' ' HIS . . . . . . . . . . . . . 86.0 t60 -156.54 142.16 17.71 Favored 'General case' 0 N--CA 1.455 -0.175 0 N-CA-C 109.66 -0.496 . . . . 0.0 109.66 179.587 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 158' ' ' HIS . . . . . . . . . . . . . 48.5 m170 -81.63 151.93 27.39 Favored 'General case' 0 CA--C 1.529 0.161 0 C-N-CA 122.667 0.387 . . . . 0.0 111.279 -176.59 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 159' ' ' HIS . . . . . . . . . . . . . 79.3 t60 . . . . . 0 C--O 1.251 1.167 0 CA-C-O 117.592 -1.194 . . . . 0.0 109.809 -177.463 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' B' B 2052 ' ' ASP . . . . . . . . . . . . . 2.4 m-20 . . . . . 0 N--CA 1.474 0.767 0 N-CA-C 110.144 -0.317 . . . . 0.0 110.144 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' B' B 2053 ' ' ASP . . . . . . . . . . . . . 5.2 m-20 -68.02 122.15 17.61 Favored 'General case' 0 N--CA 1.455 -0.223 0 CA-C-N 116.479 -0.328 . . . . 0.0 110.35 -176.95 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B 2054 ' ' ASP . . . . . . . . . . . . . 44.9 t0 -167.75 174.44 7.62 Favored 'General case' 0 CA--C 1.531 0.217 0 N-CA-C 108.719 -0.845 . . . . 0.0 108.719 -177.724 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B 2055 ' ' GLU . . . . . . . . . . . . . 54.1 mt-10 -70.5 -11.2 60.77 Favored 'General case' 0 CA--C 1.533 0.314 0 N-CA-C 109.459 -0.571 . . . . 0.0 109.459 173.408 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B 2056 ' ' ASP . . . . . . . . . . . . . 45.5 t0 50.6 -111.17 0.51 Allowed 'General case' 0 N--CA 1.455 -0.195 0 C-N-CA 125.488 1.515 . . . . 0.0 112.48 177.68 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B 2057 ' ' ASP . . . . . . . . . . . . . 22.2 t0 -63.18 170.43 2.89 Favored 'General case' 0 CA--C 1.534 0.348 0 C-N-CA 123.631 0.772 . . . . 0.0 112.756 -173.642 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B 2058 ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -143.47 153.6 42.8 Favored 'General case' 0 N--CA 1.456 -0.133 0 C-N-CA 124.342 1.057 . . . . 0.0 108.77 -178.969 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B 2059 ' ' THR . . . . . . . . . . . . . 38.7 m -137.9 119.6 10.72 Favored Pre-proline 0 N--CA 1.451 -0.415 0 N-CA-C 108.624 -0.88 . . . . 0.0 108.624 -179.115 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B 2060 ' ' PRO . . . . . . . . . . . . . 86.0 Cg_endo -75.06 169.19 23.13 Favored 'Trans proline' 0 N--CA 1.447 -1.253 0 C-N-CA 123.766 2.977 . . . . 0.0 111.131 -179.946 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B 2061 ' ' SER . . . . . . . . . . . . . 59.5 m -151.62 138.67 19.13 Favored 'General case' 0 N--CA 1.454 -0.258 0 N-CA-C 108.461 -0.94 . . . . 0.0 108.461 175.828 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B 2062 ' ' ILE . . . . . . . . . . . . . 16.7 tt -164.23 155.14 2.12 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.222 0 CA-C-N 116.642 -0.254 . . . . 0.0 110.424 -176.309 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B 2063 ' ' SER . . . . . 0.451 ' C ' HH21 ' A' ' 133' ' ' ARG . 81.3 p . . . . . 0 C--O 1.253 1.246 0 CA-C-O 117.488 -1.244 . . . . 0.0 109.65 174.17 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 70.4 mtm . . . . . 0 N--CA 1.472 0.643 0 N-CA-C 110.223 -0.288 . . . . 0.0 110.223 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -138.64 -167.46 2.2 Favored 'General case' 0 N--CA 1.456 -0.136 0 N-CA-C 109.166 -0.679 . . . . 0.0 109.166 179.872 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . 0.449 ' CD ' ' H ' ' A' ' 3' ' ' GLN . 4.1 pm0 -59.32 -20.2 52.61 Favored 'General case' 0 CA--C 1.536 0.421 0 N-CA-C 110.106 -0.331 . . . . 0.0 110.106 174.384 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 21.3 p30 -155.52 143.84 20.18 Favored 'General case' 0 N--CA 1.452 -0.364 0 C-N-CA 123.772 0.829 . . . . 0.0 108.923 172.855 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 51.1 m-20 -110.09 18.28 20.16 Favored 'General case' 0 N--CA 1.457 -0.114 0 N-CA-C 112.389 0.514 . . . . 0.0 112.389 -178.287 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 21.2 p-10 -70.39 -29.18 65.76 Favored 'General case' 0 C--N 1.331 -0.222 0 N-CA-C 108.032 -1.099 . . . . 0.0 108.032 175.863 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' PHE . . . . . 0.498 ' CD1' ' HD3' ' A' ' 45' ' ' LYS . 1.2 t80 -55.03 -30.47 59.62 Favored 'General case' 0 N--CA 1.445 -0.695 0 C-N-CA 126.09 1.756 . . . . 0.0 111.213 -178.02 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 52.1 tp60 -50.48 -36.51 33.97 Favored 'General case' 0 N--CA 1.455 -0.218 0 C-N-CA 124.125 0.97 . . . . 0.0 111.878 -177.679 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 33.8 m-80 -72.36 -36.36 68.75 Favored 'General case' 0 N--CA 1.454 -0.251 0 CA-C-N 117.939 0.336 . . . . 0.0 110.294 -179.195 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 1.9 t80 -70.84 -39.27 73.08 Favored 'General case' 0 N--CA 1.452 -0.336 0 C-N-CA 123.519 0.728 . . . . 0.0 109.044 178.008 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 76.6 t -66.59 -53.02 39.58 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.385 0 N-CA-C 108.776 -0.824 . . . . 0.0 108.776 179.446 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -60.07 -31.25 69.83 Favored 'General case' 0 N--CA 1.454 -0.267 0 C-N-CA 122.759 0.424 . . . . 0.0 111.839 -178.517 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 86.6 m -67.53 -43.78 79.95 Favored 'General case' 0 CA--C 1.531 0.241 0 N-CA-C 108.691 -0.855 . . . . 0.0 108.691 176.488 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.443 HD22 ' HG ' ' A' ' 49' ' ' LEU . 5.5 tp -69.36 -39.56 78.02 Favored 'General case' 0 N--CA 1.452 -0.356 0 CA-C-N 116.418 -0.355 . . . . 0.0 111.278 -179.559 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 69.4 mm-40 -62.73 -33.76 75.8 Favored 'General case' 0 N--CA 1.451 -0.421 0 C-N-CA 123.596 0.758 . . . . 0.0 109.206 178.226 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 49.5 m -66.21 -32.89 74.59 Favored 'General case' 0 N--CA 1.451 -0.412 0 N-CA-C 108.881 -0.785 . . . . 0.0 108.881 176.774 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' PHE . . . . . 0.467 ' CE2' ' HB3' ' A' ' 25' ' ' SER . 14.8 m-30 -69.83 -33.82 72.83 Favored 'General case' 0 C--N 1.339 0.126 0 N-CA-C 112.2 0.444 . . . . 0.0 112.2 174.904 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 70.5 mttt -64.54 -27.08 68.72 Favored 'General case' 0 C--N 1.339 0.134 0 N-CA-C 109.243 -0.651 . . . . 0.0 109.243 174.944 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 43.8 t0 -79.41 -22.24 44.54 Favored 'General case' 0 CA--C 1.535 0.368 0 CA-C-N 115.701 -0.681 . . . . 0.0 111.898 177.009 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 81.1 mt -72.65 148.54 44.69 Favored 'General case' 0 N--CA 1.457 -0.11 0 O-C-N 121.152 -0.968 . . . . 0.0 110.674 179.649 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 1.6 mppt? -86.73 20.31 2.6 Favored 'General case' 0 CA--C 1.534 0.351 0 CA-C-N 115.653 -0.703 . . . . 0.0 109.33 175.713 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 79.9 p -147.46 -32.51 0.29 Allowed 'General case' 0 CA--C 1.53 0.198 0 C-N-CA 123.953 0.901 . . . . 0.0 111.237 -176.803 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 80.07 -19.91 6.17 Favored Glycine 0 CA--C 1.527 0.841 0 CA-C-O 119.601 -0.555 . . . . 0.0 113.63 176.194 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 96.3 mt -89.86 145.88 6.86 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.128 0 CA-C-N 118.059 0.93 . . . . 0.0 109.549 176.188 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . 0.467 ' HB3' ' CE2' ' A' ' 17' ' ' PHE . 33.4 t -166.71 88.53 0.34 Allowed 'General case' 0 N--CA 1.455 -0.225 0 CA-C-N 117.679 0.218 . . . . 0.0 110.813 176.517 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -47.58 -56.55 8.27 Favored Glycine 0 CA--C 1.528 0.861 0 CA-C-O 119.111 -0.827 . . . . 0.0 114.623 -170.753 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . 0.588 ' HA ' ' HE3' ' A' ' 30' ' ' LYS . 38.9 m -63.55 -36.25 83.17 Favored 'General case' 0 CA--C 1.524 -0.027 0 CA-C-N 119.2 1.5 . . . . 0.0 112.026 -176.328 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -75.76 -37.54 59.17 Favored 'General case' 0 CA--C 1.529 0.172 0 N-CA-C 109.846 -0.427 . . . . 0.0 109.846 179.079 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 60.6 mt -58.03 -42.82 83.72 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.501 0 N-CA-C 108.237 -1.023 . . . . 0.0 108.237 172.163 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . 0.588 ' HE3' ' HA ' ' A' ' 27' ' ' SER . 45.2 mtmt -69.1 -23.36 63.99 Favored 'General case' 0 N--CA 1.454 -0.226 0 CA-C-O 118.846 -0.597 . . . . 0.0 111.497 178.777 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . 0.469 ' HA ' ' CE ' ' A' ' 31' ' ' LYS . 3.9 mmpt? -67.64 -51.59 48.18 Favored 'General case' 0 C--N 1.34 0.183 0 CA-C-N 118.904 0.775 . . . . 0.0 110.314 175.405 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 4.2 pp -75.0 -23.25 58.21 Favored 'General case' 0 CA--C 1.531 0.227 0 C-N-CA 119.943 -0.703 . . . . 0.0 110.671 179.431 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . 0.402 ' HB ' ' HA ' ' A' ' 30' ' ' LYS . 51.9 m -71.54 -39.34 70.76 Favored 'General case' 0 CA--C 1.523 -0.095 0 N-CA-C 109.678 -0.489 . . . . 0.0 109.678 177.125 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 99.7 m -70.61 -41.46 72.22 Favored 'General case' 0 N--CA 1.45 -0.47 0 N-CA-C 109.685 -0.487 . . . . 0.0 109.685 -177.881 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 29.1 t80 -66.07 -30.29 70.78 Favored 'General case' 0 N--CA 1.453 -0.282 0 C-N-CA 119.772 -0.771 . . . . 0.0 109.815 178.206 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -71.03 -27.86 63.97 Favored 'General case' 0 N--CA 1.449 -0.489 0 CA-C-O 119.492 -0.289 . . . . 0.0 111.375 176.102 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.405 HD23 ' HA ' ' A' ' 37' ' ' LEU . 11.4 mt -81.18 -39.63 25.17 Favored 'General case' 0 CA--C 1.519 -0.242 0 N-CA-C 108.926 -0.768 . . . . 0.0 108.926 -179.943 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 86.1 m-20 -58.65 -30.79 67.58 Favored 'General case' 0 N--CA 1.44 -0.949 0 C-N-CA 123.843 0.857 . . . . 0.0 110.633 175.076 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 78.4 m80 -149.93 103.3 3.2 Favored 'General case' 0 N--CA 1.453 -0.306 0 C-N-CA 122.885 0.474 . . . . 0.0 111.299 179.147 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 40' ' ' ILE . . . . . 0.638 ' H ' HD13 ' A' ' 40' ' ' ILE . 0.0 OUTLIER -75.72 -9.92 13.1 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.449 0 N-CA-C 109.136 -0.69 . . . . 0.0 109.136 172.672 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 4.6 m-20 -55.21 -25.11 30.95 Favored 'General case' 0 N--CA 1.455 -0.224 0 C-N-CA 124.026 0.931 . . . . 0.0 111.58 -177.744 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -105.62 16.33 6.45 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.328 0 C-N-CA 123.454 0.701 . . . . 0.0 112.105 -179.656 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 2.7 pp20? -52.31 -31.31 32.48 Favored 'General case' 0 CA--C 1.529 0.135 0 CA-C-N 118.641 0.655 . . . . 0.0 111.051 178.583 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 40.8 t -62.27 -46.85 86.95 Favored 'General case' 0 CA--C 1.531 0.238 0 N-CA-C 112.265 0.469 . . . . 0.0 112.265 -177.879 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . 0.498 ' HD3' ' CD1' ' A' ' 7' ' ' PHE . 14.6 ptpt -74.34 -23.49 59.05 Favored 'General case' 0 C--N 1.341 0.219 0 O-C-N 121.892 -0.505 . . . . 0.0 110.149 179.21 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 85.5 mt -73.74 -47.81 42.45 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.307 0 N-CA-C 110.059 -0.348 . . . . 0.0 110.059 -178.697 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 40.7 mm -66.93 -38.28 81.08 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.13 0 N-CA-C 109.781 -0.452 . . . . 0.0 109.781 179.415 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 27.8 t -64.78 -34.25 77.91 Favored 'General case' 0 N--CA 1.454 -0.258 0 C-N-CA 121.103 -0.239 . . . . 0.0 110.459 178.14 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . 0.454 HD22 ' CE1' ' A' ' 7' ' ' PHE . 40.9 tp -75.15 -34.51 61.63 Favored 'General case' 0 N--CA 1.452 -0.353 0 N-CA-C 112.673 0.62 . . . . 0.0 112.673 -176.605 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 11.4 pt -71.23 -43.21 74.73 Favored 'Isoleucine or valine' 0 C--N 1.339 0.151 0 CA-C-N 118.459 0.572 . . . . 0.0 110.162 178.574 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 35.4 pt -65.29 -39.77 86.41 Favored 'Isoleucine or valine' 0 C--O 1.231 0.103 0 C-N-CA 119.87 -0.732 . . . . 0.0 110.842 -178.516 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 78.3 m-20 -65.11 -51.46 61.14 Favored 'General case' 0 N--CA 1.454 -0.254 0 CA-C-N 117.462 0.119 . . . . 0.0 111.214 179.04 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 53' ' ' TYR . . . . . 0.421 ' CB ' HD21 ' A' ' 14' ' ' LEU . 15.9 t80 -63.95 -45.54 88.72 Favored 'General case' 0 N--CA 1.453 -0.306 0 N-CA-C 110.1 -0.334 . . . . 0.0 110.1 -179.293 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 31.7 t -65.2 -29.9 70.75 Favored 'General case' 0 N--CA 1.455 -0.216 0 N-CA-C 112.646 0.61 . . . . 0.0 112.646 -175.204 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 17.0 tpt85 -82.14 -36.67 27.2 Favored 'General case' 0 N--CA 1.454 -0.235 0 C-N-CA 119.697 -0.801 . . . . 0.0 111.193 -178.492 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 57.7 mt -80.98 -43.26 19.93 Favored 'General case' 0 C--O 1.227 -0.111 0 N-CA-C 112.764 0.654 . . . . 0.0 112.764 -178.482 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 57' ' ' CYS . . . . . 0.466 ' HB2' ' HD2' ' A' ' 58' ' ' PRO . 13.3 p -62.06 159.78 35.09 Favored Pre-proline 0 CA--C 1.536 0.419 0 N-CA-C 112.875 0.695 . . . . 0.0 112.875 -173.93 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 58' ' ' PRO . . . . . 0.466 ' HD2' ' HB2' ' A' ' 57' ' ' CYS . 84.3 Cg_endo -74.7 169.94 21.45 Favored 'Trans proline' 0 N--CA 1.451 -1.014 0 C-N-CA 124.209 3.272 . . . . 0.0 110.183 179.4 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -50.5 -47.04 57.45 Favored 'General case' 0 N--CA 1.457 -0.124 0 N-CA-C 114.287 1.218 . . . . 0.0 114.287 -170.795 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 16.6 t -66.79 -32.1 73.16 Favored 'General case' 0 N--CA 1.455 -0.198 0 C-N-CA 119.539 -0.864 . . . . 0.0 110.038 -177.323 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 54.8 m170 -76.03 -27.55 57.36 Favored 'General case' 0 N--CA 1.453 -0.276 0 N-CA-C 109.973 -0.38 . . . . 0.0 109.973 177.221 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 68.0 mttm -65.73 -39.87 91.58 Favored 'General case' 0 C--N 1.343 0.305 0 N-CA-C 109.106 -0.702 . . . . 0.0 109.106 174.074 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -63.08 -41.64 99.46 Favored 'General case' 0 N--CA 1.452 -0.374 0 N-CA-C 108.283 -1.006 . . . . 0.0 108.283 176.702 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -67.63 -31.56 76.51 Favored Glycine 0 CA--C 1.525 0.704 0 CA-C-O 119.713 -0.493 . . . . 0.0 112.271 -179.197 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 22.6 t -74.28 -32.75 63.02 Favored 'General case' 0 N--CA 1.453 -0.277 0 CA-C-N 118.118 0.959 . . . . 0.0 110.566 178.157 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 69.1 mt -71.99 -24.86 61.64 Favored 'General case' 0 N--CA 1.452 -0.328 0 N-CA-C 109.336 -0.616 . . . . 0.0 109.336 176.037 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -72.47 -36.88 68.59 Favored 'General case' 0 N--CA 1.455 -0.19 0 N-CA-C 110.333 -0.247 . . . . 0.0 110.333 174.533 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 68' ' ' ILE . . . . . . . . . . . . . 27.1 mt -66.65 -49.58 73.53 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.356 0 N-CA-C 108.811 -0.811 . . . . 0.0 108.811 174.886 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 67.1 mt -54.14 -34.68 27.43 Favored 'Isoleucine or valine' 0 C--O 1.226 -0.177 0 C-N-CA 123.085 0.554 . . . . 0.0 111.702 175.78 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 28.9 t70 -68.3 -44.58 75.11 Favored 'General case' 0 N--CA 1.452 -0.331 0 CA-C-N 119.112 0.869 . . . . 0.0 110.651 176.538 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 31.9 t -67.45 -57.22 6.93 Favored 'General case' 0 N--CA 1.451 -0.382 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.926 -176.804 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 72' ' ' ILE . . . . . 0.408 HD11 ' CZ ' ' A' ' 76' ' ' TYR . 0.0 OUTLIER -75.12 -30.58 23.38 Favored 'Isoleucine or valine' 0 CA--C 1.523 -0.075 0 N-CA-C 110.465 -0.198 . . . . 0.0 110.465 -177.469 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -68.49 -54.3 16.64 Favored Glycine 0 C--N 1.336 0.545 0 N-CA-C 111.582 -0.607 . . . . 0.0 111.582 -175.774 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 44.3 mtm105 -69.75 -37.34 76.4 Favored 'General case' 0 N--CA 1.452 -0.327 0 C-N-CA 120.273 -0.571 . . . . 0.0 109.737 179.294 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -60.29 -37.02 79.22 Favored 'General case' 0 N--CA 1.45 -0.456 0 C-N-CA 120.299 -0.56 . . . . 0.0 110.323 179.486 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 76' ' ' TYR . . . . . 0.408 ' CZ ' HD11 ' A' ' 72' ' ' ILE . 2.1 m-30 -68.05 -54.08 20.94 Favored 'General case' 0 N--CA 1.451 -0.378 0 CA-C-N 118.075 0.398 . . . . 0.0 111.045 178.765 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 1.5 tt -67.84 -42.27 81.66 Favored 'General case' 0 N--CA 1.448 -0.531 0 C-N-CA 118.813 -1.155 . . . . 0.0 109.003 -174.837 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 79.6 m-20 -61.72 -49.45 76.4 Favored 'General case' 0 CA--C 1.531 0.235 0 N-CA-C 112.946 0.721 . . . . 0.0 112.946 179.07 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 65.5 mm-40 -66.32 -42.96 87.5 Favored 'General case' 0 C--N 1.34 0.158 0 CA-C-N 119.452 1.024 . . . . 0.0 111.688 -178.279 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 42.6 p -65.03 -35.34 80.87 Favored 'General case' 0 N--CA 1.45 -0.432 0 N-CA-C 109.737 -0.468 . . . . 0.0 109.737 178.15 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 33.1 ttp180 -69.16 -43.22 74.71 Favored 'General case' 0 N--CA 1.45 -0.432 0 C-N-CA 123.613 0.765 . . . . 0.0 111.792 179.259 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 42.0 t -83.59 -35.66 24.52 Favored 'General case' 0 N--CA 1.454 -0.254 0 N-CA-C 113.568 0.951 . . . . 0.0 113.568 -176.56 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 50.7 m-20 -131.18 -8.65 3.81 Favored 'General case' 0 C--N 1.34 0.165 0 N-CA-C 115.471 1.656 . . . . 0.0 115.471 -166.967 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 92.0 p -161.26 77.95 0.57 Allowed 'General case' 0 N--CA 1.461 0.11 0 CA-C-N 119.844 1.202 . . . . 0.0 111.621 179.11 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 4.5 m120 -65.14 137.57 57.73 Favored 'General case' 0 CA--C 1.529 0.156 0 N-CA-C 109.258 -0.645 . . . . 0.0 109.258 177.642 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 86' ' ' SER . . . . . 0.403 ' C ' ' H ' ' A' ' 88' ' ' SER . 76.6 p -83.24 -17.07 43.97 Favored 'General case' 0 CA--C 1.528 0.124 0 O-C-N 122.294 -0.254 . . . . 0.0 111.447 -179.423 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 37.5 p 58.65 -5.42 0.06 Allowed 'General case' 0 N--CA 1.463 0.216 0 C-N-CA 125.787 1.635 . . . . 0.0 113.73 -177.001 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 88' ' ' SER . . . . . 0.403 ' H ' ' C ' ' A' ' 86' ' ' SER . 46.6 t -162.89 162.4 26.3 Favored 'General case' 0 N--CA 1.454 -0.258 0 C-N-CA 122.963 0.505 . . . . 0.0 110.119 179.841 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 1.1 t30 -82.97 114.22 21.09 Favored 'General case' 0 N--CA 1.454 -0.229 0 N-CA-C 109.468 -0.567 . . . . 0.0 109.468 175.424 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 46.8 mmtm -149.62 142.11 15.57 Favored Pre-proline 0 N--CA 1.456 -0.128 0 N-CA-C 108.628 -0.879 . . . . 0.0 108.628 177.866 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 70.5 Cg_exo -52.8 144.77 42.47 Favored 'Trans proline' 0 N--CA 1.45 -1.075 0 C-N-CA 122.639 2.226 . . . . 0.0 109.727 173.815 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 92.69 20.27 34.86 Favored Glycine 0 CA--C 1.528 0.851 0 CA-C-O 119.21 -0.772 . . . . 0.0 112.487 -178.246 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 60.6 p -151.67 167.61 27.61 Favored 'General case' 0 CA--C 1.522 -0.119 0 CA-C-N 118.11 0.955 . . . . 0.0 110.26 176.118 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 94' ' ' CYS . . . . . 0.461 ' HB2' HD13 ' A' ' 98' ' ' ILE . 17.2 p -59.51 -24.69 63.85 Favored 'General case' 0 N--CA 1.449 -0.512 0 CA-C-N 115.623 -0.717 . . . . 0.0 109.779 175.794 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -63.4 -57.65 9.61 Favored 'General case' 0 N--CA 1.446 -0.656 0 N-CA-C 109.376 -0.601 . . . . 0.0 109.376 -173.59 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 66.5 t60 -74.78 -29.28 61.06 Favored 'General case' 0 N--CA 1.449 -0.524 0 CA-C-N 116.553 -0.294 . . . . 0.0 110.631 -179.464 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -67.41 -54.52 19.7 Favored 'General case' 0 N--CA 1.452 -0.336 0 N-CA-C 111.643 0.238 . . . . 0.0 111.643 -179.125 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 98' ' ' ILE . . . . . 0.461 HD13 ' HB2' ' A' ' 94' ' ' CYS . 2.5 mp -70.0 -31.51 48.05 Favored 'Isoleucine or valine' 0 C--N 1.341 0.202 0 C-N-CA 120.817 -0.353 . . . . 0.0 110.504 -179.577 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 77.0 m-20 -68.65 -38.25 80.32 Favored 'General case' 0 N--CA 1.452 -0.37 0 CA-C-N 118.458 0.572 . . . . 0.0 111.379 176.544 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 58.2 m -73.14 -36.93 66.77 Favored 'General case' 0 N--CA 1.454 -0.228 0 CA-C-N 117.996 0.362 . . . . 0.0 110.378 179.874 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 60.0 tp -74.86 -31.92 61.75 Favored 'General case' 0 N--CA 1.452 -0.372 0 C-N-CA 121.394 -0.122 . . . . 0.0 111.089 179.137 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -62.91 -20.86 62.76 Favored Glycine 0 CA--C 1.525 0.71 0 CA-C-O 119.614 -0.548 . . . . 0.0 112.465 -176.047 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 6.1 mm-40 -85.92 -32.77 21.43 Favored 'General case' 0 N--CA 1.456 -0.164 0 CA-C-N 118.213 1.006 . . . . 0.0 111.428 177.711 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 43.9 t -96.06 -19.35 6.25 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.221 0 N-CA-C 112.701 0.63 . . . . 0.0 112.701 -175.415 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 105' ' ' ILE . . . . . . . . . . . . . 10.5 tp -57.59 -24.95 23.42 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.229 0 CA-C-N 118.604 0.638 . . . . 0.0 111.8 -177.025 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 27.5 pt20 -68.17 -25.3 65.18 Favored 'General case' 0 N--CA 1.452 -0.368 0 O-C-N 122.1 -0.375 . . . . 0.0 110.325 178.506 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 65.0 mm-40 -75.58 -39.95 57.31 Favored 'General case' 0 N--CA 1.456 -0.13 0 CA-C-N 118.271 0.487 . . . . 0.0 109.913 176.471 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 8.3 mp -70.56 -41.16 72.81 Favored 'General case' 0 N--CA 1.451 -0.376 0 N-CA-C 109.769 -0.456 . . . . 0.0 109.769 -178.583 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 89.1 mt -67.69 -61.45 1.88 Allowed 'General case' 0 N--CA 1.452 -0.337 0 CA-C-O 119.351 -0.357 . . . . 0.0 110.246 178.451 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 19.5 p -44.36 -51.24 8.69 Favored 'General case' 0 CA--C 1.52 -0.205 0 C-N-CA 122.993 0.517 . . . . 0.0 112.238 -178.076 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 62.3 t0 -63.69 -42.01 98.05 Favored 'General case' 0 N--CA 1.448 -0.539 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.438 -178.047 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -72.42 -35.75 68.44 Favored 'General case' 0 N--CA 1.447 -0.593 0 C-N-CA 120.762 -0.375 . . . . 0.0 111.268 -178.028 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 113' ' ' ILE . . . . . . . . . . . . . 34.9 mm -68.42 -38.27 79.06 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.185 0 CA-C-N 119.185 0.902 . . . . 0.0 109.569 -177.533 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -75.0 -45.46 41.79 Favored 'General case' 0 N--CA 1.451 -0.396 0 CA-C-N 117.471 0.123 . . . . 0.0 111.242 179.765 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 115' ' ' LYS . . . . . 0.611 ' HE2' ' HA ' ' A' ' 115' ' ' LYS . 0.2 OUTLIER -82.07 -31.16 30.94 Favored 'General case' 0 N--CA 1.455 -0.209 0 N-CA-C 113.869 1.063 . . . . 0.0 113.869 -173.111 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 116' ' ' SER . . . . . 0.464 ' HB2' ' CB ' ' A' ' 120' ' ' HIS . 45.5 p -76.39 156.12 33.48 Favored 'General case' 0 CA--C 1.528 0.13 0 N-CA-C 112.261 0.467 . . . . 0.0 112.261 -172.984 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 53.6 t30 -73.02 165.67 24.57 Favored 'General case' 0 N--CA 1.453 -0.277 0 C-N-CA 123.383 0.673 . . . . 0.0 110.708 -178.863 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 118' ' ' GLN . . . . . . . . . . . . . 20.5 mm100 -53.68 -38.1 63.86 Favored 'General case' 0 CA--C 1.531 0.226 0 N-CA-C 112.908 0.707 . . . . 0.0 112.908 -172.765 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 7.5 p-10 -71.65 -38.42 70.71 Favored 'General case' 0 N--CA 1.454 -0.272 0 N-CA-C 109.899 -0.408 . . . . 0.0 109.899 179.227 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 120' ' ' HIS . . . . . 0.464 ' CB ' ' HB2' ' A' ' 116' ' ' SER . 34.3 m170 -65.3 -40.78 94.26 Favored 'General case' 0 N--CA 1.451 -0.406 0 C-N-CA 122.681 0.392 . . . . 0.0 110.044 176.457 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 56.7 mttm -58.55 -42.94 89.02 Favored 'General case' 0 C--N 1.341 0.231 0 N-CA-C 108.895 -0.779 . . . . 0.0 108.895 178.225 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 43.8 tp10 -73.73 -36.5 65.18 Favored 'General case' 0 N--CA 1.451 -0.417 0 CA-C-N 116.661 -0.245 . . . . 0.0 111.468 -176.863 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 13.0 tppt? -62.41 -36.04 81.1 Favored 'General case' 0 N--CA 1.45 -0.431 0 N-CA-C 109.333 -0.617 . . . . 0.0 109.333 177.828 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 124' ' ' ILE . . . . . . . . . . . . . 61.2 mt -69.37 -36.26 71.14 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.261 0 O-C-N 121.957 -0.464 . . . . 0.0 109.892 177.51 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 13.7 mtp-105 -68.05 -35.34 78.07 Favored 'General case' 0 N--CA 1.457 -0.099 0 CA-C-O 119.468 -0.301 . . . . 0.0 111.511 -178.472 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 126' ' ' MET . . . . . . . . . . . . . 27.2 ptm -72.92 -28.01 62.2 Favored 'General case' 0 N--CA 1.455 -0.177 0 C-N-CA 119.488 -0.885 . . . . 0.0 109.452 174.666 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 4.2 mp -65.77 -31.62 72.69 Favored 'General case' 0 CA--C 1.529 0.163 0 CA-C-N 118.084 0.402 . . . . 0.0 110.134 172.999 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 95.6 mt -70.12 -38.72 75.66 Favored 'General case' 0 C--N 1.34 0.19 0 CA-C-N 118.755 0.707 . . . . 0.0 109.868 176.237 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 10.7 t70 -60.37 -44.02 96.01 Favored 'General case' 0 N--CA 1.454 -0.231 0 N-CA-C 109.182 -0.673 . . . . 0.0 109.182 175.561 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 130' ' ' ILE . . . . . 0.419 ' HA ' ' HD3' ' A' ' 133' ' ' ARG . 73.9 mt -61.87 -39.07 82.18 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.417 0 CA-C-N 116.418 -0.355 . . . . 0.0 110.632 -179.532 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 131' ' ' TRP . . . . . . . . . . . . . 48.1 m0 -75.39 -32.64 60.86 Favored 'General case' 0 N--CA 1.45 -0.43 0 N-CA-C 112.355 0.502 . . . . 0.0 112.355 -179.045 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 62.9 m-20 -70.53 -27.56 64.26 Favored 'General case' 0 C--O 1.228 -0.067 0 CA-C-N 118.504 0.593 . . . . 0.0 110.881 177.535 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 133' ' ' ARG . . . . . 0.481 HH21 ' C ' ' B' 2063 ' ' SER . 23.6 mtp180 -73.28 -42.95 61.85 Favored 'General case' 0 CA--C 1.521 -0.163 0 N-CA-C 109.741 -0.466 . . . . 0.0 109.741 177.019 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 46.4 t -77.08 -19.1 57.5 Favored 'General case' 0 CA--C 1.536 0.421 0 C-N-CA 122.185 0.194 . . . . 0.0 111.289 178.898 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 135' ' ' GLY . . . . . . . . . . . . . . . 91.09 14.13 58.01 Favored Glycine 0 CA--C 1.528 0.904 0 CA-C-O 119.346 -0.697 . . . . 0.0 114.356 174.444 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 136' ' ' LEU . . . . . . . . . . . . . 7.8 mp -73.08 154.65 40.32 Favored 'General case' 0 CA--C 1.529 0.154 0 CA-C-N 118.591 1.196 . . . . 0.0 109.881 178.667 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 137' ' ' PHE . . . . . . . . . . . . . 16.2 m-85 -77.68 148.38 35.01 Favored 'General case' 0 N--CA 1.455 -0.207 0 N-CA-C 109.77 -0.455 . . . . 0.0 109.77 176.648 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 138' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -150.9 -3.39 0.33 Allowed 'General case' 0 CA--C 1.532 0.271 0 N-CA-C 114.382 1.253 . . . . 0.0 114.382 -178.322 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 139' ' ' LYS . . . . . 0.423 ' C ' ' H ' ' A' ' 141' ' ' TYR . 53.7 mttp 49.95 28.7 3.0 Favored 'General case' 0 CA--C 1.536 0.407 0 CA-C-N 118.955 0.798 . . . . 0.0 111.746 -175.776 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 140' ' ' SER . . . . . . . . . . . . . 34.0 t -68.75 26.41 0.03 OUTLIER 'General case' 0 CA--C 1.532 0.281 0 C-N-CA 124.58 1.152 . . . . 0.0 113.139 -176.06 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 141' ' ' TYR . . . . . 0.423 ' H ' ' C ' ' A' ' 139' ' ' LYS . 43.7 p90 -137.24 2.18 2.5 Favored 'General case' 0 N--CA 1.452 -0.34 0 C-N-CA 123.562 0.745 . . . . 0.0 111.001 178.837 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 142' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -80.65 147.83 30.49 Favored 'General case' 0 N--CA 1.455 -0.192 0 N-CA-C 109.379 -0.6 . . . . 0.0 109.379 175.957 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 4.4 m120 -63.34 -15.06 56.24 Favored 'General case' 0 CA--C 1.53 0.194 0 C-N-CA 122.713 0.405 . . . . 0.0 111.805 -178.692 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . -72.15 -32.5 66.94 Favored 'General case' 0 N--CA 1.45 -0.432 0 C-N-CA 122.185 0.194 . . . . 0.0 110.586 178.356 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 145' ' ' ILE . . . . . . . . . . . . . 38.5 mm -70.54 -35.11 60.12 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.209 0 N-CA-C 110.069 -0.345 . . . . 0.0 110.069 -178.114 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 146' ' ' ARG . . . . . . . . . . . . . 9.2 tpp180 -73.61 -31.9 63.8 Favored 'General case' 0 N--CA 1.454 -0.233 0 N-CA-C 108.905 -0.776 . . . . 0.0 108.905 176.495 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 147' ' ' SER . . . . . . . . . . . . . 42.9 t 46.45 52.65 10.59 Favored 'General case' 0 N--CA 1.456 -0.143 0 CA-C-O 120.941 0.401 . . . . 0.0 110.433 178.275 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 148' ' ' LYS . . . . . 0.478 ' HD3' ' H ' ' A' ' 148' ' ' LYS . 0.0 OUTLIER -49.22 -18.85 0.39 Allowed 'General case' 0 N--CA 1.453 -0.32 0 C-N-CA 125.004 1.322 . . . . 0.0 113.608 -175.527 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 149' ' ' CYS . . . . . . . . . . . . . 60.1 m -62.73 -34.53 77.38 Favored 'General case' 0 N--CA 1.452 -0.368 0 CA-C-N 118.575 0.625 . . . . 0.0 110.226 178.231 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 150' ' ' PHE . . . . . . . . . . . . . 70.2 t80 -69.83 -28.3 65.58 Favored 'General case' 0 N--CA 1.452 -0.339 0 N-CA-C 110.212 -0.292 . . . . 0.0 110.212 179.495 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 151' ' ' ALA . . . . . . . . . . . . . . . -76.44 -27.52 56.23 Favored 'General case' 0 N--CA 1.452 -0.337 0 C-N-CA 122.16 0.184 . . . . 0.0 110.573 177.073 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 152' ' ' MET . . . . . . . . . . . . . 96.4 mmm -75.84 -27.11 57.71 Favored 'General case' 0 N--CA 1.455 -0.202 0 N-CA-C 110.435 -0.209 . . . . 0.0 110.435 175.143 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 153' ' ' ASP . . . . . . . . . . . . . 67.0 m-20 -73.55 -42.98 60.95 Favored 'General case' 0 N--CA 1.454 -0.265 0 N-CA-C 110.305 -0.258 . . . . 0.0 110.305 175.144 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 154' ' ' LEU . . . . . . . . . . . . . 49.2 mt -143.11 121.17 12.11 Favored 'General case' 0 CA--C 1.53 0.176 0 C-N-CA 123.174 0.59 . . . . 0.0 109.962 177.772 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 155' ' ' GLU . . . . . . . . . . . . . 92.0 mt-10 -73.76 0.76 12.09 Favored 'General case' 0 CA--C 1.53 0.195 0 C-N-CA 122.405 0.282 . . . . 0.0 111.071 178.055 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 156' ' ' HIS . . . . . . . . . . . . . 33.2 m170 -76.41 13.41 0.96 Allowed 'General case' 0 N--CA 1.456 -0.16 0 C-N-CA 124.092 0.957 . . . . 0.0 112.678 -175.57 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 157' ' ' HIS . . . . . . . . . . . . . 76.6 m-70 -137.63 147.91 45.35 Favored 'General case' 0 N--CA 1.454 -0.256 0 CA-C-N 118.214 0.461 . . . . 0.0 111.849 -174.733 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 158' ' ' HIS . . . . . . . . . . . . . 20.8 p80 -156.04 5.19 0.19 Allowed 'General case' 0 C--O 1.227 -0.099 0 C-N-CA 123.87 0.868 . . . . 0.0 110.384 178.042 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 159' ' ' HIS . . . . . . . . . . . . . 13.6 m80 . . . . . 0 C--O 1.248 0.993 0 CA-C-O 117.282 -1.342 . . . . 0.0 111.21 -174.44 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' B' B 2052 ' ' ASP . . . . . . . . . . . . . 3.0 m-20 . . . . . 0 N--CA 1.467 0.399 0 N-CA-C 110.407 -0.22 . . . . 0.0 110.407 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' B' B 2053 ' ' ASP . . . . . . . . . . . . . 19.4 m-20 -68.78 175.55 3.53 Favored 'General case' 0 CA--C 1.53 0.176 0 C-N-CA 123.16 0.584 . . . . 0.0 112.518 -178.045 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B 2054 ' ' ASP . . . . . . . . . . . . . 42.4 p30 -136.32 23.2 3.22 Favored 'General case' 0 CA--C 1.533 0.297 0 C-N-CA 123.79 0.836 . . . . 0.0 112.882 -170.036 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B 2055 ' ' GLU . . . . . . . . . . . . . 65.0 tt0 -149.17 48.0 0.98 Allowed 'General case' 0 CA--C 1.528 0.123 0 O-C-N 121.742 -0.599 . . . . 0.0 110.617 -177.088 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B 2056 ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -67.78 13.16 0.08 Allowed 'General case' 0 CA--C 1.535 0.372 0 N-CA-C 114.304 1.224 . . . . 0.0 114.304 -176.004 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B 2057 ' ' ASP . . . . . . . . . . . . . 47.4 t0 -157.11 74.18 0.77 Allowed 'General case' 0 N--CA 1.453 -0.316 0 CA-C-N 118.469 0.577 . . . . 0.0 110.289 172.897 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B 2058 ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -59.14 131.52 51.28 Favored 'General case' 0 C--N 1.341 0.231 0 N-CA-C 108.994 -0.743 . . . . 0.0 108.994 175.832 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B 2059 ' ' THR . . . . . . . . . . . . . 49.2 m -83.37 115.76 60.93 Favored Pre-proline 0 N--CA 1.454 -0.27 0 N-CA-C 108.94 -0.763 . . . . 0.0 108.94 179.07 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B 2060 ' ' PRO . . . . . . . . . . . . . 98.7 Cg_endo -74.22 122.18 7.38 Favored 'Trans proline' 0 N--CA 1.447 -1.23 0 C-N-CA 122.819 2.346 . . . . 0.0 110.832 -178.934 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B 2061 ' ' SER . . . . . . . . . . . . . 76.6 p -79.46 126.55 31.0 Favored 'General case' 0 N--CA 1.451 -0.393 0 N-CA-C 108.158 -1.053 . . . . 0.0 108.158 173.207 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B 2062 ' ' ILE . . . . . 0.435 HD11 ' HB2' ' A' ' 133' ' ' ARG . 4.6 tp -151.86 133.05 4.78 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.382 0 N-CA-C 112.308 0.484 . . . . 0.0 112.308 -175.963 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B 2063 ' ' SER . . . . . 0.481 ' C ' HH21 ' A' ' 133' ' ' ARG . 35.1 m . . . . . 0 C--O 1.252 1.205 0 CA-C-O 117.628 -1.177 . . . . 0.0 109.548 175.418 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 2.9 mpp? . . . . . 0 N--CA 1.475 0.806 0 CA-C-O 119.983 -0.056 . . . . 0.0 111.1 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 5.1 pm0 -150.35 -19.09 0.24 Allowed 'General case' 0 CA--C 1.532 0.265 0 N-CA-C 111.972 0.36 . . . . 0.0 111.972 -179.82 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 18.8 pt20 -157.69 20.31 0.27 Allowed 'General case' 0 CA--C 1.529 0.139 0 N-CA-C 107.496 -1.298 . . . . 0.0 107.496 173.455 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 11.0 p30 -158.32 -179.97 8.6 Favored 'General case' 0 N--CA 1.445 -0.724 0 C-N-CA 125.892 1.677 . . . . 0.0 108.312 -168.502 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 8.4 m-20 56.94 20.13 5.1 Favored 'General case' 0 N--CA 1.456 -0.146 0 C-N-CA 123.604 0.762 . . . . 0.0 112.848 179.5 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 26.8 p-10 -73.44 -28.85 62.19 Favored 'General case' 0 N--CA 1.454 -0.27 0 C-N-CA 123.13 0.572 . . . . 0.0 110.017 -178.764 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 1.6 t80 -53.83 -37.54 63.7 Favored 'General case' 0 N--CA 1.45 -0.461 0 CA-C-N 115.965 -0.561 . . . . 0.0 109.983 178.966 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 53.3 tp60 -56.58 -32.17 64.95 Favored 'General case' 0 N--CA 1.452 -0.369 0 C-N-CA 123.166 0.586 . . . . 0.0 111.813 -177.017 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 13.7 t-20 -71.45 -34.45 70.25 Favored 'General case' 0 N--CA 1.452 -0.346 0 N-CA-C 109.832 -0.433 . . . . 0.0 109.832 177.964 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 10' ' ' PHE . . . . . 0.464 ' CE2' ' HB2' ' A' ' 32' ' ' LEU . 6.7 t80 -68.97 -38.85 79.61 Favored 'General case' 0 N--CA 1.45 -0.43 0 C-N-CA 123.176 0.591 . . . . 0.0 109.5 176.014 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 87.4 t -64.48 -55.14 23.05 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.316 0 N-CA-C 109.092 -0.707 . . . . 0.0 109.092 178.279 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -59.7 -28.45 67.33 Favored 'General case' 0 N--CA 1.452 -0.334 0 C-N-CA 122.973 0.509 . . . . 0.0 112.1 -178.932 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 90.7 m -74.57 -39.94 61.94 Favored 'General case' 0 N--CA 1.456 -0.174 0 N-CA-C 109.222 -0.659 . . . . 0.0 109.222 176.99 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.466 ' HA ' ' CD1' ' A' ' 17' ' ' PHE . 13.0 tp -65.77 -44.48 85.71 Favored 'General case' 0 N--CA 1.452 -0.367 0 N-CA-C 109.3 -0.63 . . . . 0.0 109.3 179.366 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 67.7 mm-40 -62.48 -29.65 70.69 Favored 'General case' 0 N--CA 1.45 -0.458 0 C-N-CA 124.304 1.042 . . . . 0.0 109.446 177.591 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 40.8 t -69.13 -28.44 66.45 Favored 'General case' 0 N--CA 1.451 -0.392 0 CA-C-O 119.052 -0.499 . . . . 0.0 110.147 177.52 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 17' ' ' PHE . . . . . 0.532 ' CD1' HD11 ' A' ' 68' ' ' ILE . 29.2 m-85 -71.98 -36.67 69.86 Favored 'General case' 0 C--N 1.339 0.115 0 CA-C-N 118.693 0.679 . . . . 0.0 110.824 171.979 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 80.6 mttt -63.25 -24.21 67.77 Favored 'General case' 0 C--N 1.339 0.144 0 N-CA-C 110.169 -0.308 . . . . 0.0 110.169 177.429 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 30.1 t0 -76.59 -16.76 59.5 Favored 'General case' 0 CA--C 1.538 0.505 0 N-CA-C 112.466 0.543 . . . . 0.0 112.466 176.697 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . 0.505 HD22 ' HA ' ' B' 2053 ' ' ASP . 10.1 mt -85.44 161.08 19.56 Favored 'General case' 0 N--CA 1.457 -0.107 0 CA-C-N 118.728 0.694 . . . . 0.0 111.983 -174.043 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . 0.51 ' HE3' ' N ' ' A' ' 21' ' ' LYS . 0.8 OUTLIER -82.64 -36.59 25.9 Favored 'General case' 0 N--CA 1.454 -0.229 0 N-CA-C 108.803 -0.814 . . . . 0.0 108.803 176.797 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 35.9 t -90.16 -24.77 20.96 Favored 'General case' 0 C--N 1.341 0.231 0 C-N-CA 124.034 0.934 . . . . 0.0 111.648 -179.791 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 77.7 -10.52 24.14 Favored Glycine 0 CA--C 1.532 1.146 0 CA-C-O 119.675 -0.514 . . . . 0.0 111.896 -177.372 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 70.0 mt -96.05 148.93 4.93 Favored 'Isoleucine or valine' 0 C--N 1.34 0.188 0 CA-C-N 117.507 0.654 . . . . 0.0 111.155 178.447 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 19.1 t -167.68 100.82 0.48 Allowed 'General case' 0 CA--C 1.518 -0.252 0 N-CA-C 108.777 -0.823 . . . . 0.0 108.777 176.177 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -54.67 -45.62 77.68 Favored Glycine 0 CA--C 1.527 0.8 0 C-N-CA 120.861 -0.685 . . . . 0.0 112.025 -175.106 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 8.9 m -64.51 -42.72 95.64 Favored 'General case' 0 N--CA 1.456 -0.135 0 CA-C-N 118.232 1.016 . . . . 0.0 111.349 -177.327 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 28.7 mtt180 -74.63 -39.12 62.32 Favored 'General case' 0 N--CA 1.453 -0.281 0 CA-C-N 118.231 0.468 . . . . 0.0 110.083 -177.821 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 69.8 mt -58.95 -45.23 92.12 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.607 0 N-CA-C 109.045 -0.724 . . . . 0.0 109.045 174.516 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 50.4 mtmt -69.18 -25.04 64.14 Favored 'General case' 0 C--O 1.231 0.092 0 CA-C-O 119.069 -0.491 . . . . 0.0 111.403 -179.994 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . 0.466 ' HA ' ' CE ' ' A' ' 31' ' ' LYS . 3.1 mmpt? -66.22 -55.95 13.71 Favored 'General case' 0 N--CA 1.455 -0.203 0 CA-C-N 118.662 0.665 . . . . 0.0 110.14 177.856 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.473 HD12 ' N ' ' A' ' 33' ' ' THR . 1.6 pp -75.43 -17.64 60.11 Favored 'General case' 0 CA--C 1.53 0.207 0 C-N-CA 119.165 -1.014 . . . . 0.0 111.554 -179.613 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . 0.473 ' N ' HD12 ' A' ' 32' ' ' LEU . 29.8 m -73.03 -41.6 64.06 Favored 'General case' 0 C--N 1.341 0.201 0 N-CA-C 108.926 -0.768 . . . . 0.0 108.926 176.378 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 97.0 m -69.59 -37.92 77.12 Favored 'General case' 0 N--CA 1.449 -0.499 0 N-CA-C 110.414 -0.217 . . . . 0.0 110.414 -178.36 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 14.8 t80 -62.92 -40.12 96.64 Favored 'General case' 0 N--CA 1.455 -0.216 0 N-CA-C 110.103 -0.332 . . . . 0.0 110.103 175.576 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -70.92 -31.95 68.72 Favored 'General case' 0 N--CA 1.45 -0.455 0 C-N-CA 122.337 0.255 . . . . 0.0 111.148 179.954 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.455 HD21 ' HB1' ' A' ' 75' ' ' ALA . 20.1 mt -71.34 -40.08 70.94 Favored 'General case' 0 N--CA 1.453 -0.296 0 C-N-CA 122.618 0.367 . . . . 0.0 110.733 179.844 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 42.6 t0 -65.55 -23.41 66.86 Favored 'General case' 0 N--CA 1.453 -0.285 0 CA-C-N 116.463 -0.335 . . . . 0.0 110.847 177.037 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 98.1 m-70 -149.27 98.39 2.8 Favored 'General case' 0 N--CA 1.452 -0.336 0 CA-C-O 121.071 0.462 . . . . 0.0 111.651 -175.96 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 40' ' ' ILE . . . . . 0.628 ' H ' HD13 ' A' ' 40' ' ' ILE . 0.0 OUTLIER -76.59 -10.54 13.35 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.368 0 C-N-CA 122.847 0.459 . . . . 0.0 110.357 175.385 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 8.0 m-20 -57.42 -23.99 52.83 Favored 'General case' 0 N--CA 1.455 -0.18 0 C-N-CA 123.0 0.52 . . . . 0.0 111.66 -178.322 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . 0.479 ' HB ' ' HE2' ' A' ' 45' ' ' LYS . 0.0 OUTLIER -101.92 15.77 5.07 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.244 0 C-N-CA 122.877 0.471 . . . . 0.0 112.163 177.999 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 3.0 pp20? -52.43 -29.64 25.42 Favored 'General case' 0 CA--C 1.531 0.247 0 CA-C-N 119.067 0.849 . . . . 0.0 110.812 179.262 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 39.5 t -62.0 -52.61 63.31 Favored 'General case' 0 C--O 1.234 0.28 0 N-CA-C 112.028 0.381 . . . . 0.0 112.028 -178.706 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . 0.479 ' HE2' ' HB ' ' A' ' 42' ' ' ILE . 17.7 pttt -68.43 -25.89 65.25 Favored 'General case' 0 C--N 1.34 0.184 0 CA-C-N 118.245 0.475 . . . . 0.0 109.924 179.897 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 87.0 mt -73.28 -45.8 51.89 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.493 0 C-N-CA 122.649 0.38 . . . . 0.0 110.425 -176.656 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 34.2 mm -64.89 -34.7 72.17 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.215 0 N-CA-C 109.584 -0.525 . . . . 0.0 109.584 177.84 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 23.3 t -63.78 -46.84 83.42 Favored 'General case' 0 C--O 1.227 -0.09 0 C-N-CA 119.968 -0.693 . . . . 0.0 110.367 177.708 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 6.6 mp -66.65 -30.65 70.96 Favored 'General case' 0 N--CA 1.454 -0.273 0 CA-C-O 118.635 -0.698 . . . . 0.0 112.317 -175.135 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 20.3 pt -71.93 -42.76 68.88 Favored 'Isoleucine or valine' 0 C--N 1.34 0.192 0 CA-C-N 119.64 1.109 . . . . 0.0 110.126 176.982 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 38.0 pt -68.94 -42.33 82.27 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.239 0 C-N-CA 119.459 -0.896 . . . . 0.0 110.487 179.395 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 74.3 m-20 -62.54 -37.68 87.07 Favored 'General case' 0 N--CA 1.455 -0.201 0 CA-C-N 117.779 0.263 . . . . 0.0 110.806 179.767 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 26.8 t80 -72.79 -29.75 63.53 Favored 'General case' 0 CA--C 1.528 0.118 0 N-CA-C 110.29 -0.263 . . . . 0.0 110.29 177.211 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 37.7 m -75.28 -21.94 58.15 Favored 'General case' 0 N--CA 1.455 -0.221 0 N-CA-C 111.952 0.353 . . . . 0.0 111.952 179.532 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 22.6 mmm180 -93.95 -53.23 4.07 Favored 'General case' 0 N--CA 1.453 -0.284 0 N-CA-C 112.686 0.624 . . . . 0.0 112.686 -179.569 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 46.6 mt -74.18 -46.11 44.18 Favored 'General case' 0 C--N 1.334 -0.099 0 N-CA-C 112.507 0.558 . . . . 0.0 112.507 -170.188 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 57' ' ' CYS . . . . . 0.469 ' HB3' ' HD2' ' A' ' 58' ' ' PRO . 74.4 m -74.08 158.28 85.87 Favored Pre-proline 0 CA--C 1.535 0.382 0 C-N-CA 122.539 0.336 . . . . 0.0 111.598 -176.209 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 58' ' ' PRO . . . . . 0.469 ' HD2' ' HB3' ' A' ' 57' ' ' CYS . 91.8 Cg_endo -76.89 175.09 11.82 Favored 'Trans proline' 0 N--CA 1.453 -0.894 0 C-N-CA 125.127 3.885 . . . . 0.0 112.009 -169.46 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 35.3 p-10 -46.95 -46.33 21.41 Favored 'General case' 0 CA--C 1.528 0.115 0 C-N-CA 125.182 1.393 . . . . 0.0 113.677 -171.728 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 36.3 m -67.36 -36.3 81.1 Favored 'General case' 0 N--CA 1.453 -0.298 0 N-CA-C 109.992 -0.373 . . . . 0.0 109.992 -177.17 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 61' ' ' HIS . . . . . 0.431 ' ND1' ' HD2' ' A' ' 58' ' ' PRO . 53.6 m170 -75.41 -23.9 57.06 Favored 'General case' 0 N--CA 1.452 -0.366 0 N-CA-C 110.023 -0.362 . . . . 0.0 110.023 178.261 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 57.2 mttm -68.55 -34.42 75.8 Favored 'General case' 0 CA--C 1.528 0.107 0 N-CA-C 109.405 -0.591 . . . . 0.0 109.405 172.978 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -64.64 -44.47 90.37 Favored 'General case' 0 CA--C 1.532 0.261 0 N-CA-C 108.029 -1.1 . . . . 0.0 108.029 174.579 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -66.6 -28.45 73.75 Favored Glycine 0 C--N 1.336 0.576 0 N-CA-C 111.538 -0.625 . . . . 0.0 111.538 -179.749 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 38.7 t -69.88 -44.16 70.34 Favored 'General case' 0 N--CA 1.451 -0.401 0 CA-C-N 117.387 0.594 . . . . 0.0 110.08 177.371 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 60.6 mt -65.7 -25.04 67.14 Favored 'General case' 0 N--CA 1.453 -0.307 0 N-CA-C 109.581 -0.526 . . . . 0.0 109.581 178.781 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 1.2 m-85 -72.24 -37.67 69.08 Favored 'General case' 0 N--CA 1.454 -0.235 0 C-N-CA 122.617 0.367 . . . . 0.0 110.811 174.585 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 68' ' ' ILE . . . . . 0.532 HD11 ' CD1' ' A' ' 17' ' ' PHE . 20.2 mt -69.72 -46.76 73.84 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.317 0 N-CA-C 109.137 -0.69 . . . . 0.0 109.137 176.226 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 93.7 mt -57.6 -34.14 46.51 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.258 0 C-N-CA 123.556 0.742 . . . . 0.0 110.784 176.86 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 18.7 t70 -68.73 -43.68 75.42 Favored 'General case' 0 N--CA 1.451 -0.393 0 CA-C-N 118.123 0.419 . . . . 0.0 110.757 178.165 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 30.3 t -69.31 -56.55 7.2 Favored 'General case' 0 N--CA 1.452 -0.352 0 CA-C-N 116.401 -0.363 . . . . 0.0 110.65 -177.304 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -74.97 -31.34 25.09 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.253 0 N-CA-C 110.177 -0.305 . . . . 0.0 110.177 -176.623 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -66.42 -55.61 17.33 Favored Glycine 0 C--N 1.336 0.561 0 N-CA-C 111.214 -0.754 . . . . 0.0 111.214 -176.523 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 37.6 mtm105 -66.41 -40.84 89.82 Favored 'General case' 0 N--CA 1.452 -0.349 0 C-N-CA 120.489 -0.485 . . . . 0.0 109.934 -179.358 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 75' ' ' ALA . . . . . 0.455 ' HB1' HD21 ' A' ' 37' ' ' LEU . . . -64.48 -30.29 71.32 Favored 'General case' 0 N--CA 1.45 -0.426 0 C-N-CA 120.058 -0.657 . . . . 0.0 110.998 -177.893 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 1.3 m-30 -69.66 -46.66 65.62 Favored 'General case' 0 C--N 1.34 0.191 0 CA-C-N 118.18 0.446 . . . . 0.0 110.858 177.55 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 50.0 tp -71.82 -38.5 70.17 Favored 'General case' 0 N--CA 1.451 -0.419 0 C-N-CA 118.01 -1.476 . . . . 0.0 109.451 -179.611 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 91.1 m-20 -60.98 -47.84 84.6 Favored 'General case' 0 CA--C 1.529 0.156 0 N-CA-C 112.893 0.701 . . . . 0.0 112.893 178.548 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 21.3 mm-40 -66.84 -45.53 77.92 Favored 'General case' 0 CA--C 1.522 -0.098 0 CA-C-N 119.221 0.919 . . . . 0.0 111.342 179.877 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 80' ' ' THR . . . . . 0.416 HG21 ' HB3' ' A' ' 94' ' ' CYS . 60.0 p -65.34 -30.76 71.63 Favored 'General case' 0 N--CA 1.456 -0.142 0 C-N-CA 120.195 -0.602 . . . . 0.0 110.632 179.847 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 38.2 ttp-105 -72.15 -30.86 65.43 Favored 'General case' 0 N--CA 1.454 -0.226 0 CA-C-N 117.98 0.355 . . . . 0.0 111.631 175.415 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 17.2 m -92.34 -23.89 19.1 Favored 'General case' 0 N--CA 1.457 -0.102 0 N-CA-C 113.495 0.924 . . . . 0.0 113.495 -174.422 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 76.1 m-20 -137.71 20.48 2.88 Favored 'General case' 0 N--CA 1.455 -0.2 0 N-CA-C 113.354 0.872 . . . . 0.0 113.354 -172.454 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 42.3 t -150.63 153.34 35.49 Favored 'General case' 0 N--CA 1.456 -0.175 0 O-C-N 121.765 -0.585 . . . . 0.0 111.377 176.705 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 74.5 m-20 -85.8 167.52 15.13 Favored 'General case' 0 N--CA 1.453 -0.323 0 N-CA-C 109.427 -0.583 . . . . 0.0 109.427 175.282 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 41.6 t -68.25 152.58 45.25 Favored 'General case' 0 N--CA 1.454 -0.252 0 C-N-CA 122.332 0.253 . . . . 0.0 110.442 177.583 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 40.2 t -156.4 168.17 28.18 Favored 'General case' 0 N--CA 1.455 -0.197 0 C-N-CA 122.824 0.45 . . . . 0.0 110.43 -179.26 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 69.1 m -70.82 162.76 28.63 Favored 'General case' 0 N--CA 1.454 -0.273 0 C-N-CA 122.683 0.393 . . . . 0.0 110.188 179.284 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -66.3 104.8 1.27 Allowed 'General case' 0 N--CA 1.451 -0.393 0 N-CA-C 110.285 -0.265 . . . . 0.0 110.285 179.689 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 90' ' ' LYS . . . . . 0.504 ' HE3' ' HA ' ' A' ' 90' ' ' LYS . 0.0 OUTLIER -140.65 141.1 23.82 Favored Pre-proline 0 N--CA 1.454 -0.274 0 N-CA-C 108.729 -0.841 . . . . 0.0 108.729 178.091 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 57.5 Cg_exo -54.31 153.6 21.66 Favored 'Trans proline' 0 N--CA 1.452 -0.959 0 C-N-CA 123.036 2.491 . . . . 0.0 111.154 176.218 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 90.52 16.55 54.95 Favored Glycine 0 CA--C 1.523 0.571 0 CA-C-O 119.278 -0.735 . . . . 0.0 112.878 178.539 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 30.9 p -153.04 167.95 27.51 Favored 'General case' 0 CA--C 1.52 -0.202 0 CA-C-N 118.399 1.1 . . . . 0.0 110.591 177.864 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 94' ' ' CYS . . . . . 0.429 ' HB2' HD13 ' A' ' 98' ' ' ILE . 31.1 p -58.34 -24.3 59.33 Favored 'General case' 0 N--CA 1.451 -0.402 0 CA-C-N 115.478 -0.783 . . . . 0.0 110.27 175.561 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -60.9 -59.82 4.77 Favored 'General case' 0 N--CA 1.446 -0.638 0 N-CA-C 109.497 -0.557 . . . . 0.0 109.497 -175.722 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 72.4 t60 -73.56 -32.78 64.35 Favored 'General case' 0 N--CA 1.449 -0.492 0 N-CA-C 110.553 -0.166 . . . . 0.0 110.553 -178.92 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -66.08 -52.53 48.01 Favored 'General case' 0 N--CA 1.453 -0.323 0 N-CA-C 111.836 0.309 . . . . 0.0 111.836 -177.86 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 98' ' ' ILE . . . . . 0.429 HD13 ' HB2' ' A' ' 94' ' ' CYS . 1.8 mp -71.01 -33.87 53.3 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.146 0 O-C-N 121.916 -0.49 . . . . 0.0 109.908 -178.829 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 75.8 m-20 -68.1 -43.37 78.64 Favored 'General case' 0 N--CA 1.45 -0.429 0 CA-C-N 118.242 0.474 . . . . 0.0 111.626 179.34 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 91.3 m -68.32 -37.6 80.75 Favored 'General case' 0 N--CA 1.455 -0.221 0 CA-C-N 117.886 0.312 . . . . 0.0 110.472 -177.579 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 65.2 tp -75.81 -36.73 59.63 Favored 'General case' 0 N--CA 1.451 -0.424 0 CA-C-N 116.661 -0.245 . . . . 0.0 111.283 179.906 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -65.56 -22.78 69.99 Favored Glycine 0 CA--C 1.522 0.527 0 CA-C-O 119.67 -0.517 . . . . 0.0 112.437 -175.187 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 103' ' ' GLU . . . . . 0.44 ' HA ' ' HE3' ' A' ' 139' ' ' LYS . 17.6 mm-40 -72.68 -44.89 61.21 Favored 'General case' 0 N--CA 1.452 -0.359 0 CA-C-N 118.201 1.0 . . . . 0.0 111.873 178.138 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 25.0 m -92.1 -1.6 10.27 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.171 0 O-C-N 123.928 0.767 . . . . 0.0 112.369 -174.63 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 105' ' ' ILE . . . . . . . . . . . . . 10.1 tp -66.68 -25.15 34.15 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.167 0 CA-C-N 118.384 0.538 . . . . 0.0 110.954 -176.25 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 15.2 pt20 -71.76 -34.29 69.36 Favored 'General case' 0 N--CA 1.452 -0.345 0 CA-C-O 119.181 -0.438 . . . . 0.0 109.841 -178.631 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 57.9 mp0 -73.69 -37.96 65.05 Favored 'General case' 0 C--N 1.341 0.203 0 CA-C-N 118.929 0.786 . . . . 0.0 110.38 177.001 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 94.1 mt -71.74 -41.36 68.57 Favored 'General case' 0 N--CA 1.452 -0.343 0 CA-C-O 119.186 -0.435 . . . . 0.0 111.053 -177.568 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 81.5 mt -69.66 -55.62 9.5 Favored 'General case' 0 N--CA 1.45 -0.441 0 C-N-CA 120.494 -0.483 . . . . 0.0 110.146 179.156 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 14.2 p -49.18 -51.76 30.65 Favored 'General case' 0 CA--C 1.52 -0.181 0 CA-C-N 118.243 0.474 . . . . 0.0 111.48 -177.506 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 43.2 t0 -69.0 -31.17 69.8 Favored 'General case' 0 N--CA 1.447 -0.585 0 C-N-CA 120.897 -0.321 . . . . 0.0 110.508 -177.14 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -72.52 -31.27 65.19 Favored 'General case' 0 N--CA 1.448 -0.545 0 C-N-CA 120.822 -0.351 . . . . 0.0 110.496 178.902 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 113' ' ' ILE . . . . . . . . . . . . . 36.5 mm -66.31 -36.89 78.46 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.175 0 N-CA-C 108.317 -0.994 . . . . 0.0 108.317 176.375 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -74.56 -40.08 61.9 Favored 'General case' 0 N--CA 1.454 -0.26 0 N-CA-C 112.205 0.446 . . . . 0.0 112.205 177.92 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -77.24 -36.46 54.54 Favored 'General case' 0 C--N 1.339 0.123 0 N-CA-C 112.531 0.567 . . . . 0.0 112.531 -175.536 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 116' ' ' SER . . . . . 0.516 ' HB2' ' CB ' ' A' ' 120' ' ' HIS . 83.8 p -79.38 153.74 29.52 Favored 'General case' 0 N--CA 1.454 -0.246 0 N-CA-C 112.991 0.737 . . . . 0.0 112.991 -170.952 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 47.2 t30 -75.62 167.43 21.9 Favored 'General case' 0 C--O 1.225 -0.22 0 C-N-CA 123.772 0.829 . . . . 0.0 110.251 -178.611 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 118' ' ' GLN . . . . . . . . . . . . . 59.8 mt-30 -45.87 -55.67 6.38 Favored 'General case' 0 C--N 1.34 0.187 0 C-N-CA 123.478 0.711 . . . . 0.0 111.542 -174.438 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 3.9 p30 -63.15 -36.88 85.1 Favored 'General case' 0 C--O 1.232 0.143 0 C-N-CA 122.778 0.431 . . . . 0.0 110.95 -177.341 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 120' ' ' HIS . . . . . 0.516 ' CB ' ' HB2' ' A' ' 116' ' ' SER . 34.0 m170 -64.93 -39.04 92.9 Favored 'General case' 0 N--CA 1.449 -0.501 0 CA-C-O 119.168 -0.444 . . . . 0.0 110.14 176.441 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 57.6 mttm -57.54 -46.88 83.36 Favored 'General case' 0 C--N 1.342 0.271 0 N-CA-C 109.329 -0.619 . . . . 0.0 109.329 179.285 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 40.1 mm-40 -64.22 -40.53 96.23 Favored 'General case' 0 N--CA 1.452 -0.354 0 C-N-CA 122.397 0.279 . . . . 0.0 111.605 -177.022 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 63.5 mttm -64.35 -29.34 70.41 Favored 'General case' 0 N--CA 1.453 -0.277 0 C-N-CA 120.342 -0.543 . . . . 0.0 110.39 179.594 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 124' ' ' ILE . . . . . . . . . . . . . 51.8 mt -75.77 -33.13 25.3 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.218 0 N-CA-C 109.874 -0.417 . . . . 0.0 109.874 176.0 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 11.3 mmm180 -66.44 -39.06 88.67 Favored 'General case' 0 C--N 1.339 0.147 0 CA-C-N 118.135 0.425 . . . . 0.0 110.466 179.676 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 126' ' ' MET . . . . . . . . . . . . . 27.8 ptm -72.43 -33.28 66.98 Favored 'General case' 0 N--CA 1.455 -0.218 0 C-N-CA 120.314 -0.554 . . . . 0.0 109.674 177.793 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 3.3 mp -64.69 -33.96 77.17 Favored 'General case' 0 N--CA 1.455 -0.212 0 N-CA-C 109.644 -0.502 . . . . 0.0 109.644 175.042 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 31.6 tp -66.4 -42.25 88.12 Favored 'General case' 0 N--CA 1.452 -0.329 0 N-CA-C 110.077 -0.342 . . . . 0.0 110.077 179.134 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 18.0 t0 -64.7 -44.72 89.35 Favored 'General case' 0 N--CA 1.455 -0.218 0 N-CA-C 110.243 -0.281 . . . . 0.0 110.243 177.856 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 59.7 mt -58.79 -35.22 54.83 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.203 0 N-CA-C 110.238 -0.282 . . . . 0.0 110.238 -179.176 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 131' ' ' TRP . . . . . . . . . . . . . 45.6 m0 -75.43 -35.97 60.86 Favored 'General case' 0 N--CA 1.455 -0.182 0 N-CA-C 112.874 0.694 . . . . 0.0 112.874 -179.917 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 65.2 m-20 -67.39 -29.88 69.51 Favored 'General case' 0 N--CA 1.456 -0.139 0 CA-C-N 118.392 0.542 . . . . 0.0 110.112 178.206 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 133' ' ' ARG . . . . . 0.402 ' HB2' HD13 ' B' 2062 ' ' ILE . 17.8 mtp180 -74.76 -31.89 61.92 Favored 'General case' 0 N--CA 1.456 -0.158 0 C-N-CA 123.684 0.794 . . . . 0.0 110.261 175.851 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 32.1 t -75.08 -10.69 59.7 Favored 'General case' 0 CA--C 1.529 0.142 0 C-N-CA 122.928 0.491 . . . . 0.0 112.262 179.012 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 135' ' ' GLY . . . . . . . . . . . . . . . 75.27 12.73 83.36 Favored Glycine 0 CA--C 1.529 0.957 0 CA-C-O 119.472 -0.627 . . . . 0.0 112.782 178.745 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 136' ' ' LEU . . . . . . . . . . . . . 34.0 mt -62.59 146.1 52.78 Favored 'General case' 0 N--CA 1.457 -0.12 0 CA-C-N 118.051 0.926 . . . . 0.0 109.545 178.417 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 137' ' ' PHE . . . . . . . . . . . . . 7.1 m-30 -77.59 30.98 0.15 Allowed 'General case' 0 CA--C 1.53 0.191 0 C-N-CA 123.773 0.829 . . . . 0.0 112.931 -174.87 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 138' ' ' GLN . . . . . 0.432 ' C ' ' H ' ' A' ' 140' ' ' SER . 24.5 mm-40 -68.45 152.54 45.26 Favored 'General case' 0 N--CA 1.456 -0.136 0 CA-C-O 120.776 0.322 . . . . 0.0 111.312 -177.292 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 139' ' ' LYS . . . . . 0.44 ' HE3' ' HA ' ' A' ' 103' ' ' GLU . 98.8 mttt -76.58 30.08 0.13 Allowed 'General case' 0 CA--C 1.531 0.218 0 C-N-CA 123.288 0.635 . . . . 0.0 110.728 174.971 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 140' ' ' SER . . . . . 0.432 ' H ' ' C ' ' A' ' 138' ' ' GLN . 80.5 p -67.51 -0.74 4.06 Favored 'General case' 0 N--CA 1.453 -0.314 0 C-N-CA 123.913 0.885 . . . . 0.0 112.022 -176.938 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 141' ' ' TYR . . . . . . . . . . . . . 50.7 p90 -90.31 -7.72 52.64 Favored 'General case' 0 CA--C 1.535 0.39 0 CA-C-N 118.094 0.406 . . . . 0.0 111.723 176.779 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 142' ' ' LEU . . . . . . . . . . . . . 90.2 mt -82.69 148.77 27.72 Favored 'General case' 0 CA--C 1.529 0.135 0 CA-C-O 121.269 0.556 . . . . 0.0 111.857 -179.821 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 28.7 p-10 -75.11 -17.38 60.44 Favored 'General case' 0 N--CA 1.455 -0.189 0 C-N-CA 123.171 0.588 . . . . 0.0 111.041 178.746 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . -63.71 -29.73 70.92 Favored 'General case' 0 N--CA 1.453 -0.314 0 N-CA-C 110.427 -0.212 . . . . 0.0 110.427 178.336 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 145' ' ' ILE . . . . . . . . . . . . . 32.9 mm -67.6 -25.91 34.17 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.336 0 C-N-CA 122.218 0.207 . . . . 0.0 110.674 178.122 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 146' ' ' ARG . . . . . . . . . . . . . 9.4 mpt_? -79.12 -55.9 4.77 Favored 'General case' 0 N--CA 1.455 -0.182 0 N-CA-C 109.491 -0.559 . . . . 0.0 109.491 178.707 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 147' ' ' SER . . . . . . . . . . . . . 72.4 m 37.69 57.59 1.44 Allowed 'General case' 0 C--N 1.34 0.153 0 C-N-CA 123.597 0.759 . . . . 0.0 111.261 -179.874 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 148' ' ' LYS . . . . . 0.608 ' HD3' ' H ' ' A' ' 148' ' ' LYS . 0.1 OUTLIER -52.87 -17.67 1.51 Allowed 'General case' 0 CA--C 1.53 0.188 0 C-N-CA 123.754 0.821 . . . . 0.0 112.931 -175.818 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 149' ' ' CYS . . . . . . . . . . . . . 66.4 m -59.94 -34.7 73.59 Favored 'General case' 0 N--CA 1.451 -0.401 0 CA-C-N 118.225 0.466 . . . . 0.0 109.961 179.904 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 150' ' ' PHE . . . . . . . . . . . . . 18.3 m-85 -67.25 -14.45 62.93 Favored 'General case' 0 N--CA 1.453 -0.281 0 CA-C-N 117.714 0.234 . . . . 0.0 111.253 -179.721 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 151' ' ' ALA . . . . . . . . . . . . . . . -101.4 -14.73 17.45 Favored 'General case' 0 N--CA 1.454 -0.275 0 C-N-CA 123.088 0.555 . . . . 0.0 111.068 174.896 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 152' ' ' MET . . . . . . . . . . . . . 93.2 mtp -88.7 -26.41 21.83 Favored 'General case' 0 CA--C 1.528 0.106 0 C-N-CA 122.741 0.416 . . . . 0.0 111.445 173.853 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 153' ' ' ASP . . . . . . . . . . . . . 90.9 m-20 -68.34 -21.63 64.73 Favored 'General case' 0 CA--C 1.53 0.194 0 C-N-CA 123.648 0.779 . . . . 0.0 112.29 -179.522 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 154' ' ' LEU . . . . . . . . . . . . . 4.3 pp -134.27 164.35 27.59 Favored 'General case' 0 N--CA 1.447 -0.579 0 C-N-CA 123.92 0.888 . . . . 0.0 110.017 178.745 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 155' ' ' GLU . . . . . . . . . . . . . 2.1 pp20? -69.38 148.68 49.31 Favored 'General case' 0 N--CA 1.455 -0.202 0 CA-C-O 120.661 0.267 . . . . 0.0 110.825 -177.181 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 156' ' ' HIS . . . . . . . . . . . . . 14.0 t-80 -147.82 150.24 33.83 Favored 'General case' 0 N--CA 1.451 -0.394 0 N-CA-C 109.295 -0.631 . . . . 0.0 109.295 175.737 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 157' ' ' HIS . . . . . . . . . . . . . 26.9 m170 -76.9 4.63 9.43 Favored 'General case' 0 N--CA 1.453 -0.281 0 N-CA-C 112.431 0.53 . . . . 0.0 112.431 -171.971 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 158' ' ' HIS . . . . . . . . . . . . . 7.7 p80 -105.61 2.4 28.19 Favored 'General case' 0 CA--C 1.532 0.27 0 CA-C-O 119.427 -0.321 . . . . 0.0 111.392 174.304 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 159' ' ' HIS . . . . . . . . . . . . . 46.4 m170 . . . . . 0 C--O 1.249 1.071 0 CA-C-O 116.656 -1.64 . . . . 0.0 110.117 176.165 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' B' B 2052 ' ' ASP . . . . . . . . . . . . . 11.1 p-10 . . . . . 0 N--CA 1.473 0.695 0 N-CA-C 109.685 -0.487 . . . . 0.0 109.685 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' B' B 2053 ' ' ASP . . . . . 0.505 ' HA ' HD22 ' A' ' 20' ' ' LEU . 0.4 OUTLIER -73.76 138.76 44.77 Favored 'General case' 0 N--CA 1.456 -0.126 0 CA-C-O 120.923 0.392 . . . . 0.0 111.948 -177.676 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' B' B 2054 ' ' ASP . . . . . . . . . . . . . 40.8 p30 -157.34 154.62 29.26 Favored 'General case' 0 N--CA 1.452 -0.354 0 C-N-CA 123.752 0.821 . . . . 0.0 109.547 176.189 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B 2055 ' ' GLU . . . . . . . . . . . . . 60.0 tt0 44.16 41.36 4.17 Favored 'General case' 0 CA--C 1.531 0.241 0 C-N-CA 123.602 0.761 . . . . 0.0 111.718 178.382 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B 2056 ' ' ASP . . . . . . . . . . . . . 51.1 t0 -61.42 138.48 58.26 Favored 'General case' 0 N--CA 1.451 -0.403 0 N-CA-C 108.697 -0.853 . . . . 0.0 108.697 177.436 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B 2057 ' ' ASP . . . . . . . . . . . . . 56.6 t0 49.75 86.55 0.03 OUTLIER 'General case' 0 N--CA 1.455 -0.212 0 C-N-CA 124.938 1.295 . . . . 0.0 111.528 -170.045 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B 2058 ' ' TYR . . . . . . . . . . . . . 2.7 p90 -64.9 0.99 1.0 Allowed 'General case' 0 N--CA 1.455 -0.178 0 N-CA-C 112.419 0.526 . . . . 0.0 112.419 -177.929 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B 2059 ' ' THR . . . . . . . . . . . . . 60.4 m 54.23 77.86 0.42 Allowed Pre-proline 0 N--CA 1.455 -0.216 0 C-N-CA 124.362 1.065 . . . . 0.0 111.072 177.224 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B 2060 ' ' PRO . . . . . . . . . . . . . 61.3 Cg_endo -66.62 156.2 66.77 Favored 'Trans proline' 0 N--CA 1.45 -1.066 0 C-N-CA 123.43 2.753 . . . . 0.0 111.209 -179.231 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B 2061 ' ' SER . . . . . . . . . . . . . 46.0 t -152.36 154.46 35.67 Favored 'General case' 0 N--CA 1.455 -0.176 0 C-N-CA 123.231 0.612 . . . . 0.0 109.934 179.454 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B 2062 ' ' ILE . . . . . 0.402 HD13 ' HB2' ' A' ' 133' ' ' ARG . 14.2 tt -162.85 151.68 3.48 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.309 0 C-N-CA 123.122 0.569 . . . . 0.0 109.904 -176.91 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B 2063 ' ' SER . . . . . . . . . . . . . 93.1 p . . . . . 0 C--O 1.25 1.079 0 CA-C-O 117.618 -1.182 . . . . 0.0 109.282 174.334 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 68.0 mtm . . . . . 0 N--CA 1.475 0.813 0 N-CA-C 109.854 -0.425 . . . . 0.0 109.854 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 58.1 mm-40 -97.82 -170.02 1.92 Allowed 'General case' 0 C--N 1.333 -0.131 0 N-CA-C 108.101 -1.074 . . . . 0.0 108.101 175.785 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 14.0 pt20 -63.64 -20.27 65.55 Favored 'General case' 0 CA--C 1.53 0.176 0 N-CA-C 109.426 -0.583 . . . . 0.0 109.426 174.072 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 11.8 p30 -156.18 126.28 6.53 Favored 'General case' 0 N--CA 1.449 -0.508 0 C-N-CA 124.463 1.105 . . . . 0.0 108.67 176.78 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 68.0 m-20 -90.97 17.84 7.42 Favored 'General case' 0 CA--C 1.522 -0.103 0 N-CA-C 112.998 0.74 . . . . 0.0 112.998 -177.179 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 21.2 p-10 -73.91 -29.73 62.2 Favored 'General case' 0 N--CA 1.455 -0.196 0 N-CA-C 108.549 -0.908 . . . . 0.0 108.549 178.156 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 7' ' ' PHE . . . . . 0.445 ' CD1' ' HD3' ' A' ' 45' ' ' LYS . 1.0 OUTLIER -55.35 -33.06 63.05 Favored 'General case' 0 N--CA 1.447 -0.606 0 C-N-CA 125.584 1.554 . . . . 0.0 111.462 -177.253 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 51.1 tp60 -51.8 -36.89 49.37 Favored 'General case' 0 N--CA 1.454 -0.272 0 C-N-CA 123.201 0.601 . . . . 0.0 112.21 -176.993 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 27.6 m-80 -71.29 -36.22 71.59 Favored 'General case' 0 N--CA 1.455 -0.223 0 CA-C-O 121.175 0.512 . . . . 0.0 110.016 -179.437 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 10' ' ' PHE . . . . . 0.424 ' CE2' ' HB2' ' A' ' 32' ' ' LEU . 7.1 t80 -69.96 -39.8 75.8 Favored 'General case' 0 N--CA 1.451 -0.408 0 C-N-CA 124.05 0.94 . . . . 0.0 109.349 177.139 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 83.2 t -66.17 -51.72 56.2 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.493 0 N-CA-C 109.042 -0.725 . . . . 0.0 109.042 179.693 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -59.45 -32.12 69.93 Favored 'General case' 0 CA--C 1.53 0.175 0 C-N-CA 122.508 0.323 . . . . 0.0 111.381 -179.422 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 85.5 m -71.55 -39.53 70.62 Favored 'General case' 0 CA--C 1.531 0.246 0 N-CA-C 109.025 -0.732 . . . . 0.0 109.025 176.484 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.552 ' HA ' ' CD1' ' A' ' 17' ' ' PHE . 4.9 tp -64.84 -42.15 95.14 Favored 'General case' 0 N--CA 1.45 -0.471 0 CA-C-O 121.215 0.531 . . . . 0.0 110.208 178.624 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 69.0 mm-40 -63.83 -28.06 69.6 Favored 'General case' 0 N--CA 1.45 -0.469 0 C-N-CA 124.762 1.225 . . . . 0.0 109.337 178.09 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 43.6 t -70.23 -27.35 64.4 Favored 'General case' 0 N--CA 1.449 -0.516 0 N-CA-C 110.417 -0.216 . . . . 0.0 110.417 174.942 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 17' ' ' PHE . . . . . 0.582 ' CE1' HD11 ' A' ' 68' ' ' ILE . 21.8 m-85 -71.42 -41.1 69.95 Favored 'General case' 0 C--N 1.338 0.108 0 C-N-CA 119.335 -0.946 . . . . 0.0 110.879 170.441 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . 0.529 ' HG2' ' CE1' ' A' ' 53' ' ' TYR . 65.9 mttt -60.62 -25.55 66.36 Favored 'General case' 0 C--N 1.34 0.19 0 CA-C-N 118.138 0.426 . . . . 0.0 111.008 175.799 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 10.6 t0 -72.47 -47.06 51.78 Favored 'General case' 0 C--N 1.331 -0.22 0 C-N-CA 123.231 0.612 . . . . 0.0 110.26 178.784 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 63.3 mt -66.78 136.31 55.28 Favored 'General case' 0 N--CA 1.453 -0.306 0 CA-C-O 120.967 0.413 . . . . 0.0 110.405 -178.769 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 1.2 mppt? -75.3 -24.24 57.46 Favored 'General case' 0 N--CA 1.454 -0.236 0 N-CA-C 109.105 -0.702 . . . . 0.0 109.105 177.35 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 80.7 p -80.94 -23.4 38.87 Favored 'General case' 0 N--CA 1.457 -0.119 0 C-N-CA 123.773 0.829 . . . . 0.0 110.391 175.845 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 72.35 -33.73 0.67 Allowed Glycine 0 CA--C 1.526 0.728 0 C-N-CA 124.846 1.212 . . . . 0.0 112.938 178.239 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 63.0 mt -76.16 147.38 7.89 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.333 0 CA-C-N 117.528 0.664 . . . . 0.0 110.109 178.112 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 32.9 t -162.37 94.2 0.88 Allowed 'General case' 0 N--CA 1.455 -0.198 0 N-CA-C 109.058 -0.719 . . . . 0.0 109.058 171.67 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . 0.429 ' O ' ' HE2' ' A' ' 30' ' ' LYS . . . -55.28 -38.33 67.95 Favored Glycine 0 CA--C 1.524 0.613 0 C-N-CA 121.12 -0.562 . . . . 0.0 111.91 -172.426 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . 0.524 ' H ' ' HB2' ' B' 2055 ' ' GLU . 74.7 p -71.71 -48.66 45.69 Favored 'General case' 0 N--CA 1.452 -0.354 0 CA-C-N 118.21 1.005 . . . . 0.0 110.898 -177.196 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . 0.407 HH12 ' CG ' ' B' 2054 ' ' ASP . 71.5 mmt-85 -65.53 -38.56 90.0 Favored 'General case' 0 C--O 1.233 0.2 0 N-CA-C 109.617 -0.512 . . . . 0.0 109.617 -179.637 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 47.9 mt -59.96 -44.41 94.49 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.814 0 N-CA-C 108.71 -0.848 . . . . 0.0 108.71 176.06 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . 0.432 ' HE3' ' HA ' ' A' ' 27' ' ' SER . 49.2 mtmt -66.17 -25.79 67.12 Favored 'General case' 0 C--N 1.34 0.166 0 CA-C-O 118.727 -0.654 . . . . 0.0 111.562 177.635 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . 0.565 ' HA ' ' HE2' ' A' ' 31' ' ' LYS . 8.9 mmpt? -66.88 -57.97 5.93 Favored 'General case' 0 C--N 1.341 0.214 0 CA-C-N 119.433 1.015 . . . . 0.0 109.95 179.435 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.528 HD12 ' N ' ' A' ' 33' ' ' THR . 1.4 pp -75.1 -20.07 59.64 Favored 'General case' 0 CA--C 1.53 0.194 0 C-N-CA 118.929 -1.109 . . . . 0.0 111.917 -176.782 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . 0.528 ' N ' HD12 ' A' ' 32' ' ' LEU . 54.3 m -71.16 -38.28 72.2 Favored 'General case' 0 N--CA 1.452 -0.366 0 N-CA-C 108.626 -0.879 . . . . 0.0 108.626 175.548 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 63.8 m -69.76 -37.37 76.4 Favored 'General case' 0 N--CA 1.45 -0.431 0 N-CA-C 110.032 -0.358 . . . . 0.0 110.032 -178.949 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 72.8 t80 -67.39 -33.81 75.96 Favored 'General case' 0 N--CA 1.455 -0.18 0 C-N-CA 120.279 -0.569 . . . . 0.0 110.248 177.42 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -69.47 -37.11 77.13 Favored 'General case' 0 N--CA 1.45 -0.472 0 CA-C-N 116.627 -0.261 . . . . 0.0 110.588 178.207 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 2.9 mm? -71.23 -34.5 70.84 Favored 'General case' 0 N--CA 1.456 -0.154 0 C-N-CA 122.478 0.311 . . . . 0.0 110.227 179.781 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 45.5 t0 -67.17 -26.49 66.67 Favored 'General case' 0 N--CA 1.453 -0.297 0 C-N-CA 122.315 0.246 . . . . 0.0 110.475 176.289 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 39' ' ' HIS . . . . . 0.403 ' HB2' HD11 ' A' ' 42' ' ' ILE . 97.1 m-70 -149.0 100.29 3.05 Favored 'General case' 0 C--N 1.341 0.197 0 N-CA-C 111.82 0.304 . . . . 0.0 111.82 -175.737 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 40' ' ' ILE . . . . . 0.621 ' H ' HD13 ' A' ' 40' ' ' ILE . 0.0 OUTLIER -75.65 -13.49 15.06 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.488 0 CA-C-O 119.158 -0.449 . . . . 0.0 110.061 174.116 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 32.6 m-20 -58.15 -16.68 14.29 Favored 'General case' 0 CA--C 1.532 0.286 0 C-N-CA 123.124 0.57 . . . . 0.0 112.11 -176.07 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . 0.403 HD11 ' HB2' ' A' ' 39' ' ' HIS . 0.0 OUTLIER -113.65 19.17 7.24 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.177 0 C-N-CA 123.41 0.684 . . . . 0.0 111.834 176.903 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 2.9 pp20? -54.02 -28.84 40.8 Favored 'General case' 0 C--N 1.339 0.131 0 O-C-N 121.544 -0.722 . . . . 0.0 111.693 179.175 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 3.9 m -67.31 -44.04 80.14 Favored 'General case' 0 N--CA 1.454 -0.231 0 O-C-N 121.962 -0.461 . . . . 0.0 111.518 -176.662 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . 0.445 ' HD3' ' CD1' ' A' ' 7' ' ' PHE . 16.6 ptpt -73.73 -27.47 61.2 Favored 'General case' 0 C--N 1.341 0.206 0 CA-C-N 118.699 0.681 . . . . 0.0 109.789 177.56 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 64.0 mt -71.45 -53.88 19.26 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.274 0 C-N-CA 123.102 0.561 . . . . 0.0 110.721 -178.29 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 34.0 mm -68.18 -39.82 81.84 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.351 0 C-N-CA 122.381 0.272 . . . . 0.0 110.313 -176.49 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 66.0 p -68.15 -33.55 74.68 Favored 'General case' 0 N--CA 1.452 -0.347 0 C-N-CA 120.219 -0.592 . . . . 0.0 110.54 179.922 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 48.4 tp -75.21 -35.13 61.52 Favored 'General case' 0 N--CA 1.453 -0.286 0 N-CA-C 113.033 0.753 . . . . 0.0 113.033 -177.823 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . 0.443 HD12 HG12 ' A' ' 69' ' ' ILE . 3.4 pt -73.06 -42.61 59.21 Favored 'Isoleucine or valine' 0 CA--C 1.526 0.041 0 CA-C-N 118.788 0.722 . . . . 0.0 111.137 179.311 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 21.8 pt -65.79 -39.17 84.01 Favored 'Isoleucine or valine' 0 CA--C 1.528 0.112 0 C-N-CA 119.649 -0.821 . . . . 0.0 110.708 177.707 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 84.8 m-20 -68.79 -35.44 77.04 Favored 'General case' 0 N--CA 1.453 -0.325 0 CA-C-N 118.248 0.476 . . . . 0.0 111.279 177.901 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 53' ' ' TYR . . . . . 0.529 ' CE1' ' HG2' ' A' ' 18' ' ' LYS . 7.7 t80 -62.02 -45.33 94.04 Favored 'General case' 0 N--CA 1.453 -0.301 0 N-CA-C 108.501 -0.926 . . . . 0.0 108.501 174.781 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 20.5 m -63.27 -33.93 76.58 Favored 'General case' 0 N--CA 1.454 -0.232 0 C-N-CA 123.258 0.623 . . . . 0.0 111.99 -175.193 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 64.6 mtm180 -79.0 -42.65 26.1 Favored 'General case' 0 N--CA 1.455 -0.201 0 N-CA-C 111.883 0.327 . . . . 0.0 111.883 -176.685 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 45.2 mt -77.47 -43.29 32.81 Favored 'General case' 0 N--CA 1.457 -0.08 0 N-CA-C 112.309 0.485 . . . . 0.0 112.309 -177.743 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 57' ' ' CYS . . . . . 0.461 ' HB2' ' HD2' ' A' ' 58' ' ' PRO . 10.6 p -67.49 161.42 65.37 Favored Pre-proline 0 CA--C 1.532 0.264 0 N-CA-C 113.049 0.759 . . . . 0.0 113.049 -173.489 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 58' ' ' PRO . . . . . 0.461 ' HD2' ' HB2' ' A' ' 57' ' ' CYS . 86.3 Cg_endo -72.89 179.25 5.5 Favored 'Trans proline' 0 N--CA 1.454 -0.823 0 C-N-CA 124.249 3.299 . . . . 0.0 110.59 174.614 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 59' ' ' ASP . . . . . 0.493 ' CG ' ' HA ' ' A' ' 116' ' ' SER . 49.9 t0 -55.37 -52.52 63.24 Favored 'General case' 0 N--CA 1.453 -0.311 0 N-CA-C 113.958 1.095 . . . . 0.0 113.958 -173.479 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 97.4 p -63.4 -39.61 94.96 Favored 'General case' 0 C--O 1.231 0.131 0 CA-C-N 119.091 0.86 . . . . 0.0 110.545 -174.297 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 49.6 m170 -66.11 -34.71 78.67 Favored 'General case' 0 N--CA 1.452 -0.348 0 N-CA-C 109.666 -0.494 . . . . 0.0 109.666 175.54 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . 0.599 ' HE3' HD11 ' A' ' 124' ' ' ILE . 0.0 OUTLIER -72.36 -32.1 66.18 Favored 'General case' 0 N--CA 1.453 -0.283 0 C-N-CA 122.893 0.477 . . . . 0.0 111.954 -178.464 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 1.7 tm? -75.29 -35.11 61.34 Favored 'General case' 0 CA--C 1.532 0.276 0 N-CA-C 107.783 -1.192 . . . . 0.0 107.783 178.699 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -71.49 -31.64 65.42 Favored Glycine 0 CA--C 1.526 0.77 0 N-CA-C 111.601 -0.6 . . . . 0.0 111.601 176.449 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 65' ' ' SER . . . . . 0.453 ' HA ' HD12 ' A' ' 68' ' ' ILE . 82.6 p -71.96 -31.47 66.33 Favored 'General case' 0 N--CA 1.451 -0.401 0 O-C-N 121.822 -0.81 . . . . 0.0 109.882 177.797 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 76.8 mt -75.05 -25.08 58.4 Favored 'General case' 0 N--CA 1.455 -0.222 0 CA-C-O 119.568 -0.253 . . . . 0.0 110.413 174.781 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 4.1 m-30 -66.5 -36.26 82.29 Favored 'General case' 0 CA--C 1.516 -0.341 0 N-CA-C 109.453 -0.573 . . . . 0.0 109.453 172.465 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 68' ' ' ILE . . . . . 0.582 HD11 ' CE1' ' A' ' 17' ' ' PHE . 41.0 mt -68.32 -55.82 14.86 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.567 0 N-CA-C 108.758 -0.83 . . . . 0.0 108.758 178.03 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 69' ' ' ILE . . . . . 0.443 HG12 HD12 ' A' ' 50' ' ' ILE . 61.9 mt -47.87 -37.67 6.45 Favored 'Isoleucine or valine' 0 C--N 1.343 0.297 0 C-N-CA 124.089 0.956 . . . . 0.0 111.742 176.016 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 15.4 t70 -70.4 -44.07 68.73 Favored 'General case' 0 C--O 1.233 0.203 0 CA-C-N 118.557 0.617 . . . . 0.0 110.881 178.976 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 20.4 m -68.97 -52.32 30.2 Favored 'General case' 0 N--CA 1.455 -0.183 0 N-CA-C 110.202 -0.296 . . . . 0.0 110.202 -175.46 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 72' ' ' ILE . . . . . 0.476 HD11 ' CZ ' ' A' ' 76' ' ' TYR . 0.0 OUTLIER -73.97 -31.04 29.28 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.403 0 N-CA-C 109.68 -0.489 . . . . 0.0 109.68 -176.403 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -68.76 -53.84 17.87 Favored Glycine 0 C--N 1.338 0.694 0 N-CA-C 111.695 -0.562 . . . . 0.0 111.695 -175.458 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 37.8 mtm105 -68.5 -39.5 81.24 Favored 'General case' 0 N--CA 1.452 -0.335 0 C-N-CA 120.672 -0.411 . . . . 0.0 110.157 179.844 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -65.26 -30.9 71.81 Favored 'General case' 0 N--CA 1.451 -0.386 0 C-N-CA 120.457 -0.497 . . . . 0.0 110.755 -179.183 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 76' ' ' TYR . . . . . 0.476 ' CZ ' HD11 ' A' ' 72' ' ' ILE . 1.4 m-30 -68.23 -48.06 66.14 Favored 'General case' 0 CA--C 1.517 -0.318 0 CA-C-N 118.225 0.466 . . . . 0.0 110.779 176.358 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 51.3 tp -68.59 -37.25 79.69 Favored 'General case' 0 N--CA 1.448 -0.534 0 C-N-CA 118.617 -1.233 . . . . 0.0 110.021 -177.669 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 96.5 m-20 -67.87 -40.27 83.61 Favored 'General case' 0 C--N 1.333 -0.139 0 N-CA-C 113.273 0.842 . . . . 0.0 113.273 -179.584 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 13.6 mm-40 -65.8 -48.37 71.97 Favored 'General case' 0 N--CA 1.456 -0.175 0 C-N-CA 119.917 -0.713 . . . . 0.0 110.336 174.06 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 80' ' ' THR . . . . . 0.447 HG21 ' HB3' ' A' ' 94' ' ' CYS . 76.5 p -66.53 -26.86 67.35 Favored 'General case' 0 CA--C 1.529 0.145 0 CA-C-N 118.505 0.593 . . . . 0.0 111.251 -179.632 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 74.7 mtt180 -65.41 -37.75 87.88 Favored 'General case' 0 C--N 1.338 0.067 0 C-N-CA 122.717 0.407 . . . . 0.0 110.393 170.858 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 20.7 m -79.82 -41.95 25.36 Favored 'General case' 0 N--CA 1.452 -0.326 0 N-CA-C 112.07 0.396 . . . . 0.0 112.07 -176.645 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -167.22 155.84 9.86 Favored 'General case' 0 C--O 1.226 -0.164 0 C-N-CA 122.858 0.463 . . . . 0.0 110.974 -177.171 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 78.9 p -84.39 94.63 8.54 Favored 'General case' 0 N--CA 1.454 -0.265 0 N-CA-C 109.094 -0.706 . . . . 0.0 109.094 175.241 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 2.0 m120 -69.0 -13.94 62.75 Favored 'General case' 0 CA--C 1.532 0.278 0 C-N-CA 122.361 0.264 . . . . 0.0 111.583 -179.431 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 45.7 t -160.8 173.16 15.78 Favored 'General case' 0 N--CA 1.453 -0.28 0 C-N-CA 123.425 0.69 . . . . 0.0 109.487 -179.699 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 26.6 m -144.61 145.72 31.93 Favored 'General case' 0 N--CA 1.455 -0.183 0 C-N-CA 123.252 0.621 . . . . 0.0 109.941 -179.428 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 35.1 t -163.86 168.32 19.66 Favored 'General case' 0 N--CA 1.453 -0.275 0 C-N-CA 122.608 0.363 . . . . 0.0 110.263 -176.238 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 7.5 m120 -69.15 -34.86 75.66 Favored 'General case' 0 N--CA 1.454 -0.263 0 C-N-CA 122.462 0.305 . . . . 0.0 111.707 -178.312 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 90' ' ' LYS . . . . . 0.411 ' HB3' ' CD ' ' A' ' 91' ' ' PRO . 29.9 tptp -161.32 -64.28 0.02 OUTLIER Pre-proline 0 CA--C 1.535 0.379 0 CA-C-O 118.265 -0.874 . . . . 0.0 111.7 176.013 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 91' ' ' PRO . . . . . 0.411 ' CD ' ' HB3' ' A' ' 90' ' ' LYS . 91.0 Cg_endo -71.77 159.72 49.95 Favored 'Trans proline' 0 N--CA 1.454 -0.83 0 C-N-CA 122.527 2.152 . . . . 0.0 108.951 176.913 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 92' ' ' GLY . . . . . 0.413 ' HA2' ' O ' ' A' ' 40' ' ' ILE . . . 97.73 16.65 33.09 Favored Glycine 0 CA--C 1.527 0.842 0 CA-C-O 119.507 -0.607 . . . . 0.0 113.793 179.944 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 21.9 p -152.22 169.36 22.66 Favored 'General case' 0 C--O 1.231 0.099 0 CA-C-N 118.14 0.97 . . . . 0.0 110.508 178.179 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 94' ' ' CYS . . . . . 0.478 ' HB2' HD13 ' A' ' 98' ' ' ILE . 30.0 p -57.8 -23.24 51.52 Favored 'General case' 0 N--CA 1.449 -0.514 0 CA-C-N 115.956 -0.565 . . . . 0.0 109.64 175.88 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -60.38 -55.84 28.68 Favored 'General case' 0 N--CA 1.446 -0.659 0 N-CA-C 109.358 -0.608 . . . . 0.0 109.358 -178.013 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 53.9 t60 -76.06 -29.5 58.04 Favored 'General case' 0 N--CA 1.451 -0.401 0 N-CA-C 111.608 0.225 . . . . 0.0 111.608 179.997 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -67.58 -49.46 63.04 Favored 'General case' 0 N--CA 1.448 -0.528 0 N-CA-C 110.493 -0.188 . . . . 0.0 110.493 -178.596 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 98' ' ' ILE . . . . . 0.478 HD13 ' HB2' ' A' ' 94' ' ' CYS . 2.1 mp -72.47 -26.84 24.83 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.313 0 C-N-CA 120.546 -0.461 . . . . 0.0 110.062 178.78 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 3.7 m120 -63.69 -45.0 92.02 Favored 'General case' 0 N--CA 1.454 -0.264 0 CA-C-N 118.912 0.778 . . . . 0.0 110.193 173.251 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 85.0 m -65.04 -35.5 81.38 Favored 'General case' 0 N--CA 1.455 -0.189 0 C-N-CA 122.705 0.402 . . . . 0.0 110.967 -176.395 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 93.3 mt -75.74 -35.36 60.24 Favored 'General case' 0 N--CA 1.448 -0.559 0 N-CA-C 110.501 -0.185 . . . . 0.0 110.501 176.461 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -75.44 -30.23 58.73 Favored Glycine 0 CA--C 1.527 0.813 0 CA-C-O 119.785 -0.453 . . . . 0.0 112.941 -175.843 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 25.8 pt-20 -75.99 -6.11 49.43 Favored 'General case' 0 CA--C 1.53 0.183 0 CA-C-N 117.856 0.828 . . . . 0.0 111.926 -177.348 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 27.0 m -140.17 21.04 0.56 Allowed 'Isoleucine or valine' 0 CA--C 1.531 0.218 0 CA-C-N 118.102 0.41 . . . . 0.0 111.064 175.524 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 105' ' ' ILE . . . . . . . . . . . . . 10.0 tp -62.05 -39.21 82.95 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.288 0 CA-C-N 118.033 0.379 . . . . 0.0 111.768 -173.958 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 13.3 pt20 -73.86 -31.08 63.0 Favored 'General case' 0 N--CA 1.454 -0.228 0 O-C-N 122.009 -0.432 . . . . 0.0 110.19 -179.421 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 58.7 mm-40 -76.11 -41.42 50.28 Favored 'General case' 0 N--CA 1.454 -0.258 0 CA-C-N 117.743 0.247 . . . . 0.0 110.467 -179.863 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 65.7 tp -70.32 -38.49 74.94 Favored 'General case' 0 N--CA 1.45 -0.463 0 C-N-CA 122.657 0.383 . . . . 0.0 110.61 -177.775 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 88.5 mt -73.44 -42.51 61.9 Favored 'General case' 0 N--CA 1.453 -0.31 0 C-N-CA 120.692 -0.403 . . . . 0.0 110.16 177.386 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 45.6 t -58.07 -43.96 87.26 Favored 'General case' 0 N--CA 1.456 -0.129 0 CA-C-N 118.187 0.449 . . . . 0.0 110.465 178.753 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 55.0 t0 -64.48 -39.72 94.33 Favored 'General case' 0 N--CA 1.453 -0.299 0 N-CA-C 108.682 -0.859 . . . . 0.0 108.682 175.59 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 112' ' ' ALA . . . . . 0.428 ' HA ' ' HD2' ' A' ' 62' ' ' LYS . . . -66.39 -38.32 87.26 Favored 'General case' 0 N--CA 1.444 -0.742 0 N-CA-C 112.202 0.445 . . . . 0.0 112.202 -175.89 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 113' ' ' ILE . . . . . 0.451 HG22 ' HE3' ' A' ' 121' ' ' LYS . 9.3 mm -71.83 -38.99 67.26 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.287 0 CA-C-N 118.462 0.574 . . . . 0.0 109.809 179.816 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -71.26 -35.44 71.4 Favored 'General case' 0 CA--C 1.531 0.23 0 N-CA-C 112.247 0.462 . . . . 0.0 112.247 178.916 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 5.2 tppp? -74.15 -32.91 63.33 Favored 'General case' 0 N--CA 1.456 -0.141 0 C-N-CA 123.004 0.522 . . . . 0.0 110.779 178.436 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 116' ' ' SER . . . . . 0.493 ' HA ' ' CG ' ' A' ' 59' ' ' ASP . 94.4 p -90.93 142.86 27.32 Favored 'General case' 0 N--CA 1.452 -0.37 0 N-CA-C 113.188 0.811 . . . . 0.0 113.188 -169.972 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 14.0 t-20 -76.82 170.53 16.3 Favored 'General case' 0 N--CA 1.454 -0.23 0 N-CA-C 109.013 -0.736 . . . . 0.0 109.013 173.456 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 118' ' ' GLN . . . . . . . . . . . . . 13.9 mm100 -58.88 -32.2 69.27 Favored 'General case' 0 CA--C 1.528 0.097 0 N-CA-C 112.489 0.551 . . . . 0.0 112.489 -170.859 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 10.5 t0 -63.22 -51.81 64.78 Favored 'General case' 0 C--O 1.233 0.221 0 CA-C-O 121.508 0.671 . . . . 0.0 109.257 175.572 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 120' ' ' HIS . . . . . 0.404 ' HB2' ' HB2' ' A' ' 116' ' ' SER . 98.5 m-70 -72.83 -25.44 61.13 Favored 'General case' 0 N--CA 1.447 -0.595 0 CA-C-N 116.046 -0.524 . . . . 0.0 111.098 -177.555 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 121' ' ' LYS . . . . . 0.451 ' HE3' HG22 ' A' ' 113' ' ' ILE . 56.3 mttp -61.44 -44.65 96.75 Favored 'General case' 0 C--N 1.338 0.073 0 N-CA-C 108.973 -0.751 . . . . 0.0 108.973 172.012 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 41.0 tp10 -67.63 -35.78 79.56 Favored 'General case' 0 N--CA 1.454 -0.246 0 C-N-CA 122.185 0.194 . . . . 0.0 111.123 -177.223 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 43.7 mtmt -71.21 -30.23 66.12 Favored 'General case' 0 N--CA 1.454 -0.246 0 O-C-N 122.129 -0.357 . . . . 0.0 110.537 178.147 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 124' ' ' ILE . . . . . 0.599 HD11 ' HE3' ' A' ' 62' ' ' LYS . 56.4 mt -68.8 -37.69 77.78 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.195 0 N-CA-C 108.891 -0.781 . . . . 0.0 108.891 171.802 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 125' ' ' ARG . . . . . 0.422 ' HA ' ' HD2' ' A' ' 125' ' ' ARG . 6.1 mmm180 -61.5 -45.33 94.65 Favored 'General case' 0 N--CA 1.453 -0.284 0 CA-C-O 118.717 -0.659 . . . . 0.0 111.476 -179.606 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 126' ' ' MET . . . . . . . . . . . . . 28.5 ptm -64.85 -34.34 78.15 Favored 'General case' 0 N--CA 1.455 -0.176 0 C-N-CA 119.187 -1.005 . . . . 0.0 108.923 177.712 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 3.6 mp -64.41 -39.82 94.59 Favored 'General case' 0 CA--C 1.531 0.224 0 CA-C-N 118.317 0.508 . . . . 0.0 110.873 175.742 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 81.3 mt -70.23 -30.59 67.71 Favored 'General case' 0 N--CA 1.454 -0.263 0 CA-C-N 118.404 0.547 . . . . 0.0 111.191 179.755 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 48.5 m-20 -73.97 -35.86 64.52 Favored 'General case' 0 N--CA 1.456 -0.143 0 N-CA-C 109.951 -0.389 . . . . 0.0 109.951 176.102 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 60.1 mt -62.15 -35.8 70.87 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.22 0 N-CA-C 109.133 -0.691 . . . . 0.0 109.133 175.273 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 131' ' ' TRP . . . . . . . . . . . . . 43.3 m0 -73.14 -34.74 66.26 Favored 'General case' 0 N--CA 1.455 -0.21 0 N-CA-C 112.975 0.732 . . . . 0.0 112.975 179.536 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 96.0 m-20 -64.92 -35.59 81.65 Favored 'General case' 0 C--N 1.339 0.149 0 CA-C-N 118.767 0.712 . . . . 0.0 110.388 176.19 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 12.6 mtp180 -74.65 -32.02 62.14 Favored 'General case' 0 N--CA 1.456 -0.171 0 C-N-CA 122.99 0.516 . . . . 0.0 110.346 179.486 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 41.3 m -77.51 -14.65 59.62 Favored 'General case' 0 N--CA 1.452 -0.331 0 C-N-CA 123.043 0.537 . . . . 0.0 111.662 179.797 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 135' ' ' GLY . . . . . . . . . . . . . . . 66.26 15.18 62.93 Favored Glycine 0 CA--C 1.529 0.922 0 CA-C-O 119.487 -0.618 . . . . 0.0 111.571 -179.699 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 136' ' ' LEU . . . . . . . . . . . . . 3.0 tt -66.44 -52.47 46.05 Favored 'General case' 0 N--CA 1.454 -0.235 0 CA-C-N 117.826 0.813 . . . . 0.0 109.088 -178.496 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 137' ' ' PHE . . . . . . . . . . . . . 69.7 t80 -161.34 142.67 11.5 Favored 'General case' 0 N--CA 1.45 -0.447 0 N-CA-C 108.252 -1.018 . . . . 0.0 108.252 174.922 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 138' ' ' GLN . . . . . . . . . . . . . 22.6 mp0 -74.31 139.3 44.1 Favored 'General case' 0 N--CA 1.454 -0.271 0 CA-C-O 120.826 0.346 . . . . 0.0 110.749 -176.581 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 139' ' ' LYS . . . . . . . . . . . . . 4.5 ttmp? -55.44 131.05 44.99 Favored 'General case' 0 N--CA 1.452 -0.364 0 C-N-CA 123.63 0.772 . . . . 0.0 109.816 176.1 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 140' ' ' SER . . . . . . . . . . . . . 46.9 t -74.15 154.93 38.89 Favored 'General case' 0 N--CA 1.454 -0.269 0 C-N-CA 122.631 0.372 . . . . 0.0 110.211 179.447 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 141' ' ' TYR . . . . . . . . . . . . . 55.4 p90 -128.01 6.15 5.98 Favored 'General case' 0 N--CA 1.455 -0.186 0 N-CA-C 112.099 0.407 . . . . 0.0 112.099 -175.406 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 142' ' ' LEU . . . . . . . . . . . . . 10.0 mp -69.3 151.71 45.89 Favored 'General case' 0 N--CA 1.454 -0.233 0 N-CA-C 109.427 -0.582 . . . . 0.0 109.427 -179.877 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 16.2 p30 -65.43 -12.19 49.97 Favored 'General case' 0 N--CA 1.453 -0.279 0 CA-C-N 116.48 -0.327 . . . . 0.0 111.088 -179.336 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . -64.37 -38.02 89.58 Favored 'General case' 0 N--CA 1.451 -0.4 0 N-CA-C 109.128 -0.693 . . . . 0.0 109.128 174.04 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 145' ' ' ILE . . . . . . . . . . . . . 26.1 mm -68.26 -40.32 82.45 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.418 0 N-CA-C 109.124 -0.695 . . . . 0.0 109.124 176.474 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 146' ' ' ARG . . . . . . . . . . . . . 32.3 tpt180 -59.45 -29.95 68.15 Favored 'General case' 0 N--CA 1.456 -0.129 0 C-N-CA 123.002 0.521 . . . . 0.0 110.391 -177.195 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 147' ' ' SER . . . . . . . . . . . . . 17.7 m 49.15 35.95 8.15 Favored 'General case' 0 C--N 1.339 0.129 0 C-N-CA 123.187 0.595 . . . . 0.0 111.534 174.715 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 148' ' ' LYS . . . . . 0.63 ' HD3' ' H ' ' A' ' 148' ' ' LYS . 0.0 OUTLIER -40.67 -41.87 1.6 Allowed 'General case' 0 CA--C 1.531 0.227 0 C-N-CA 124.867 1.267 . . . . 0.0 113.279 -172.762 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 149' ' ' CYS . . . . . . . . . . . . . 59.7 m -70.1 -64.72 0.83 Allowed 'General case' 0 N--CA 1.454 -0.271 0 CA-C-N 118.392 0.542 . . . . 0.0 110.783 -177.97 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 150' ' ' PHE . . . . . . . . . . . . . 45.8 m-85 -62.82 -22.33 66.57 Favored 'General case' 0 N--CA 1.455 -0.223 0 N-CA-C 111.53 0.196 . . . . 0.0 111.53 -175.28 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 151' ' ' ALA . . . . . . . . . . . . . . . -75.72 -41.1 54.39 Favored 'General case' 0 N--CA 1.452 -0.344 0 C-N-CA 121.298 -0.161 . . . . 0.0 110.995 177.208 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 152' ' ' MET . . . . . . . . . . . . . 94.6 mtp -76.82 -22.74 53.17 Favored 'General case' 0 CA--C 1.529 0.152 0 N-CA-C 112.088 0.403 . . . . 0.0 112.088 178.884 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 153' ' ' ASP . . . . . . . . . . . . . 80.6 m-20 -69.61 -14.75 62.99 Favored 'General case' 0 CA--C 1.529 0.142 0 N-CA-C 112.659 0.614 . . . . 0.0 112.659 -179.813 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 154' ' ' LEU . . . . . . . . . . . . . 78.1 mt -78.24 159.27 28.6 Favored 'General case' 0 N--CA 1.456 -0.152 0 CA-C-O 121.247 0.546 . . . . 0.0 112.181 -179.305 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 155' ' ' GLU . . . . . 0.433 ' HG2' ' CD2' ' A' ' 156' ' ' HIS . 3.2 pm0 -72.16 -5.84 38.44 Favored 'General case' 0 N--CA 1.454 -0.247 0 C-N-CA 124.145 0.978 . . . . 0.0 112.947 -177.326 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 156' ' ' HIS . . . . . 0.433 ' CD2' ' HG2' ' A' ' 155' ' ' GLU . 93.8 m-70 -143.59 151.36 40.09 Favored 'General case' 0 N--CA 1.454 -0.259 0 C-N-CA 123.518 0.727 . . . . 0.0 109.314 176.361 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 157' ' ' HIS . . . . . . . . . . . . . 42.7 m170 -123.64 155.06 38.45 Favored 'General case' 0 N--CA 1.455 -0.22 0 C-N-CA 123.444 0.698 . . . . 0.0 109.764 -179.06 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 158' ' ' HIS . . . . . . . . . . . . . 79.0 t60 -164.87 -22.03 0.03 OUTLIER 'General case' 0 N--CA 1.465 0.301 0 C-N-CA 123.168 0.587 . . . . 0.0 110.083 -178.016 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 159' ' ' HIS . . . . . . . . . . . . . 20.0 p-80 . . . . . 0 C--O 1.257 1.464 0 CA-C-O 116.283 -1.817 . . . . 0.0 110.164 178.061 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' B' B 2052 ' ' ASP . . . . . . . . . . . . . 28.4 p-10 . . . . . 0 N--CA 1.474 0.744 0 N-CA-C 110.604 -0.147 . . . . 0.0 110.604 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' B' B 2053 ' ' ASP . . . . . . . . . . . . . 47.3 t0 -160.13 162.08 33.89 Favored 'General case' 0 N--CA 1.454 -0.265 0 C-N-CA 122.317 0.247 . . . . 0.0 111.143 -179.745 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B 2054 ' ' ASP . . . . . 0.407 ' CG ' HH12 ' A' ' 28' ' ' ARG . 0.5 OUTLIER -155.29 10.95 0.33 Allowed 'General case' 0 CA--C 1.538 0.501 0 CA-C-N 115.728 -0.669 . . . . 0.0 110.497 173.213 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' B' B 2055 ' ' GLU . . . . . 0.524 ' HB2' ' H ' ' A' ' 27' ' ' SER . 70.9 mt-10 -146.09 93.02 2.26 Favored 'General case' 0 C--N 1.34 0.167 0 C-N-CA 125.495 1.518 . . . . 0.0 107.341 173.46 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B 2056 ' ' ASP . . . . . . . . . . . . . 35.4 p-10 -70.31 -0.33 7.89 Favored 'General case' 0 CA--C 1.53 0.205 0 N-CA-C 113.153 0.797 . . . . 0.0 113.153 -171.477 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B 2057 ' ' ASP . . . . . . . . . . . . . 38.7 t0 -154.14 175.78 13.04 Favored 'General case' 0 N--CA 1.453 -0.317 0 CA-C-N 118.664 0.666 . . . . 0.0 110.565 179.619 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B 2058 ' ' TYR . . . . . . . . . . . . . 1.3 t80 -146.21 131.26 18.28 Favored 'General case' 0 N--CA 1.451 -0.418 0 C-N-CA 124.887 1.275 . . . . 0.0 107.848 179.103 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B 2059 ' ' THR . . . . . 0.413 ' HA ' ' HD2' ' B' 2060 ' ' PRO . 80.5 p -125.58 101.52 30.35 Favored Pre-proline 0 N--CA 1.454 -0.241 0 N-CA-C 109.729 -0.471 . . . . 0.0 109.729 -174.936 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B 2060 ' ' PRO . . . . . 0.413 ' HD2' ' HA ' ' B' 2059 ' ' THR . 79.5 Cg_endo -72.34 167.86 25.78 Favored 'Trans proline' 0 N--CA 1.45 -1.049 0 C-N-CA 123.391 2.727 . . . . 0.0 110.359 176.135 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B 2061 ' ' SER . . . . . . . . . . . . . 41.1 t -146.0 140.01 26.55 Favored 'General case' 0 N--CA 1.452 -0.365 0 N-CA-C 108.653 -0.869 . . . . 0.0 108.653 177.266 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B 2062 ' ' ILE . . . . . . . . . . . . . 18.8 tt -163.72 157.75 1.71 Allowed 'Isoleucine or valine' 0 N--CA 1.453 -0.301 0 N-CA-C 110.096 -0.335 . . . . 0.0 110.096 -176.116 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B 2063 ' ' SER . . . . . . . . . . . . . 81.7 p . . . . . 0 C--O 1.251 1.16 0 CA-C-O 117.272 -1.347 . . . . 0.0 109.769 175.521 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 44.9 ttp . . . . . 0 N--CA 1.476 0.848 0 N-CA-C 109.901 -0.407 . . . . 0.0 109.901 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 42.4 tp60 -63.27 -16.9 61.71 Favored 'General case' 0 CA--C 1.531 0.232 0 C-N-CA 122.875 0.47 . . . . 0.0 111.114 179.053 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 56.7 tt0 -148.24 132.11 17.08 Favored 'General case' 0 N--CA 1.451 -0.379 0 N-CA-C 106.916 -1.513 . . . . 0.0 106.916 175.713 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 39.4 t0 58.21 174.42 0.06 Allowed 'General case' 0 CA--C 1.537 0.465 0 C-N-CA 123.309 0.644 . . . . 0.0 110.392 -170.184 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 47.5 t0 52.73 44.42 30.22 Favored 'General case' 0 CA--C 1.528 0.121 0 O-C-N 121.601 -0.687 . . . . 0.0 110.365 -179.465 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 28.6 p-10 -63.17 -32.85 74.34 Favored 'General case' 0 N--CA 1.452 -0.342 0 CA-C-N 116.385 -0.37 . . . . 0.0 110.434 -177.45 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 7' ' ' PHE . . . . . 0.472 ' CD1' ' HD3' ' A' ' 45' ' ' LYS . 1.5 t80 -59.18 -41.97 89.73 Favored 'General case' 0 N--CA 1.449 -0.508 0 CA-C-N 116.746 -0.207 . . . . 0.0 110.489 -178.984 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 9.7 tp60 -55.18 -32.74 62.41 Favored 'General case' 0 N--CA 1.454 -0.252 0 C-N-CA 122.635 0.374 . . . . 0.0 110.934 -178.793 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 27.4 m-20 -70.84 -34.64 71.88 Favored 'General case' 0 N--CA 1.45 -0.455 0 N-CA-C 109.49 -0.559 . . . . 0.0 109.49 179.856 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 10' ' ' PHE . . . . . 0.519 ' CE2' ' HB2' ' A' ' 32' ' ' LEU . 11.7 t80 -69.14 -41.45 77.29 Favored 'General case' 0 N--CA 1.453 -0.284 0 C-N-CA 123.295 0.638 . . . . 0.0 109.411 175.503 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 94.6 t -63.68 -50.1 79.42 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.36 0 N-CA-C 109.032 -0.729 . . . . 0.0 109.032 179.771 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -61.13 -28.45 69.11 Favored 'General case' 0 N--CA 1.451 -0.409 0 C-N-CA 122.702 0.401 . . . . 0.0 111.137 179.731 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 85.8 m -73.98 -38.22 64.23 Favored 'General case' 0 N--CA 1.454 -0.266 0 N-CA-C 109.335 -0.617 . . . . 0.0 109.335 175.817 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.408 ' HA ' ' CD1' ' A' ' 17' ' ' PHE . 0.1 OUTLIER -64.67 -43.82 92.36 Favored 'General case' 0 N--CA 1.453 -0.285 0 N-CA-C 108.809 -0.811 . . . . 0.0 108.809 176.916 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 66.4 mm-40 -65.22 -29.05 69.82 Favored 'General case' 0 N--CA 1.454 -0.243 0 C-N-CA 123.88 0.872 . . . . 0.0 109.988 178.633 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 67.0 m -69.76 -29.03 66.28 Favored 'General case' 0 N--CA 1.451 -0.397 0 N-CA-C 109.787 -0.449 . . . . 0.0 109.787 176.968 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 17' ' ' PHE . . . . . 0.467 ' CD1' HD11 ' A' ' 68' ' ' ILE . 18.4 m-85 -68.55 -40.49 80.62 Favored 'General case' 0 N--CA 1.456 -0.151 0 C-N-CA 120.195 -0.602 . . . . 0.0 109.869 172.814 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . 0.4 ' HG2' ' CE1' ' A' ' 53' ' ' TYR . 65.5 mttt -65.48 -26.14 67.8 Favored 'General case' 0 N--CA 1.463 0.187 0 CA-C-O 121.134 0.492 . . . . 0.0 110.544 178.338 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 31.7 t0 -81.04 -6.81 59.24 Favored 'General case' 0 CA--C 1.536 0.442 0 C-N-CA 123.748 0.819 . . . . 0.0 112.99 -178.537 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . 0.42 ' CD1' ' HB2' ' A' ' 25' ' ' SER . 18.4 mt -93.6 151.01 19.96 Favored 'General case' 0 N--CA 1.455 -0.2 0 N-CA-C 113.17 0.804 . . . . 0.0 113.17 -176.558 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -71.75 -6.36 40.77 Favored 'General case' 0 CA--C 1.53 0.188 0 C-N-CA 124.049 0.939 . . . . 0.0 112.978 178.532 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 58.9 m -137.85 -7.8 1.63 Allowed 'General case' 0 CA--C 1.522 -0.096 0 N-CA-C 112.925 0.713 . . . . 0.0 112.925 -176.875 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 72.52 -25.69 0.74 Allowed Glycine 0 CA--C 1.528 0.859 0 C-N-CA 123.758 0.694 . . . . 0.0 112.512 -179.805 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 94.8 mt -76.98 141.64 15.35 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.263 0 N-CA-C 108.012 -1.107 . . . . 0.0 108.012 175.388 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . 0.42 ' HB2' ' CD1' ' A' ' 20' ' ' LEU . 7.5 t -160.51 79.88 0.65 Allowed 'General case' 0 CA--C 1.518 -0.254 0 N-CA-C 110.209 -0.293 . . . . 0.0 110.209 -174.598 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . 0.4 ' O ' ' HE2' ' A' ' 30' ' ' LYS . . . -48.28 -49.95 24.19 Favored Glycine 0 CA--C 1.527 0.782 0 CA-C-O 118.851 -0.972 . . . . 0.0 114.17 -171.002 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . 0.522 ' HA ' ' HE3' ' A' ' 30' ' ' LYS . 47.3 p -73.27 -33.34 65.2 Favored 'General case' 0 C--N 1.339 0.14 0 CA-C-N 119.962 1.881 . . . . 0.0 111.641 -174.54 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 2.3 mpt_? -73.91 -36.8 64.76 Favored 'General case' 0 N--CA 1.456 -0.147 0 N-CA-C 109.253 -0.647 . . . . 0.0 109.253 177.344 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 74.5 mt -61.25 -47.51 93.17 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.287 0 N-CA-C 109.007 -0.738 . . . . 0.0 109.007 175.417 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . 0.522 ' HE3' ' HA ' ' A' ' 27' ' ' SER . 52.1 mtmt -64.87 -30.15 71.14 Favored 'General case' 0 C--N 1.339 0.122 0 CA-C-O 119.36 -0.352 . . . . 0.0 111.135 179.65 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . 0.47 ' HA ' ' CE ' ' A' ' 31' ' ' LYS . 2.8 mmpt? -65.87 -60.07 3.23 Favored 'General case' 0 N--CA 1.455 -0.223 0 CA-C-N 118.455 0.57 . . . . 0.0 111.328 -179.942 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.519 ' HB2' ' CE2' ' A' ' 10' ' ' PHE . 1.2 pp -75.89 -16.55 60.02 Favored 'General case' 0 CA--C 1.532 0.276 0 C-N-CA 119.247 -0.981 . . . . 0.0 111.687 -177.925 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . 0.434 ' N ' HD12 ' A' ' 32' ' ' LEU . 24.7 m -70.26 -42.94 71.49 Favored 'General case' 0 N--CA 1.454 -0.232 0 N-CA-C 108.398 -0.964 . . . . 0.0 108.398 173.338 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 93.5 m -66.65 -41.46 88.19 Favored 'General case' 0 N--CA 1.45 -0.459 0 N-CA-C 109.664 -0.495 . . . . 0.0 109.664 -178.728 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 23.8 t80 -60.49 -36.53 78.54 Favored 'General case' 0 C--N 1.339 0.122 0 N-CA-C 110.155 -0.313 . . . . 0.0 110.155 177.073 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -72.3 -28.12 62.88 Favored 'General case' 0 N--CA 1.451 -0.391 0 CA-C-O 119.211 -0.423 . . . . 0.0 111.516 179.457 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 2.7 mm? -82.12 -34.08 29.4 Favored 'General case' 0 CA--C 1.518 -0.281 0 N-CA-C 108.822 -0.807 . . . . 0.0 108.822 -177.923 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 86.7 m-20 -64.4 -27.19 68.83 Favored 'General case' 0 N--CA 1.444 -0.766 0 C-N-CA 123.652 0.781 . . . . 0.0 110.959 174.274 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 65.8 m80 -151.53 106.62 3.29 Favored 'General case' 0 N--CA 1.454 -0.234 0 C-N-CA 122.624 0.37 . . . . 0.0 111.621 -179.187 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 40' ' ' ILE . . . . . 0.597 ' H ' HD13 ' A' ' 40' ' ' ILE . 0.0 OUTLIER -80.53 -10.15 12.3 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.359 0 C-N-CA 123.058 0.543 . . . . 0.0 109.728 173.631 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -55.4 -23.39 24.45 Favored 'General case' 0 N--CA 1.457 -0.122 0 C-N-CA 123.86 0.864 . . . . 0.0 111.86 -178.016 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -108.6 18.0 6.74 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.246 0 C-N-CA 124.032 0.933 . . . . 0.0 111.95 -179.83 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 3.0 pp20? -53.33 -30.1 37.46 Favored 'General case' 0 CA--C 1.53 0.183 0 O-C-N 121.649 -0.657 . . . . 0.0 111.598 178.985 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 47.1 t -65.33 -44.49 87.61 Favored 'General case' 0 CA--C 1.53 0.196 0 N-CA-C 111.756 0.28 . . . . 0.0 111.756 -175.89 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . 0.472 ' HD3' ' CD1' ' A' ' 7' ' ' PHE . 19.4 ptpt -73.94 -24.79 59.71 Favored 'General case' 0 C--N 1.341 0.22 0 O-C-N 121.738 -0.601 . . . . 0.0 110.167 179.253 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 84.8 mt -72.99 -48.17 45.4 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.327 0 C-N-CA 122.873 0.469 . . . . 0.0 109.948 -179.475 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 35.5 mm -63.92 -35.54 73.69 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.323 0 N-CA-C 109.646 -0.501 . . . . 0.0 109.646 178.977 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 15.4 t -63.25 -45.76 90.06 Favored 'General case' 0 N--CA 1.453 -0.276 0 C-N-CA 119.813 -0.755 . . . . 0.0 110.557 178.158 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . 0.417 HD23 ' HA ' ' A' ' 49' ' ' LEU . 25.7 mt -66.6 -33.6 76.03 Favored 'General case' 0 N--CA 1.451 -0.415 0 CA-C-O 118.677 -0.677 . . . . 0.0 112.684 -175.671 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 15.9 pt -69.58 -42.64 80.67 Favored 'Isoleucine or valine' 0 C--N 1.339 0.12 0 CA-C-N 119.553 1.069 . . . . 0.0 110.85 177.077 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 37.7 pt -71.03 -39.86 75.32 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.173 0 C-N-CA 119.926 -0.71 . . . . 0.0 111.13 179.8 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 79.7 m-20 -65.99 -42.31 89.98 Favored 'General case' 0 N--CA 1.454 -0.238 0 C-N-CA 122.492 0.317 . . . . 0.0 110.589 178.984 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 53' ' ' TYR . . . . . 0.4 ' CE1' ' HG2' ' A' ' 18' ' ' LYS . 14.5 t80 -64.95 -45.23 86.63 Favored 'General case' 0 N--CA 1.451 -0.419 0 N-CA-C 109.566 -0.531 . . . . 0.0 109.566 178.266 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 23.7 m -63.84 -30.16 71.27 Favored 'General case' 0 N--CA 1.456 -0.156 0 N-CA-C 111.502 0.186 . . . . 0.0 111.502 -177.522 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 15.6 tpp180 -75.63 -45.07 39.44 Favored 'General case' 0 N--CA 1.453 -0.281 0 O-C-N 122.957 0.161 . . . . 0.0 110.822 -177.16 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 42.0 mt -83.71 -43.4 15.56 Favored 'General case' 0 N--CA 1.456 -0.154 0 N-CA-C 113.379 0.881 . . . . 0.0 113.379 -174.912 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 9.0 p -64.42 154.42 83.85 Favored Pre-proline 0 CA--C 1.535 0.4 0 N-CA-C 113.074 0.768 . . . . 0.0 113.074 -172.088 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 94.6 Cg_endo -74.43 171.6 17.79 Favored 'Trans proline' 0 N--CA 1.455 -0.745 0 C-N-CA 125.125 3.883 . . . . 0.0 111.824 179.806 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -43.5 -49.14 7.39 Favored 'General case' 0 CA--C 1.532 0.255 0 C-N-CA 125.909 1.684 . . . . 0.0 113.794 -174.173 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 87.9 p -70.08 -35.34 74.12 Favored 'General case' 0 N--CA 1.457 -0.118 0 O-C-N 121.967 -0.458 . . . . 0.0 110.684 -176.408 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 62.3 m170 -75.33 -24.91 57.45 Favored 'General case' 0 N--CA 1.45 -0.438 0 CA-C-O 119.28 -0.39 . . . . 0.0 110.379 178.617 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 66.3 mttm -64.61 -47.76 77.43 Favored 'General case' 0 C--N 1.342 0.251 0 N-CA-C 109.094 -0.706 . . . . 0.0 109.094 172.913 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -58.93 -43.23 91.12 Favored 'General case' 0 CA--C 1.533 0.316 0 N-CA-C 108.003 -1.11 . . . . 0.0 108.003 177.454 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -63.02 -34.84 91.05 Favored Glycine 0 CA--C 1.526 0.733 0 N-CA-C 111.146 -0.782 . . . . 0.0 111.146 -179.582 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 44.6 t -67.32 -39.18 85.84 Favored 'General case' 0 N--CA 1.452 -0.337 0 CA-C-N 117.61 0.705 . . . . 0.0 109.644 177.409 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 8.0 mp -64.27 -28.92 70.05 Favored 'General case' 0 N--CA 1.453 -0.324 0 N-CA-C 110.098 -0.334 . . . . 0.0 110.098 178.38 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 0.9 OUTLIER -69.96 -41.27 74.71 Favored 'General case' 0 CA--C 1.528 0.123 0 CA-C-N 117.784 0.265 . . . . 0.0 110.59 175.673 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 68' ' ' ILE . . . . . 0.467 HD11 ' CD1' ' A' ' 17' ' ' PHE . 8.3 mt -64.19 -48.56 85.11 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.269 0 N-CA-C 109.73 -0.471 . . . . 0.0 109.73 176.874 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 91.2 mt -57.75 -33.71 46.02 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.317 0 C-N-CA 123.129 0.572 . . . . 0.0 111.504 178.117 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 17.6 t70 -69.63 -41.84 75.11 Favored 'General case' 0 CA--C 1.521 -0.139 0 CA-C-N 119.116 0.871 . . . . 0.0 110.563 176.986 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 35.4 t -66.24 -59.6 3.58 Favored 'General case' 0 N--CA 1.45 -0.431 0 C-N-CA 122.672 0.389 . . . . 0.0 110.279 -177.381 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -75.17 -33.05 27.56 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.272 0 O-C-N 122.262 -0.274 . . . . 0.0 110.511 -177.217 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -68.33 -50.32 39.41 Favored Glycine 0 CA--C 1.524 0.613 0 N-CA-C 111.739 -0.544 . . . . 0.0 111.739 -174.119 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 41.6 mtm105 -72.13 -39.17 69.0 Favored 'General case' 0 N--CA 1.452 -0.347 0 CA-C-N 117.482 0.641 . . . . 0.0 109.753 179.061 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -62.56 -30.33 71.23 Favored 'General case' 0 N--CA 1.45 -0.461 0 C-N-CA 119.788 -0.765 . . . . 0.0 110.334 -179.611 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 1.7 m-30 -70.02 -53.46 17.49 Favored 'General case' 0 CA--C 1.518 -0.25 0 CA-C-N 118.161 0.437 . . . . 0.0 111.133 176.317 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -71.4 -32.0 67.92 Favored 'General case' 0 N--CA 1.449 -0.512 0 C-N-CA 117.751 -1.58 . . . . 0.0 109.865 -175.04 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 85.5 m-20 -68.9 -45.57 70.57 Favored 'General case' 0 N--CA 1.457 -0.096 0 CA-C-N 118.218 0.463 . . . . 0.0 112.152 179.378 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 15.7 tm-20 -65.19 -50.13 67.08 Favored 'General case' 0 N--CA 1.444 -0.727 0 C-N-CA 120.764 -0.374 . . . . 0.0 110.64 179.705 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 80' ' ' THR . . . . . 0.431 HG21 ' HB3' ' A' ' 94' ' ' CYS . 69.3 p -64.74 -27.11 68.68 Favored 'General case' 0 N--CA 1.454 -0.262 0 N-CA-C 111.708 0.262 . . . . 0.0 111.708 -179.242 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 32.8 ttp-105 -75.26 -30.56 60.51 Favored 'General case' 0 N--CA 1.456 -0.156 0 C-N-CA 122.806 0.442 . . . . 0.0 110.807 175.468 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 19.8 m -85.11 -24.71 27.91 Favored 'General case' 0 N--CA 1.454 -0.232 0 C-N-CA 122.894 0.478 . . . . 0.0 111.673 -179.75 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 6.7 t-20 -88.37 160.72 17.47 Favored 'General case' 0 N--CA 1.453 -0.294 0 C-N-CA 123.201 0.6 . . . . 0.0 111.242 -177.176 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 99.6 p -86.24 12.93 8.79 Favored 'General case' 0 N--CA 1.456 -0.162 0 C-N-CA 124.006 0.922 . . . . 0.0 111.29 179.818 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -60.46 147.4 41.26 Favored 'General case' 0 N--CA 1.453 -0.28 0 C-N-CA 123.248 0.619 . . . . 0.0 112.626 -175.485 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 32.9 t -163.45 150.45 12.43 Favored 'General case' 0 N--CA 1.453 -0.296 0 N-CA-C 107.892 -1.151 . . . . 0.0 107.892 176.0 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 87.1 p -160.89 150.22 16.96 Favored 'General case' 0 N--CA 1.453 -0.293 0 CA-C-O 120.887 0.375 . . . . 0.0 111.708 -177.277 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 43.0 t -71.4 -35.8 71.15 Favored 'General case' 0 N--CA 1.455 -0.198 0 N-CA-C 108.937 -0.764 . . . . 0.0 108.937 175.812 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 8.0 p-10 -75.76 167.53 21.71 Favored 'General case' 0 N--CA 1.452 -0.373 0 N-CA-C 108.416 -0.957 . . . . 0.0 108.416 172.138 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 90' ' ' LYS . . . . . 0.628 ' H ' ' CD ' ' A' ' 91' ' ' PRO . 43.2 mmtm -124.3 -34.31 0.04 OUTLIER Pre-proline 0 N--CA 1.454 -0.239 0 CA-C-O 118.235 -0.888 . . . . 0.0 111.267 178.507 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 91' ' ' PRO . . . . . 0.628 ' CD ' ' H ' ' A' ' 90' ' ' LYS . 31.2 Cg_exo -61.91 150.45 86.14 Favored 'Trans proline' 0 N--CA 1.451 -1.022 0 C-N-CA 122.269 1.979 . . . . 0.0 109.368 167.268 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 83.6 13.81 74.9 Favored Glycine 0 CA--C 1.528 0.871 0 N-CA-C 111.65 -0.58 . . . . 0.0 111.65 -177.088 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -153.52 165.23 36.53 Favored 'General case' 0 N--CA 1.454 -0.245 0 C-N-CA 124.534 1.134 . . . . 0.0 109.469 -179.845 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 94' ' ' CYS . . . . . 0.431 ' HB3' HG21 ' A' ' 80' ' ' THR . 29.4 p -56.22 -21.35 22.76 Favored 'General case' 0 N--CA 1.453 -0.305 0 C-N-CA 123.519 0.728 . . . . 0.0 110.925 177.323 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -58.31 -63.44 1.27 Allowed 'General case' 0 N--CA 1.447 -0.616 0 O-C-N 122.297 -0.252 . . . . 0.0 110.327 -176.111 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 76.8 t60 -71.62 -33.28 68.83 Favored 'General case' 0 N--CA 1.451 -0.418 0 CA-C-N 117.609 0.186 . . . . 0.0 110.514 -179.489 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -62.75 -52.78 61.89 Favored 'General case' 0 N--CA 1.451 -0.388 0 O-C-N 123.229 0.331 . . . . 0.0 111.535 -176.837 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 98' ' ' ILE . . . . . 0.426 HD13 ' HB2' ' A' ' 94' ' ' CYS . 1.8 mp -71.82 -36.11 57.31 Favored 'Isoleucine or valine' 0 C--N 1.338 0.097 0 C-N-CA 121.001 -0.28 . . . . 0.0 110.75 -178.69 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 24.4 m-80 -69.02 -38.51 79.25 Favored 'General case' 0 N--CA 1.455 -0.2 0 CA-C-N 118.442 0.565 . . . . 0.0 111.736 -179.996 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 99.6 m -73.37 -33.68 65.18 Favored 'General case' 0 N--CA 1.456 -0.143 0 CA-C-N 118.422 0.555 . . . . 0.0 110.449 -178.98 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 62.6 tp -75.29 -37.56 60.79 Favored 'General case' 0 N--CA 1.449 -0.489 0 N-CA-C 110.317 -0.253 . . . . 0.0 110.317 179.707 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -61.96 -22.75 62.83 Favored Glycine 0 CA--C 1.527 0.81 0 CA-C-O 119.448 -0.64 . . . . 0.0 113.138 -173.752 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 13.7 mm-40 -80.14 -39.32 29.67 Favored 'General case' 0 N--CA 1.452 -0.36 0 CA-C-N 117.702 0.751 . . . . 0.0 112.403 -179.939 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 21.7 m -100.61 -14.77 7.8 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.092 0 N-CA-C 112.992 0.738 . . . . 0.0 112.992 -175.746 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 105' ' ' ILE . . . . . . . . . . . . . 9.8 tp -63.5 -26.8 41.62 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.206 0 CA-C-N 118.511 0.596 . . . . 0.0 111.206 -177.458 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 106' ' ' GLN . . . . . 0.442 ' HA ' ' CD1' ' A' ' 145' ' ' ILE . 20.3 pt20 -66.27 -29.85 70.17 Favored 'General case' 0 N--CA 1.452 -0.361 0 O-C-N 122.006 -0.434 . . . . 0.0 111.039 -179.937 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 84.0 mt-10 -73.74 -40.7 63.34 Favored 'General case' 0 N--CA 1.453 -0.31 0 N-CA-C 109.511 -0.552 . . . . 0.0 109.511 177.395 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 66.1 mt -74.96 -35.94 62.08 Favored 'General case' 0 N--CA 1.451 -0.405 0 C-N-CA 122.996 0.518 . . . . 0.0 111.343 -174.853 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 92.7 mt -70.54 -52.71 19.84 Favored 'General case' 0 N--CA 1.452 -0.341 0 N-CA-C 109.583 -0.525 . . . . 0.0 109.583 177.163 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 13.1 t -59.26 -37.43 77.6 Favored 'General case' 0 N--CA 1.453 -0.276 0 CA-C-N 117.749 0.249 . . . . 0.0 111.034 -178.153 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 36.9 t0 -62.87 -45.75 91.1 Favored 'General case' 0 N--CA 1.454 -0.267 0 N-CA-C 108.883 -0.784 . . . . 0.0 108.883 174.59 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -65.7 -30.36 71.03 Favored 'General case' 0 N--CA 1.448 -0.569 0 CA-C-O 118.959 -0.543 . . . . 0.0 110.837 -176.538 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 113' ' ' ILE . . . . . . . . . . . . . 49.6 mm -68.19 -50.78 54.91 Favored 'Isoleucine or valine' 0 C--N 1.34 0.156 0 CA-C-N 119.073 0.851 . . . . 0.0 109.56 177.647 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -69.63 -41.29 75.82 Favored 'General case' 0 N--CA 1.449 -0.501 0 O-C-N 123.03 0.207 . . . . 0.0 111.088 -175.381 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 115' ' ' LYS . . . . . 0.575 ' HE2' ' HA ' ' A' ' 115' ' ' LYS . 0.6 OUTLIER -75.61 -40.42 56.4 Favored 'General case' 0 N--CA 1.45 -0.429 0 N-CA-C 113.977 1.103 . . . . 0.0 113.977 -176.521 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 116' ' ' SER . . . . . 0.479 ' HB3' ' CB ' ' A' ' 120' ' ' HIS . 2.4 m -80.53 157.33 26.14 Favored 'General case' 0 CA--C 1.53 0.188 0 C-N-CA 120.181 -0.608 . . . . 0.0 112.539 -169.156 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 62.9 t30 -72.74 171.35 12.76 Favored 'General case' 0 CA--C 1.531 0.213 0 C-N-CA 124.05 0.94 . . . . 0.0 111.887 -174.845 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 118' ' ' GLN . . . . . . . . . . . . . 53.6 mt-30 -51.4 -44.3 62.18 Favored 'General case' 0 C--O 1.231 0.115 0 C-N-CA 123.615 0.766 . . . . 0.0 111.553 -176.826 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 22.5 t0 -65.97 -33.04 74.9 Favored 'General case' 0 N--CA 1.454 -0.234 0 CA-C-O 121.469 0.652 . . . . 0.0 109.975 -179.717 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 120' ' ' HIS . . . . . 0.479 ' CB ' ' HB3' ' A' ' 116' ' ' SER . 21.9 m170 -75.98 -45.88 32.5 Favored 'General case' 0 N--CA 1.447 -0.576 0 CA-C-N 115.746 -0.661 . . . . 0.0 110.342 -178.824 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 52.8 mttm -57.7 -37.77 74.07 Favored 'General case' 0 C--N 1.341 0.234 0 N-CA-C 108.856 -0.794 . . . . 0.0 108.856 179.792 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 7.0 tm-20 -62.48 -51.99 65.29 Favored 'General case' 0 N--CA 1.452 -0.373 0 C-N-CA 122.251 0.221 . . . . 0.0 110.758 179.004 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 3.1 mtmm -64.77 -27.12 68.68 Favored 'General case' 0 N--CA 1.454 -0.226 0 CA-C-N 116.761 -0.2 . . . . 0.0 111.244 179.866 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 124' ' ' ILE . . . . . . . . . . . . . 54.6 mt -74.81 -39.65 45.81 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.242 0 O-C-N 121.576 -0.702 . . . . 0.0 109.517 175.706 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 125' ' ' ARG . . . . . 0.424 HH11 ' HA ' ' A' ' 125' ' ' ARG . 7.2 mmm180 -59.79 -41.5 91.3 Favored 'General case' 0 N--CA 1.454 -0.271 0 CA-C-O 119.073 -0.489 . . . . 0.0 111.09 178.584 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 126' ' ' MET . . . . . . . . . . . . . 28.1 ptm -66.23 -39.98 89.93 Favored 'General case' 0 N--CA 1.449 -0.48 0 C-N-CA 118.542 -1.263 . . . . 0.0 108.409 176.663 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 4.0 mp -62.29 -36.95 83.7 Favored 'General case' 0 N--CA 1.456 -0.174 0 CA-C-N 118.839 0.745 . . . . 0.0 111.549 179.845 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 93.2 mt -67.61 -42.94 81.58 Favored 'General case' 0 N--CA 1.457 -0.099 0 CA-C-N 118.551 0.614 . . . . 0.0 110.325 178.598 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 27.6 m-20 -69.73 -32.4 70.93 Favored 'General case' 0 N--CA 1.454 -0.261 0 N-CA-C 110.045 -0.354 . . . . 0.0 110.045 178.946 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 130' ' ' ILE . . . . . 0.438 ' HA ' ' HD3' ' A' ' 133' ' ' ARG . 34.5 mt -61.98 -39.76 84.82 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.286 0 N-CA-C 109.885 -0.413 . . . . 0.0 109.885 176.641 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 131' ' ' TRP . . . . . . . . . . . . . 32.3 m0 -74.69 -30.84 61.71 Favored 'General case' 0 N--CA 1.453 -0.302 0 C-N-CA 120.372 -0.531 . . . . 0.0 112.084 -179.779 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 66.3 m-20 -75.55 -28.78 59.18 Favored 'General case' 0 CA--C 1.534 0.341 0 CA-C-N 117.961 0.346 . . . . 0.0 111.128 177.912 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 133' ' ' ARG . . . . . 0.447 HH21 ' C ' ' B' 2063 ' ' SER . 24.6 mtp180 -72.89 -36.61 67.36 Favored 'General case' 0 C--N 1.34 0.166 0 N-CA-C 110.055 -0.35 . . . . 0.0 110.055 175.018 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 47.5 m -75.15 -7.97 55.27 Favored 'General case' 0 N--CA 1.453 -0.292 0 C-N-CA 123.39 0.676 . . . . 0.0 112.306 -176.45 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 135' ' ' GLY . . . . . . . . . . . . . . . 87.62 11.71 68.05 Favored Glycine 0 CA--C 1.527 0.824 0 CA-C-O 119.17 -0.794 . . . . 0.0 113.229 175.898 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 136' ' ' LEU . . . . . . . . . . . . . 6.7 mp -75.77 46.21 0.36 Allowed 'General case' 0 CA--C 1.532 0.267 0 CA-C-N 118.351 1.076 . . . . 0.0 110.553 178.497 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 137' ' ' PHE . . . . . . . . . . . . . 69.4 m-85 -71.96 -2.26 17.47 Favored 'General case' 0 CA--C 1.529 0.161 0 O-C-N 121.85 -0.531 . . . . 0.0 112.281 -179.534 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 138' ' ' GLN . . . . . . . . . . . . . 17.7 mp0 -75.62 -14.92 60.39 Favored 'General case' 0 CA--C 1.53 0.199 0 CA-C-N 118.385 0.539 . . . . 0.0 110.971 -178.585 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 139' ' ' LYS . . . . . . . . . . . . . 23.7 pttm -79.95 163.62 24.14 Favored 'General case' 0 N--CA 1.454 -0.25 0 N-CA-C 109.407 -0.59 . . . . 0.0 109.407 175.271 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 140' ' ' SER . . . . . . . . . . . . . 30.2 t -66.91 134.99 53.14 Favored 'General case' 0 N--CA 1.454 -0.252 0 N-CA-C 109.127 -0.694 . . . . 0.0 109.127 173.054 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 141' ' ' TYR . . . . . . . . . . . . . 39.1 p90 -132.8 22.74 4.24 Favored 'General case' 0 C--O 1.231 0.089 0 C-N-CA 122.93 0.492 . . . . 0.0 110.687 -176.898 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 142' ' ' LEU . . . . . . . . . . . . . 79.6 mt -60.44 167.93 2.34 Favored 'General case' 0 N--CA 1.454 -0.265 0 CA-C-O 121.433 0.635 . . . . 0.0 111.145 -179.709 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 74.0 m-20 -59.59 -14.56 13.87 Favored 'General case' 0 N--CA 1.455 -0.205 0 N-CA-C 112.392 0.516 . . . . 0.0 112.392 -178.444 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . -66.02 -27.5 68.16 Favored 'General case' 0 N--CA 1.451 -0.413 0 C-N-CA 122.494 0.318 . . . . 0.0 111.354 178.396 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 145' ' ' ILE . . . . . 0.442 ' CD1' ' HA ' ' A' ' 106' ' ' GLN . 39.1 mm -69.98 -49.0 59.77 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.203 0 CA-C-N 117.621 0.192 . . . . 0.0 111.164 -179.782 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 146' ' ' ARG . . . . . . . . . . . . . 6.2 mpt_? -75.35 -26.42 58.55 Favored 'General case' 0 N--CA 1.454 -0.241 0 N-CA-C 109.071 -0.714 . . . . 0.0 109.071 176.802 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 147' ' ' SER . . . . . . . . . . . . . 32.0 p 57.97 0.05 0.11 Allowed 'General case' 0 C--N 1.341 0.234 0 C-N-CA 126.425 1.89 . . . . 0.0 115.978 171.502 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 33.7 mmtt 50.63 -88.26 0.01 OUTLIER 'General case' 0 CA--C 1.532 0.275 0 C-N-CA 125.561 1.544 . . . . 0.0 113.053 175.626 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 149' ' ' CYS . . . . . . . . . . . . . 48.6 t -66.17 -35.25 79.96 Favored 'General case' 0 N--CA 1.452 -0.328 0 N-CA-C 112.034 0.383 . . . . 0.0 112.034 -172.482 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 150' ' ' PHE . . . . . . . . . . . . . 95.3 m-85 -75.15 -13.43 60.47 Favored 'General case' 0 N--CA 1.452 -0.351 0 CA-C-N 118.05 0.386 . . . . 0.0 111.325 -178.807 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 151' ' ' ALA . . . . . . . . . . . . . . . -93.0 -37.4 12.21 Favored 'General case' 0 N--CA 1.451 -0.387 0 N-CA-C 110.311 -0.255 . . . . 0.0 110.311 172.834 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 152' ' ' MET . . . . . . . . . . . . . 93.5 mtp -79.35 -10.27 59.77 Favored 'General case' 0 N--CA 1.454 -0.257 0 C-N-CA 123.346 0.658 . . . . 0.0 112.109 178.902 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 153' ' ' ASP . . . . . . . . . . . . . 42.3 p-10 -51.9 -36.71 49.78 Favored 'General case' 0 CA--C 1.529 0.152 0 C-N-CA 123.416 0.686 . . . . 0.0 112.446 -174.691 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 154' ' ' LEU . . . . . . . . . . . . . 76.5 mt -138.5 37.35 2.25 Favored 'General case' 0 C--O 1.231 0.12 0 C-N-CA 124.216 1.006 . . . . 0.0 110.94 -178.735 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 155' ' ' GLU . . . . . . . . . . . . . 25.3 pt-20 -68.21 163.75 22.05 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-O 121.421 0.629 . . . . 0.0 111.467 -177.804 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 156' ' ' HIS . . . . . . . . . . . . . 92.1 m-70 -72.72 162.11 29.9 Favored 'General case' 0 N--CA 1.452 -0.342 0 CA-C-N 115.784 -0.644 . . . . 0.0 110.73 178.808 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 157' ' ' HIS . . . . . . . . . . . . . 32.2 p-80 -68.0 152.15 45.98 Favored 'General case' 0 N--CA 1.453 -0.278 0 C-N-CA 122.879 0.471 . . . . 0.0 110.691 -179.449 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 158' ' ' HIS . . . . . . . . . . . . . 88.9 m-70 -109.37 -0.41 19.03 Favored 'General case' 0 CA--C 1.529 0.153 0 C-N-CA 122.997 0.519 . . . . 0.0 111.688 -179.854 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 159' ' ' HIS . . . . . . . . . . . . . 42.0 m170 . . . . . 0 C--O 1.25 1.127 0 CA-C-O 117.353 -1.308 . . . . 0.0 109.905 -177.01 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' B' B 2052 ' ' ASP . . . . . . . . . . . . . 23.1 p-10 . . . . . 0 N--CA 1.472 0.649 0 N-CA-C 109.668 -0.493 . . . . 0.0 109.668 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' B' B 2053 ' ' ASP . . . . . . . . . . . . . 68.0 m-20 -145.64 153.77 41.4 Favored 'General case' 0 N--CA 1.454 -0.269 0 C-N-CA 124.454 1.102 . . . . 0.0 109.961 178.822 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B 2054 ' ' ASP . . . . . . . . . . . . . 50.4 t0 -155.76 -169.59 3.15 Favored 'General case' 0 N--CA 1.452 -0.363 0 N-CA-C 107.735 -1.209 . . . . 0.0 107.735 -179.761 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B 2055 ' ' GLU . . . . . . . . . . . . . 12.0 pt-20 -65.83 -8.04 19.54 Favored 'General case' 0 CA--C 1.534 0.349 0 O-C-N 121.934 -0.479 . . . . 0.0 110.087 173.006 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B 2056 ' ' ASP . . . . . . . . . . . . . 51.8 m-20 48.91 15.05 0.09 Allowed 'General case' 0 CA--C 1.533 0.326 0 C-N-CA 126.651 1.98 . . . . 0.0 115.505 173.638 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B 2057 ' ' ASP . . . . . . . . . . . . . 40.6 t0 -152.04 170.64 19.41 Favored 'General case' 0 N--CA 1.454 -0.26 0 CA-C-N 118.761 0.71 . . . . 0.0 109.963 177.56 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B 2058 ' ' TYR . . . . . . . . . . . . . 0.7 OUTLIER -160.74 140.84 11.18 Favored 'General case' 0 N--CA 1.452 -0.37 0 C-N-CA 123.811 0.844 . . . . 0.0 109.286 -178.23 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B 2059 ' ' THR . . . . . 0.422 HG22 ' H ' ' B' 2061 ' ' SER . 92.4 m -107.61 126.84 28.99 Favored Pre-proline 0 CA--C 1.529 0.172 0 N-CA-C 109.687 -0.486 . . . . 0.0 109.687 -179.293 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B 2060 ' ' PRO . . . . . . . . . . . . . 91.2 Cg_endo -72.99 -16.1 25.83 Favored 'Trans proline' 0 N--CA 1.454 -0.846 0 C-N-CA 124.124 3.216 . . . . 0.0 113.159 -175.963 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B 2061 ' ' SER . . . . . 0.422 ' H ' HG22 ' B' 2059 ' ' THR . 37.5 t 51.51 35.15 13.73 Favored 'General case' 0 CA--C 1.53 0.209 0 C-N-CA 123.523 0.729 . . . . 0.0 111.972 -179.057 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B 2062 ' ' ILE . . . . . 0.445 HD11 ' HB2' ' A' ' 133' ' ' ARG . 5.8 tp -76.27 132.85 32.27 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.259 0 N-CA-C 114.225 1.194 . . . . 0.0 114.225 -172.356 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B 2063 ' ' SER . . . . . 0.447 ' C ' HH21 ' A' ' 133' ' ' ARG . 83.5 p . . . . . 0 C--O 1.254 1.342 0 CA-C-O 117.549 -1.215 . . . . 0.0 109.371 172.918 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 64.1 mtt . . . . . 0 N--CA 1.474 0.742 0 CA-C-O 120.573 0.225 . . . . 0.0 110.527 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 4.2 pm0 -153.19 157.71 40.68 Favored 'General case' 0 N--CA 1.456 -0.15 0 N-CA-C 109.328 -0.619 . . . . 0.0 109.328 -179.215 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 37.4 mm-40 -128.19 4.4 5.8 Favored 'General case' 0 CA--C 1.529 0.171 0 C-N-CA 123.053 0.541 . . . . 0.0 111.454 -177.759 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 6.1 m-20 -71.14 127.93 34.21 Favored 'General case' 0 N--CA 1.452 -0.34 0 N-CA-C 109.476 -0.564 . . . . 0.0 109.476 179.161 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 25.0 m-20 47.63 34.66 3.77 Favored 'General case' 0 CA--C 1.532 0.261 0 C-N-CA 123.211 0.605 . . . . 0.0 111.388 -176.546 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 21.3 p-10 -53.69 -49.71 67.43 Favored 'General case' 0 CA--C 1.518 -0.28 0 C-N-CA 123.129 0.572 . . . . 0.0 111.678 -172.718 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -75.65 -41.58 53.7 Favored 'General case' 0 N--CA 1.441 -0.905 0 C-N-CA 120.356 -0.538 . . . . 0.0 111.534 -170.501 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 52.2 tp60 -52.52 -36.57 55.62 Favored 'General case' 0 N--CA 1.453 -0.298 0 N-CA-C 112.169 0.433 . . . . 0.0 112.169 -176.179 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 54.2 m-80 -71.74 -35.64 70.2 Favored 'General case' 0 N--CA 1.453 -0.291 0 C-N-CA 120.541 -0.463 . . . . 0.0 110.139 179.391 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 10' ' ' PHE . . . . . 0.426 ' CE1' HD22 ' A' ' 32' ' ' LEU . 1.9 t80 -71.99 -37.49 69.84 Favored 'General case' 0 N--CA 1.451 -0.394 0 C-N-CA 123.011 0.524 . . . . 0.0 110.891 178.987 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 99.3 t -65.79 -57.3 11.23 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.337 0 N-CA-C 108.625 -0.88 . . . . 0.0 108.625 179.6 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -59.06 -31.35 68.79 Favored 'General case' 0 N--CA 1.453 -0.284 0 C-N-CA 122.894 0.477 . . . . 0.0 112.021 -177.246 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 79.2 m -70.31 -39.36 74.85 Favored 'General case' 0 N--CA 1.456 -0.144 0 CA-C-N 118.723 0.692 . . . . 0.0 109.588 176.707 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.441 ' HA ' ' CD1' ' A' ' 17' ' ' PHE . 2.8 tp -70.15 -39.66 75.24 Favored 'General case' 0 N--CA 1.453 -0.285 0 CA-C-O 121.169 0.509 . . . . 0.0 110.489 -179.479 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 61.7 mm-40 -64.07 -29.69 70.81 Favored 'General case' 0 N--CA 1.45 -0.431 0 N-CA-C 108.872 -0.788 . . . . 0.0 108.872 177.617 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 32.3 t -71.59 -29.18 64.41 Favored 'General case' 0 N--CA 1.45 -0.455 0 CA-C-O 119.476 -0.297 . . . . 0.0 110.427 177.306 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 17' ' ' PHE . . . . . 0.535 ' CD1' HD11 ' A' ' 68' ' ' ILE . 27.3 m-85 -67.6 -36.66 81.29 Favored 'General case' 0 C--N 1.342 0.253 0 CA-C-N 118.508 0.595 . . . . 0.0 110.845 172.503 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . 0.495 ' HG2' ' CE1' ' A' ' 53' ' ' TYR . 61.2 mttt -61.49 -37.72 84.66 Favored 'General case' 0 C--N 1.341 0.202 0 C-N-CA 120.088 -0.645 . . . . 0.0 109.367 176.643 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 39.1 t0 -81.07 -18.87 45.13 Favored 'General case' 0 CA--C 1.534 0.331 0 N-CA-C 113.176 0.806 . . . . 0.0 113.176 -178.908 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . 0.451 HD12 ' HA ' ' A' ' 17' ' ' PHE . 1.4 mt -64.8 -7.51 11.38 Favored 'General case' 0 C--O 1.227 -0.1 0 CA-C-O 118.439 -0.791 . . . . 0.0 112.816 178.722 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 36.0 mmtm 64.19 -48.08 0.29 Allowed 'General case' 0 CA--C 1.528 0.111 0 C-N-CA 126.506 1.923 . . . . 0.0 112.547 179.602 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 53.3 m -85.74 -13.26 48.9 Favored 'General case' 0 N--CA 1.451 -0.418 0 C-N-CA 123.186 0.594 . . . . 0.0 110.861 174.309 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 79.31 -34.33 1.99 Allowed Glycine 0 CA--C 1.527 0.834 0 C-N-CA 124.45 1.024 . . . . 0.0 113.16 175.553 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 93.9 mt -80.45 146.15 8.02 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.252 0 CA-C-N 118.025 0.912 . . . . 0.0 111.401 -178.933 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 35.1 t -169.02 97.68 0.36 Allowed 'General case' 0 CA--C 1.517 -0.326 0 N-CA-C 108.274 -1.01 . . . . 0.0 108.274 173.438 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -53.41 -34.72 49.22 Favored Glycine 0 CA--C 1.526 0.742 0 CA-C-O 119.405 -0.664 . . . . 0.0 111.672 -176.518 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 98.4 p -66.6 -49.92 64.74 Favored 'General case' 0 N--CA 1.456 -0.157 0 CA-C-N 118.255 1.027 . . . . 0.0 110.432 -178.261 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . 0.436 HH22 ' CB ' ' B' 2053 ' ' ASP . 33.8 mtm180 -73.83 -34.9 64.75 Favored 'General case' 0 C--O 1.231 0.127 0 C-N-CA 122.383 0.273 . . . . 0.0 110.788 -179.077 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 59.7 mt -58.79 -50.44 79.32 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.467 0 N-CA-C 109.228 -0.656 . . . . 0.0 109.228 174.55 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 70.9 mttt -64.47 -28.73 69.87 Favored 'General case' 0 CA--C 1.529 0.141 0 CA-C-O 118.904 -0.569 . . . . 0.0 111.43 178.773 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . 0.439 ' HA ' ' CE ' ' A' ' 31' ' ' LYS . 3.4 mmpt? -63.41 -58.88 5.65 Favored 'General case' 0 N--CA 1.457 -0.083 0 CA-C-N 118.624 0.647 . . . . 0.0 111.205 179.124 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.514 HD12 ' N ' ' A' ' 33' ' ' THR . 1.4 pp -75.78 -18.42 59.53 Favored 'General case' 0 N--CA 1.454 -0.256 0 C-N-CA 118.732 -1.187 . . . . 0.0 111.739 -178.714 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . 0.514 ' N ' HD12 ' A' ' 32' ' ' LEU . 38.6 m -70.76 -41.49 71.68 Favored 'General case' 0 N--CA 1.455 -0.201 0 N-CA-C 108.664 -0.865 . . . . 0.0 108.664 175.931 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 98.2 m -69.54 -38.31 77.43 Favored 'General case' 0 N--CA 1.45 -0.46 0 CA-C-N 116.459 -0.337 . . . . 0.0 110.441 -178.188 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 26.6 t80 -69.89 -29.81 67.1 Favored 'General case' 0 N--CA 1.454 -0.259 0 C-N-CA 119.826 -0.75 . . . . 0.0 110.899 178.369 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -68.94 -32.15 71.55 Favored 'General case' 0 N--CA 1.448 -0.571 0 N-CA-C 110.313 -0.254 . . . . 0.0 110.313 176.53 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -76.98 -34.26 57.56 Favored 'General case' 0 N--CA 1.456 -0.154 0 N-CA-C 110.173 -0.306 . . . . 0.0 110.173 174.171 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 40.4 t0 -60.55 -24.81 65.7 Favored 'General case' 0 CA--C 1.531 0.229 0 C-N-CA 122.926 0.49 . . . . 0.0 110.563 175.547 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 27.3 m-70 -158.32 110.19 2.25 Favored 'General case' 0 N--CA 1.455 -0.193 0 C-N-CA 123.374 0.67 . . . . 0.0 111.28 172.691 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 40' ' ' ILE . . . . . 0.584 ' H ' HD13 ' A' ' 40' ' ' ILE . 0.0 OUTLIER -77.35 -11.39 13.59 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.385 0 N-CA-C 109.626 -0.509 . . . . 0.0 109.626 173.45 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 48.0 m-20 -59.33 -19.91 50.28 Favored 'General case' 0 CA--C 1.532 0.264 0 C-N-CA 122.987 0.515 . . . . 0.0 111.87 -177.916 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -102.95 13.36 6.93 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.195 0 C-N-CA 123.068 0.547 . . . . 0.0 111.848 176.576 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 3.0 pp20? -52.78 -32.01 41.51 Favored 'General case' 0 CA--C 1.527 0.093 0 O-C-N 121.613 -0.679 . . . . 0.0 112.096 -179.659 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 48.2 t -61.99 -48.86 78.46 Favored 'General case' 0 N--CA 1.455 -0.199 0 O-C-N 122.172 -0.33 . . . . 0.0 111.563 -176.113 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 19.6 ptpt -71.9 -24.66 61.69 Favored 'General case' 0 C--N 1.34 0.156 0 O-C-N 121.857 -0.527 . . . . 0.0 109.837 179.764 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 46' ' ' ILE . . . . . 0.42 HG12 ' CZ ' ' A' ' 10' ' ' PHE . 89.6 mt -71.87 -46.0 62.51 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.263 0 C-N-CA 122.763 0.425 . . . . 0.0 110.427 -179.393 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 33.9 mm -63.99 -35.67 74.26 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.224 0 N-CA-C 109.478 -0.564 . . . . 0.0 109.478 178.058 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 13.3 t -63.25 -41.6 99.08 Favored 'General case' 0 N--CA 1.453 -0.319 0 C-N-CA 119.644 -0.822 . . . . 0.0 110.36 177.801 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 4.4 mp -67.99 -37.13 81.12 Favored 'General case' 0 N--CA 1.454 -0.272 0 CA-C-O 118.791 -0.623 . . . . 0.0 112.172 -176.202 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 15.6 pt -69.33 -41.54 80.98 Favored 'Isoleucine or valine' 0 C--O 1.23 0.076 0 CA-C-N 119.168 0.895 . . . . 0.0 110.597 179.901 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 27.5 pt -71.48 -39.75 71.3 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.178 0 C-N-CA 120.084 -0.647 . . . . 0.0 110.646 179.164 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 90.1 m-20 -68.19 -41.67 81.05 Favored 'General case' 0 N--CA 1.452 -0.33 0 CA-C-N 118.1 0.409 . . . . 0.0 112.002 -179.93 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 53' ' ' TYR . . . . . 0.495 ' CE1' ' HG2' ' A' ' 18' ' ' LYS . 8.5 t80 -67.1 -47.04 72.42 Favored 'General case' 0 N--CA 1.453 -0.292 0 N-CA-C 109.202 -0.666 . . . . 0.0 109.202 178.512 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 39.8 t -65.19 -28.16 69.2 Favored 'General case' 0 N--CA 1.453 -0.288 0 N-CA-C 111.589 0.218 . . . . 0.0 111.589 -178.052 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 55.7 ttp85 -75.48 -41.46 55.44 Favored 'General case' 0 N--CA 1.454 -0.232 0 C-N-CA 123.405 0.682 . . . . 0.0 112.251 -179.078 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 46.8 mt -86.98 -43.54 12.28 Favored 'General case' 0 C--O 1.227 -0.111 0 N-CA-C 112.541 0.571 . . . . 0.0 112.541 -176.448 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 8.2 p -66.48 156.8 84.83 Favored Pre-proline 0 CA--C 1.538 0.486 0 N-CA-C 113.416 0.895 . . . . 0.0 113.416 -172.666 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 87.2 Cg_endo -73.49 173.3 14.06 Favored 'Trans proline' 0 N--CA 1.456 -0.711 0 C-N-CA 124.707 3.605 . . . . 0.0 111.048 178.887 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -51.78 -42.78 62.68 Favored 'General case' 0 CA--C 1.53 0.197 0 N-CA-C 113.581 0.956 . . . . 0.0 113.581 -172.96 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 51.0 m -66.88 -40.39 87.78 Favored 'General case' 0 N--CA 1.455 -0.189 0 CA-C-N 118.076 0.398 . . . . 0.0 110.283 -177.006 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 39.9 m170 -75.78 -24.11 55.97 Favored 'General case' 0 N--CA 1.45 -0.44 0 N-CA-C 109.89 -0.411 . . . . 0.0 109.89 177.272 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . 0.405 ' HB2' ' HE2' ' A' ' 62' ' ' LYS . 19.7 ttmm -73.61 -34.02 64.86 Favored 'General case' 0 N--CA 1.454 -0.257 0 C-N-CA 123.744 0.817 . . . . 0.0 109.595 178.51 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -66.54 -45.18 80.28 Favored 'General case' 0 CA--C 1.53 0.186 0 N-CA-C 107.334 -1.358 . . . . 0.0 107.334 172.719 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -64.96 -30.45 78.04 Favored Glycine 0 C--N 1.34 0.768 0 N-CA-C 111.193 -0.763 . . . . 0.0 111.193 179.241 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 59.4 m -67.54 -40.63 85.02 Favored 'General case' 0 N--CA 1.454 -0.255 0 N-CA-C 109.419 -0.586 . . . . 0.0 109.419 177.649 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 59.6 mt -70.82 -24.05 62.47 Favored 'General case' 0 N--CA 1.452 -0.326 0 N-CA-C 110.187 -0.301 . . . . 0.0 110.187 178.885 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -72.43 -37.91 68.47 Favored 'General case' 0 C--O 1.231 0.101 0 CA-C-N 117.932 0.333 . . . . 0.0 110.105 175.421 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 68' ' ' ILE . . . . . 0.535 HD11 ' CD1' ' A' ' 17' ' ' PHE . 18.2 mt -68.48 -44.94 82.79 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.342 0 N-CA-C 109.114 -0.699 . . . . 0.0 109.114 176.609 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 76.2 mt -58.34 -32.01 44.06 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.114 0 C-N-CA 123.156 0.582 . . . . 0.0 110.748 175.791 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 19.7 t70 -69.57 -47.11 64.72 Favored 'General case' 0 N--CA 1.454 -0.263 0 CA-C-N 117.967 0.349 . . . . 0.0 111.325 179.696 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 99.2 p -71.59 -47.35 55.38 Favored 'General case' 0 N--CA 1.449 -0.503 0 C-N-CA 121.092 -0.243 . . . . 0.0 110.73 -176.538 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -75.66 -34.04 27.88 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.28 0 N-CA-C 109.879 -0.415 . . . . 0.0 109.879 -178.539 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -66.23 -52.41 36.5 Favored Glycine 0 C--N 1.334 0.466 0 N-CA-C 111.248 -0.741 . . . . 0.0 111.248 -175.745 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 44.5 mtm105 -71.46 -38.65 71.26 Favored 'General case' 0 N--CA 1.451 -0.408 0 CA-C-O 119.168 -0.444 . . . . 0.0 110.767 -179.926 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -63.16 -30.94 71.99 Favored 'General case' 0 N--CA 1.451 -0.401 0 C-N-CA 119.763 -0.775 . . . . 0.0 109.972 -179.231 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 1.8 m-30 -69.76 -52.14 27.94 Favored 'General case' 0 N--CA 1.454 -0.234 0 CA-C-O 119.265 -0.398 . . . . 0.0 110.965 176.473 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 8.0 tt -70.28 -45.53 66.17 Favored 'General case' 0 N--CA 1.448 -0.547 0 C-N-CA 117.328 -1.749 . . . . 0.0 109.458 -176.474 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 91.0 m-20 -56.96 -47.64 80.25 Favored 'General case' 0 N--CA 1.455 -0.189 0 CA-C-O 119.17 -0.443 . . . . 0.0 111.795 -176.244 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 75.5 mm-40 -70.41 -41.38 73.05 Favored 'General case' 0 N--CA 1.455 -0.22 0 CA-C-N 118.498 0.59 . . . . 0.0 111.902 -179.614 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 80.9 p -72.38 -28.14 62.82 Favored 'General case' 0 CA--C 1.529 0.148 0 CA-C-N 118.804 0.729 . . . . 0.0 111.574 -179.429 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 5.7 tmm_? -82.48 -35.05 27.79 Favored 'General case' 0 N--CA 1.457 -0.09 0 C-N-CA 123.22 0.608 . . . . 0.0 111.48 179.372 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 40.0 t -90.47 -34.68 15.49 Favored 'General case' 0 N--CA 1.457 -0.082 0 N-CA-C 113.086 0.773 . . . . 0.0 113.086 -179.326 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 28.7 m-20 -134.03 174.95 9.93 Favored 'General case' 0 N--CA 1.452 -0.338 0 CA-C-O 121.251 0.548 . . . . 0.0 112.346 -167.729 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 44.6 t -65.42 157.33 29.68 Favored 'General case' 0 N--CA 1.455 -0.192 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.324 178.9 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 8.8 p30 -154.77 -172.51 4.22 Favored 'General case' 0 N--CA 1.453 -0.284 0 N-CA-C 109.359 -0.608 . . . . 0.0 109.359 -176.553 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 38.5 t -59.66 -16.84 29.24 Favored 'General case' 0 CA--C 1.532 0.27 0 C-N-CA 123.125 0.57 . . . . 0.0 112.0 -176.396 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 33.7 t 52.85 29.14 7.25 Favored 'General case' 0 CA--C 1.532 0.285 0 N-CA-C 113.389 0.885 . . . . 0.0 113.389 174.919 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 43.2 t -65.39 162.7 17.16 Favored 'General case' 0 N--CA 1.453 -0.302 0 C-N-CA 122.596 0.358 . . . . 0.0 111.123 -179.963 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 72.1 m-20 -65.79 -34.21 77.64 Favored 'General case' 0 N--CA 1.454 -0.266 0 C-N-CA 122.533 0.333 . . . . 0.0 111.735 -175.827 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 90' ' ' LYS . . . . . 0.448 ' HB3' ' CD ' ' A' ' 91' ' ' PRO . 55.1 tptt -161.06 -67.63 0.02 OUTLIER Pre-proline 0 CA--C 1.535 0.396 0 CA-C-O 117.861 -1.066 . . . . 0.0 111.187 176.47 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 91' ' ' PRO . . . . . 0.448 ' CD ' ' HB3' ' A' ' 90' ' ' LYS . 83.7 Cg_endo -73.32 152.93 50.39 Favored 'Trans proline' 0 N--CA 1.453 -0.877 0 C-N-CA 122.523 2.148 . . . . 0.0 108.94 174.819 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 88.64 15.33 60.05 Favored Glycine 0 CA--C 1.526 0.762 0 C-N-CA 121.186 -0.53 . . . . 0.0 112.175 -177.753 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -152.48 164.35 37.75 Favored 'General case' 0 N--CA 1.455 -0.187 0 C-N-CA 124.025 0.93 . . . . 0.0 110.042 179.679 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 94' ' ' CYS . . . . . 0.593 ' SG ' HD13 ' A' ' 98' ' ' ILE . 2.5 t -52.63 -26.47 13.74 Favored 'General case' 0 N--CA 1.453 -0.317 0 C-N-CA 123.316 0.646 . . . . 0.0 110.716 175.93 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -55.74 -58.76 6.48 Favored 'General case' 0 N--CA 1.449 -0.501 0 O-C-N 122.164 -0.335 . . . . 0.0 110.598 -176.98 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 76.3 t60 -75.49 -32.96 60.74 Favored 'General case' 0 N--CA 1.453 -0.306 0 O-C-N 122.286 -0.259 . . . . 0.0 111.117 -179.833 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -65.4 -51.86 57.45 Favored 'General case' 0 N--CA 1.449 -0.493 0 O-C-N 122.977 0.173 . . . . 0.0 111.453 -176.255 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 98' ' ' ILE . . . . . 0.593 HD13 ' SG ' ' A' ' 94' ' ' CYS . 1.7 mp -72.03 -34.18 49.67 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.153 0 N-CA-C 110.18 -0.304 . . . . 0.0 110.18 -179.248 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 1.7 m120 -66.87 -46.18 75.78 Favored 'General case' 0 N--CA 1.452 -0.355 0 C-N-CA 120.319 -0.552 . . . . 0.0 111.304 178.281 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 87.8 m -67.95 -35.03 77.7 Favored 'General case' 0 N--CA 1.456 -0.125 0 CA-C-N 118.077 0.399 . . . . 0.0 110.896 -176.319 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 57.7 tp -75.9 -39.83 55.57 Favored 'General case' 0 N--CA 1.449 -0.489 0 CA-C-O 119.779 -0.153 . . . . 0.0 111.05 -179.261 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -66.37 -16.09 64.49 Favored Glycine 0 CA--C 1.528 0.849 0 CA-C-O 119.634 -0.537 . . . . 0.0 112.717 -175.549 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 103' ' ' GLU . . . . . 0.417 ' HA ' ' HE3' ' A' ' 139' ' ' LYS . 14.9 mm-40 -78.83 -34.77 44.9 Favored 'General case' 0 N--CA 1.455 -0.211 0 CA-C-N 117.754 0.777 . . . . 0.0 112.133 179.908 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 18.9 m -112.44 3.47 8.4 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.135 0 O-C-N 124.007 0.817 . . . . 0.0 112.88 -174.027 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 105' ' ' ILE . . . . . . . . . . . . . 10.9 tp -68.93 -26.93 33.68 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.224 0 O-C-N 121.927 -0.483 . . . . 0.0 111.49 -177.915 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 14.1 pt20 -70.32 -31.56 68.93 Favored 'General case' 0 N--CA 1.455 -0.214 0 O-C-N 121.786 -0.571 . . . . 0.0 110.085 -178.888 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 48.4 mp0 -71.49 -38.74 71.15 Favored 'General case' 0 N--CA 1.451 -0.394 0 CA-C-N 118.256 0.48 . . . . 0.0 110.32 177.705 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 87.3 mt -74.11 -36.24 64.2 Favored 'General case' 0 N--CA 1.455 -0.212 0 N-CA-C 110.669 -0.122 . . . . 0.0 110.669 -178.401 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 87.6 mt -71.58 -47.7 53.14 Favored 'General case' 0 N--CA 1.452 -0.344 0 C-N-CA 120.874 -0.33 . . . . 0.0 110.295 176.133 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 48.3 t -57.16 -40.34 77.06 Favored 'General case' 0 N--CA 1.457 -0.105 0 C-N-CA 122.435 0.294 . . . . 0.0 110.604 179.716 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 39.8 t0 -64.12 -42.75 96.72 Favored 'General case' 0 N--CA 1.453 -0.282 0 N-CA-C 109.256 -0.646 . . . . 0.0 109.256 176.156 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -70.79 -39.01 73.39 Favored 'General case' 0 N--CA 1.445 -0.68 0 CA-C-O 119.141 -0.457 . . . . 0.0 111.36 -175.252 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 113' ' ' ILE . . . . . . . . . . . . . 12.1 mm -68.65 -38.53 79.12 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.276 0 CA-C-N 119.592 1.087 . . . . 0.0 109.75 -179.308 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -67.2 -47.6 70.41 Favored 'General case' 0 N--CA 1.45 -0.464 0 C-N-CA 122.839 0.456 . . . . 0.0 111.707 178.234 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 115' ' ' LYS . . . . . 0.588 ' HE2' ' HA ' ' A' ' 115' ' ' LYS . 0.3 OUTLIER -84.05 -34.79 24.16 Favored 'General case' 0 N--CA 1.455 -0.194 0 N-CA-C 114.018 1.118 . . . . 0.0 114.018 -172.907 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 116' ' ' SER . . . . . 0.453 ' HB2' ' CB ' ' A' ' 120' ' ' HIS . 28.3 p -77.63 159.42 29.21 Favored 'General case' 0 CA--C 1.528 0.121 0 N-CA-C 112.527 0.565 . . . . 0.0 112.527 -172.505 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 7.8 t-20 -80.35 164.58 23.02 Favored 'General case' 0 C--O 1.225 -0.22 0 C-N-CA 123.713 0.805 . . . . 0.0 111.127 -178.461 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 118' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -44.76 -48.86 10.85 Favored 'General case' 0 N--CA 1.455 -0.197 0 C-N-CA 124.034 0.934 . . . . 0.0 113.05 -179.176 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 49.8 t0 -60.76 -39.69 89.68 Favored 'General case' 0 CA--C 1.531 0.217 0 CA-C-O 121.002 0.429 . . . . 0.0 110.192 178.51 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 120' ' ' HIS . . . . . 0.453 ' CB ' ' HB2' ' A' ' 116' ' ' SER . 24.9 m170 -68.67 -40.8 79.96 Favored 'General case' 0 N--CA 1.451 -0.38 0 N-CA-C 109.69 -0.485 . . . . 0.0 109.69 -179.053 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 94.8 mttt -59.26 -34.6 72.44 Favored 'General case' 0 C--N 1.339 0.127 0 N-CA-C 109.446 -0.576 . . . . 0.0 109.446 178.87 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 24.2 tt0 -67.58 -45.98 73.97 Favored 'General case' 0 N--CA 1.455 -0.193 0 C-N-CA 122.527 0.331 . . . . 0.0 110.766 179.134 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 14.4 mptt -68.18 -35.42 77.99 Favored 'General case' 0 C--N 1.338 0.099 0 C-N-CA 120.42 -0.512 . . . . 0.0 110.386 -177.753 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 124' ' ' ILE . . . . . . . . . . . . . 63.5 mt -66.7 -38.52 81.74 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.207 0 N-CA-C 108.96 -0.756 . . . . 0.0 108.96 177.513 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 125' ' ' ARG . . . . . 0.442 ' HD2' ' HA ' ' A' ' 125' ' ' ARG . 25.0 tpt85 -66.39 -42.22 88.21 Favored 'General case' 0 N--CA 1.443 -0.776 0 N-CA-C 111.849 0.314 . . . . 0.0 111.849 -172.431 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 126' ' ' MET . . . . . . . . . . . . . 27.1 ptm -67.13 -33.28 75.1 Favored 'General case' 0 N--CA 1.45 -0.436 0 N-CA-C 108.965 -0.754 . . . . 0.0 108.965 175.606 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 2.7 mp -61.92 -34.55 76.28 Favored 'General case' 0 CA--C 1.53 0.203 0 CA-C-O 119.271 -0.395 . . . . 0.0 110.146 176.227 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 53.6 mt -68.1 -43.46 78.4 Favored 'General case' 0 N--CA 1.455 -0.201 0 CA-C-N 119.139 0.881 . . . . 0.0 110.459 178.743 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 55.3 m-20 -65.47 -37.74 87.74 Favored 'General case' 0 CA--C 1.529 0.163 0 C-N-CA 120.314 -0.555 . . . . 0.0 110.042 177.925 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 130' ' ' ILE . . . . . 0.46 ' HA ' ' HD3' ' A' ' 133' ' ' ARG . 53.1 mt -63.06 -36.39 75.65 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.319 0 C-N-CA 122.766 0.426 . . . . 0.0 110.297 178.516 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 131' ' ' TRP . . . . . . . . . . . . . 51.4 m0 -74.55 -34.86 63.06 Favored 'General case' 0 N--CA 1.453 -0.299 0 N-CA-C 112.522 0.564 . . . . 0.0 112.522 -179.27 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 90.1 m-20 -68.21 -28.42 67.23 Favored 'General case' 0 CA--C 1.53 0.188 0 CA-C-N 118.541 0.609 . . . . 0.0 110.531 175.789 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 133' ' ' ARG . . . . . 0.475 ' HB2' HD13 ' B' 2062 ' ' ILE . 13.3 mtp180 -72.42 -33.5 67.16 Favored 'General case' 0 N--CA 1.457 -0.087 0 C-N-CA 122.774 0.43 . . . . 0.0 110.832 177.301 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 30.4 t -74.37 -18.8 60.63 Favored 'General case' 0 CA--C 1.531 0.224 0 CA-C-N 118.014 0.37 . . . . 0.0 110.676 173.449 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 135' ' ' GLY . . . . . . . . . . . . . . . 87.18 17.97 58.29 Favored Glycine 0 CA--C 1.528 0.89 0 CA-C-O 119.423 -0.654 . . . . 0.0 112.221 -179.257 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 136' ' ' LEU . . . . . . . . . . . . . 42.6 mt -62.68 132.79 53.5 Favored 'General case' 0 N--CA 1.456 -0.15 0 CA-C-N 117.959 0.879 . . . . 0.0 110.174 179.641 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 137' ' ' PHE . . . . . . . . . . . . . 78.1 t80 -75.34 128.22 34.89 Favored 'General case' 0 N--CA 1.451 -0.4 0 N-CA-C 109.148 -0.686 . . . . 0.0 109.148 175.529 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 138' ' ' GLN . . . . . . . . . . . . . 20.7 pt20 -159.46 151.53 20.81 Favored 'General case' 0 N--CA 1.45 -0.427 0 CA-C-O 120.803 0.335 . . . . 0.0 111.183 -179.61 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 139' ' ' LYS . . . . . 0.417 ' HE3' ' HA ' ' A' ' 103' ' ' GLU . 95.1 mttt -84.49 17.12 2.77 Favored 'General case' 0 N--CA 1.457 -0.125 0 C-N-CA 123.706 0.803 . . . . 0.0 110.494 175.306 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 140' ' ' SER . . . . . . . . . . . . . 33.1 t -70.37 27.5 0.03 OUTLIER 'General case' 0 CA--C 1.531 0.216 0 C-N-CA 124.205 1.002 . . . . 0.0 113.356 -174.805 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 141' ' ' TYR . . . . . . . . . . . . . 12.3 m-85 -121.35 -6.52 9.32 Favored 'General case' 0 N--CA 1.454 -0.261 0 O-C-N 122.173 -0.329 . . . . 0.0 111.824 -176.93 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 142' ' ' LEU . . . . . . . . . . . . . 9.4 mp -79.47 163.07 25.04 Favored 'General case' 0 N--CA 1.454 -0.225 0 CA-C-O 121.059 0.457 . . . . 0.0 110.757 178.881 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 76.3 m-20 -66.64 -15.69 63.65 Favored 'General case' 0 CA--C 1.529 0.145 0 N-CA-C 112.442 0.534 . . . . 0.0 112.442 -178.372 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . -65.42 -31.79 73.08 Favored 'General case' 0 N--CA 1.452 -0.339 0 N-CA-C 110.115 -0.328 . . . . 0.0 110.115 179.546 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 145' ' ' ILE . . . . . . . . . . . . . 37.0 mm -64.47 -30.84 51.3 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.35 0 C-N-CA 122.462 0.305 . . . . 0.0 110.523 178.044 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 146' ' ' ARG . . . . . . . . . . . . . 7.4 mpt_? -75.51 -58.18 3.44 Favored 'General case' 0 N--CA 1.453 -0.302 0 N-CA-C 109.808 -0.441 . . . . 0.0 109.808 -179.626 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 147' ' ' SER . . . . . . . . . . . . . 69.9 m 38.77 44.68 0.84 Allowed 'General case' 0 C--N 1.341 0.23 0 C-N-CA 123.238 0.615 . . . . 0.0 111.723 -179.02 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 148' ' ' LYS . . . . . 0.623 ' HD3' ' H ' ' A' ' 148' ' ' LYS . 0.0 OUTLIER -52.18 -23.84 6.18 Favored 'General case' 0 N--CA 1.456 -0.134 0 C-N-CA 124.045 0.938 . . . . 0.0 112.466 -175.695 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 149' ' ' CYS . . . . . . . . . . . . . 59.9 m -66.11 -61.31 2.1 Favored 'General case' 0 N--CA 1.451 -0.383 0 N-CA-C 109.552 -0.536 . . . . 0.0 109.552 -179.771 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 150' ' ' PHE . . . . . . . . . . . . . 9.4 m-85 -62.61 -29.91 70.95 Favored 'General case' 0 N--CA 1.454 -0.254 0 CA-C-O 120.463 0.173 . . . . 0.0 110.716 -177.114 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 151' ' ' ALA . . . . . . . . . . . . . . . -67.5 -35.73 79.69 Favored 'General case' 0 N--CA 1.452 -0.369 0 CA-C-N 116.747 -0.206 . . . . 0.0 110.574 -179.644 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 152' ' ' MET . . . . . . . . . . . . . 5.2 mmt -88.67 -14.23 37.86 Favored 'General case' 0 CA--C 1.529 0.171 0 N-CA-C 111.935 0.346 . . . . 0.0 111.935 178.493 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 153' ' ' ASP . . . . . . . . . . . . . 94.7 m-20 -75.75 -22.59 56.37 Favored 'General case' 0 CA--C 1.531 0.218 0 N-CA-C 112.906 0.706 . . . . 0.0 112.906 179.507 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 154' ' ' LEU . . . . . . . . . . . . . 39.9 mt -109.37 4.82 22.94 Favored 'General case' 0 C--N 1.34 0.169 0 N-CA-C 113.811 1.041 . . . . 0.0 113.811 -173.22 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 155' ' ' GLU . . . . . . . . . . . . . 23.1 pt-20 -161.57 171.37 18.17 Favored 'General case' 0 C--N 1.33 -0.277 0 C-N-CA 122.71 0.404 . . . . 0.0 110.903 177.104 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 156' ' ' HIS . . . . . . . . . . . . . 69.7 t60 -62.1 154.34 27.31 Favored 'General case' 0 N--CA 1.454 -0.245 0 CA-C-O 120.928 0.394 . . . . 0.0 110.841 179.927 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 157' ' ' HIS . . . . . . . . . . . . . 46.3 m170 -79.78 18.64 0.75 Allowed 'General case' 0 CA--C 1.531 0.221 0 N-CA-C 112.738 0.644 . . . . 0.0 112.738 -174.274 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 158' ' ' HIS . . . . . . . . . . . . . 17.7 m170 61.62 11.04 3.65 Favored 'General case' 0 CA--C 1.53 0.184 0 C-N-CA 124.388 1.075 . . . . 0.0 113.312 179.611 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 159' ' ' HIS . . . . . . . . . . . . . 56.6 m170 . . . . . 0 C--O 1.251 1.139 0 CA-C-O 117.313 -1.327 . . . . 0.0 110.595 178.054 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' B' B 2052 ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 N--CA 1.471 0.589 0 N-CA-C 109.767 -0.457 . . . . 0.0 109.767 . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B 2053 ' ' ASP . . . . . 0.436 ' CB ' HH22 ' A' ' 28' ' ' ARG . 3.9 m-20 59.69 -73.67 0.03 OUTLIER 'General case' 0 CA--C 1.53 0.192 0 C-N-CA 125.317 1.447 . . . . 0.0 114.3 -179.729 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B 2054 ' ' ASP . . . . . . . . . . . . . 41.9 p-10 -155.6 149.13 25.02 Favored 'General case' 0 N--CA 1.453 -0.307 0 C-N-CA 122.988 0.515 . . . . 0.0 111.811 -172.161 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B 2055 ' ' GLU . . . . . . . . . . . . . 47.2 mt-10 43.99 45.04 6.43 Favored 'General case' 0 C--N 1.339 0.113 0 C-N-CA 124.058 0.943 . . . . 0.0 112.331 175.745 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B 2056 ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -62.15 -1.47 0.72 Allowed 'General case' 0 CA--C 1.536 0.422 0 C-N-CA 122.988 0.515 . . . . 0.0 112.108 -177.999 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B 2057 ' ' ASP . . . . . . . . . . . . . 64.3 t0 -154.0 103.76 2.6 Favored 'General case' 0 N--CA 1.453 -0.281 0 N-CA-C 107.382 -1.34 . . . . 0.0 107.382 168.367 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B 2058 ' ' TYR . . . . . . . . . . . . . 0.8 OUTLIER -70.8 -0.62 9.4 Favored 'General case' 0 CA--C 1.529 0.145 0 N-CA-C 111.942 0.349 . . . . 0.0 111.942 -176.139 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B 2059 ' ' THR . . . . . . . . . . . . . 56.0 m 56.0 76.4 0.5 Allowed Pre-proline 0 CA--C 1.531 0.213 0 C-N-CA 124.318 1.047 . . . . 0.0 110.849 178.239 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B 2060 ' ' PRO . . . . . . . . . . . . . 57.9 Cg_endo -65.09 146.67 87.62 Favored 'Trans proline' 0 N--CA 1.451 -1.004 0 C-N-CA 123.306 2.671 . . . . 0.0 110.592 179.385 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B 2061 ' ' SER . . . . . . . . . . . . . 48.0 t -156.15 154.87 31.55 Favored 'General case' 0 N--CA 1.456 -0.154 0 N-CA-C 109.925 -0.398 . . . . 0.0 109.925 -178.767 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B 2062 ' ' ILE . . . . . 0.475 HD13 ' HB2' ' A' ' 133' ' ' ARG . 15.1 tt -164.64 161.91 0.89 Allowed 'Isoleucine or valine' 0 N--CA 1.455 -0.211 0 N-CA-C 108.777 -0.823 . . . . 0.0 108.777 -178.496 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B 2063 ' ' SER . . . . . . . . . . . . . 80.7 p . . . . . 0 C--O 1.252 1.199 0 CA-C-O 117.484 -1.246 . . . . 0.0 109.739 174.84 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 74.2 mtm . . . . . 0 N--CA 1.476 0.826 0 N-CA-C 109.841 -0.429 . . . . 0.0 109.841 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 3.4 pm0 -63.01 -22.05 66.58 Favored 'General case' 0 N--CA 1.455 -0.195 0 C-N-CA 124.341 1.056 . . . . 0.0 109.932 173.312 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . 0.511 ' HG2' ' H ' ' A' ' 4' ' ' ASP . 6.6 tt0 -162.62 -174.15 3.85 Favored 'General case' 0 N--CA 1.45 -0.463 0 N-CA-C 106.545 -1.65 . . . . 0.0 106.545 177.819 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 4' ' ' ASP . . . . . 0.511 ' H ' ' HG2' ' A' ' 3' ' ' GLN . 12.1 p-10 -72.92 122.16 21.2 Favored 'General case' 0 N--CA 1.452 -0.336 0 N-CA-C 108.309 -0.997 . . . . 0.0 108.309 173.898 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 65.5 m-20 -78.26 10.6 2.9 Favored 'General case' 0 CA--C 1.521 -0.159 0 N-CA-C 114.715 1.376 . . . . 0.0 114.715 -169.892 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 23.1 p-10 -93.19 -42.7 9.22 Favored 'General case' 0 C--N 1.328 -0.348 0 N-CA-C 106.835 -1.543 . . . . 0.0 106.835 170.816 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 7' ' ' PHE . . . . . 0.44 ' CE1' HD22 ' A' ' 49' ' ' LEU . 0.7 OUTLIER -75.05 -34.3 61.82 Favored 'General case' 0 N--CA 1.441 -0.886 0 CA-C-N 115.341 -0.845 . . . . 0.0 110.129 -179.023 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 60.5 tp60 -48.19 -39.84 22.27 Favored 'General case' 0 CA--C 1.529 0.163 0 C-N-CA 123.984 0.914 . . . . 0.0 112.125 -175.427 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 4.1 m-80 -70.16 -38.65 75.49 Favored 'General case' 0 CA--C 1.529 0.173 0 CA-C-O 121.264 0.554 . . . . 0.0 110.283 -178.867 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 1.8 t80 -70.82 -37.38 73.2 Favored 'General case' 0 N--CA 1.451 -0.425 0 C-N-CA 124.289 1.036 . . . . 0.0 109.601 179.503 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 74.9 t -68.6 -52.9 31.26 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.302 0 N-CA-C 108.872 -0.788 . . . . 0.0 108.872 179.322 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -57.91 -31.43 66.77 Favored 'General case' 0 N--CA 1.453 -0.29 0 CA-C-N 117.78 0.264 . . . . 0.0 111.519 -179.135 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 82.9 m -69.31 -42.67 75.1 Favored 'General case' 0 CA--C 1.534 0.332 0 N-CA-C 109.015 -0.735 . . . . 0.0 109.015 175.366 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.459 HD11 ' CD2' ' A' ' 53' ' ' TYR . 0.1 OUTLIER -64.09 -40.23 95.77 Favored 'General case' 0 N--CA 1.454 -0.232 0 C-N-CA 122.947 0.499 . . . . 0.0 110.039 179.152 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 73.1 mm-40 -65.27 -32.5 74.19 Favored 'General case' 0 N--CA 1.451 -0.38 0 C-N-CA 123.565 0.746 . . . . 0.0 109.702 179.558 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 16.2 p -65.14 -34.28 78.02 Favored 'General case' 0 N--CA 1.454 -0.253 0 N-CA-C 109.537 -0.542 . . . . 0.0 109.537 176.068 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 17' ' ' PHE . . . . . 0.536 ' CD1' HD11 ' A' ' 68' ' ' ILE . 14.8 m-30 -67.18 -34.26 77.15 Favored 'General case' 0 N--CA 1.458 -0.038 0 C-N-CA 121.187 -0.205 . . . . 0.0 111.529 175.845 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . 0.513 ' HG2' ' CE1' ' A' ' 53' ' ' TYR . 53.2 mttt -68.99 -24.9 64.28 Favored 'General case' 0 C--O 1.227 -0.089 0 N-CA-C 110.084 -0.339 . . . . 0.0 110.084 175.172 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 30.6 t0 -78.43 -23.9 46.41 Favored 'General case' 0 CA--C 1.534 0.359 0 C-N-CA 123.106 0.563 . . . . 0.0 111.811 178.23 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 93.3 mt -75.53 164.93 25.84 Favored 'General case' 0 CA--C 1.529 0.17 0 CA-C-O 121.132 0.492 . . . . 0.0 111.196 179.101 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -94.01 -45.53 7.55 Favored 'General case' 0 N--CA 1.455 -0.212 0 N-CA-C 108.573 -0.899 . . . . 0.0 108.573 177.533 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 53.9 m -80.43 -16.35 54.62 Favored 'General case' 0 CA--C 1.529 0.139 0 C-N-CA 122.949 0.5 . . . . 0.0 111.563 -179.235 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 72.6 -29.05 0.73 Allowed Glycine 0 CA--C 1.529 0.963 0 C-N-CA 124.29 0.948 . . . . 0.0 113.203 178.134 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 94.6 mt -75.81 147.54 7.95 Favored 'Isoleucine or valine' 0 C--N 1.339 0.109 0 CA-C-N 117.94 0.87 . . . . 0.0 109.455 177.028 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 6.4 t -163.7 78.23 0.41 Allowed 'General case' 0 N--CA 1.453 -0.312 0 N-CA-C 110.322 -0.251 . . . . 0.0 110.322 -178.495 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -45.72 -52.74 9.12 Favored Glycine 0 CA--C 1.527 0.798 0 CA-C-O 118.928 -0.929 . . . . 0.0 114.126 -170.63 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 37.8 t -65.5 -45.04 85.12 Favored 'General case' 0 N--CA 1.456 -0.157 0 CA-C-N 119.432 1.616 . . . . 0.0 110.918 -175.374 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 17.1 mtm180 -70.48 -37.64 74.26 Favored 'General case' 0 CA--C 1.527 0.091 0 CA-C-O 119.385 -0.341 . . . . 0.0 111.228 -179.356 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 63.4 mt -56.5 -43.92 79.25 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.474 0 N-CA-C 108.185 -1.042 . . . . 0.0 108.185 172.105 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 46.0 mtmt -70.81 -19.3 62.69 Favored 'General case' 0 N--CA 1.452 -0.337 0 CA-C-O 118.653 -0.689 . . . . 0.0 111.753 179.382 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . 0.518 ' HA ' ' HE3' ' A' ' 31' ' ' LYS . 0.0 OUTLIER -69.32 -55.17 11.21 Favored 'General case' 0 C--N 1.343 0.284 0 CA-C-N 119.223 0.919 . . . . 0.0 109.585 174.793 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.422 HD12 ' N ' ' A' ' 33' ' ' THR . 3.2 pp -75.18 -19.71 59.69 Favored 'General case' 0 N--CA 1.456 -0.145 0 C-N-CA 119.567 -0.853 . . . . 0.0 111.177 -178.773 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . 0.422 ' N ' HD12 ' A' ' 32' ' ' LEU . 53.3 m -71.84 -43.18 65.97 Favored 'General case' 0 N--CA 1.453 -0.314 0 N-CA-C 108.923 -0.769 . . . . 0.0 108.923 175.535 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 80.6 m -67.39 -37.53 83.27 Favored 'General case' 0 N--CA 1.453 -0.284 0 O-C-N 122.359 -0.213 . . . . 0.0 110.449 -177.7 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 81.0 t80 -68.68 -34.42 75.65 Favored 'General case' 0 N--CA 1.45 -0.467 0 O-C-N 122.285 -0.259 . . . . 0.0 110.493 177.451 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -68.48 -36.18 78.58 Favored 'General case' 0 N--CA 1.451 -0.421 0 O-C-N 122.288 -0.257 . . . . 0.0 110.352 177.688 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -69.86 -33.84 72.8 Favored 'General case' 0 N--CA 1.455 -0.208 0 C-N-CA 122.729 0.412 . . . . 0.0 110.32 179.357 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 43.5 t0 -69.44 -21.59 63.72 Favored 'General case' 0 N--CA 1.451 -0.393 0 C-N-CA 122.564 0.346 . . . . 0.0 110.767 176.129 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 95.6 m-70 -150.67 95.62 2.25 Favored 'General case' 0 C--N 1.341 0.22 0 N-CA-C 112.208 0.447 . . . . 0.0 112.208 -175.413 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 40' ' ' ILE . . . . . 0.617 ' H ' HD13 ' A' ' 40' ' ' ILE . 0.0 OUTLIER -74.28 -13.28 15.64 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.291 0 CA-C-O 119.529 -0.272 . . . . 0.0 110.311 175.09 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 19.1 m-20 -57.68 -22.46 46.16 Favored 'General case' 0 N--CA 1.456 -0.131 0 C-N-CA 122.975 0.51 . . . . 0.0 112.104 -176.997 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -108.77 18.38 6.6 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.185 0 C-N-CA 122.897 0.479 . . . . 0.0 112.255 178.384 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 3.1 pp20? -52.85 -27.58 19.03 Favored 'General case' 0 C--O 1.226 -0.165 0 CA-C-N 118.365 0.529 . . . . 0.0 109.582 174.785 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 90.3 p -58.94 -55.11 39.42 Favored 'General case' 0 N--CA 1.453 -0.294 0 C-N-CA 123.668 0.787 . . . . 0.0 111.315 -178.708 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . 0.435 ' HD3' ' CD1' ' A' ' 7' ' ' PHE . 17.0 ptpt -73.76 -21.5 60.17 Favored 'General case' 0 C--N 1.338 0.108 0 O-C-N 122.298 -0.251 . . . . 0.0 110.98 -179.858 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 93.5 mt -74.37 -45.61 46.01 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.198 0 N-CA-C 110.045 -0.354 . . . . 0.0 110.045 -179.81 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 34.6 mm -66.35 -38.85 82.71 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.126 0 N-CA-C 109.422 -0.584 . . . . 0.0 109.422 178.66 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 27.4 t -63.05 -38.92 93.11 Favored 'General case' 0 N--CA 1.453 -0.278 0 C-N-CA 119.657 -0.817 . . . . 0.0 109.887 177.332 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . 0.44 HD22 ' CE1' ' A' ' 7' ' ' PHE . 32.7 tp -72.03 -31.89 66.61 Favored 'General case' 0 N--CA 1.449 -0.52 0 N-CA-C 112.615 0.598 . . . . 0.0 112.615 -173.772 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 14.4 pt -70.82 -41.34 77.33 Favored 'Isoleucine or valine' 0 C--N 1.34 0.169 0 CA-C-N 118.785 0.72 . . . . 0.0 110.099 175.996 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 42.4 pt -71.38 -37.74 66.24 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.171 0 C-N-CA 119.875 -0.73 . . . . 0.0 110.85 179.664 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 84.5 m-20 -65.37 -44.99 85.88 Favored 'General case' 0 C--O 1.233 0.214 0 CA-C-N 117.927 0.331 . . . . 0.0 111.307 177.849 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 53' ' ' TYR . . . . . 0.513 ' CE1' ' HG2' ' A' ' 18' ' ' LYS . 9.3 t80 -60.64 -42.94 97.94 Favored 'General case' 0 C--N 1.34 0.189 0 N-CA-C 108.893 -0.78 . . . . 0.0 108.893 176.365 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 25.0 m -69.21 -26.93 65.06 Favored 'General case' 0 N--CA 1.453 -0.319 0 C-N-CA 122.197 0.199 . . . . 0.0 111.479 -177.899 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 51.9 tpt85 -75.78 -35.13 60.21 Favored 'General case' 0 N--CA 1.455 -0.194 0 O-C-N 121.985 -0.447 . . . . 0.0 111.336 -178.697 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 32.4 mt -89.08 -43.17 11.27 Favored 'General case' 0 N--CA 1.457 -0.113 0 N-CA-C 112.772 0.656 . . . . 0.0 112.772 -177.548 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 57' ' ' CYS . . . . . 0.44 ' HB2' ' CB ' ' A' ' 61' ' ' HIS . 3.4 p -65.89 157.86 78.08 Favored Pre-proline 0 CA--C 1.536 0.422 0 N-CA-C 114.981 1.474 . . . . 0.0 114.981 -169.715 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 58' ' ' PRO . . . . . 0.415 ' HD2' ' HB2' ' A' ' 57' ' ' CYS . 51.5 Cg_endo -78.12 -166.92 0.43 Allowed 'Trans proline' 0 N--CA 1.456 -0.677 1 C-N-CA 125.72 4.28 . . . . 0.0 111.243 175.29 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 29.9 p-10 -61.7 -52.26 65.05 Favored 'General case' 0 CA--C 1.53 0.2 0 C-N-CA 125.131 1.372 . . . . 0.0 113.793 -172.15 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 40.3 m -67.73 -34.25 76.47 Favored 'General case' 0 N--CA 1.455 -0.198 0 CA-C-O 120.709 0.29 . . . . 0.0 110.615 -174.234 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 61' ' ' HIS . . . . . 0.44 ' CB ' ' HB2' ' A' ' 57' ' ' CYS . 55.3 m170 -74.33 -23.29 59.03 Favored 'General case' 0 N--CA 1.452 -0.33 0 N-CA-C 109.901 -0.407 . . . . 0.0 109.901 176.132 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 4.4 tppt? -67.36 -39.8 85.73 Favored 'General case' 0 N--CA 1.455 -0.215 0 N-CA-C 108.978 -0.749 . . . . 0.0 108.978 176.558 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -67.49 -42.41 82.96 Favored 'General case' 0 N--CA 1.454 -0.254 0 N-CA-C 108.875 -0.787 . . . . 0.0 108.875 177.221 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -66.14 -31.0 77.94 Favored Glycine 0 C--N 1.339 0.738 0 N-CA-C 111.116 -0.794 . . . . 0.0 111.116 179.533 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 50.5 m -67.29 -43.04 82.75 Favored 'General case' 0 N--CA 1.455 -0.189 0 N-CA-C 109.808 -0.442 . . . . 0.0 109.808 177.571 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 61.3 mt -68.51 -25.98 65.22 Favored 'General case' 0 N--CA 1.453 -0.311 0 CA-C-O 119.554 -0.26 . . . . 0.0 110.79 179.384 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 1.4 m-85 -70.94 -37.81 72.87 Favored 'General case' 0 N--CA 1.455 -0.215 0 CA-C-N 117.778 0.263 . . . . 0.0 110.721 175.473 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 68' ' ' ILE . . . . . 0.536 HD11 ' CD1' ' A' ' 17' ' ' PHE . 14.7 mt -67.69 -46.9 81.78 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.472 0 N-CA-C 108.859 -0.793 . . . . 0.0 108.859 176.401 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 95.7 mt -57.39 -37.5 57.69 Favored 'Isoleucine or valine' 0 C--N 1.339 0.128 0 C-N-CA 123.49 0.716 . . . . 0.0 111.071 176.641 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 17.6 t70 -69.42 -43.6 73.07 Favored 'General case' 0 N--CA 1.455 -0.19 0 CA-C-N 118.161 0.437 . . . . 0.0 110.291 178.421 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 29.4 t -66.63 -57.33 7.42 Favored 'General case' 0 N--CA 1.451 -0.385 0 C-N-CA 122.733 0.413 . . . . 0.0 110.988 -176.993 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -75.57 -32.32 24.71 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.408 0 N-CA-C 109.868 -0.419 . . . . 0.0 109.868 -176.733 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -64.84 -50.55 57.77 Favored Glycine 0 C--N 1.337 0.606 0 N-CA-C 111.385 -0.686 . . . . 0.0 111.385 -175.587 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 37.1 mtm105 -71.88 -39.13 69.84 Favored 'General case' 0 N--CA 1.451 -0.383 0 CA-C-N 117.481 0.64 . . . . 0.0 110.134 178.81 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -62.16 -33.94 75.46 Favored 'General case' 0 N--CA 1.452 -0.357 0 C-N-CA 120.54 -0.464 . . . . 0.0 110.751 -179.122 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 1.4 m-30 -69.79 -49.85 48.8 Favored 'General case' 0 CA--C 1.52 -0.204 0 CA-C-N 118.419 0.554 . . . . 0.0 111.023 175.764 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 2.5 tm? -67.93 -35.85 79.14 Favored 'General case' 0 N--CA 1.45 -0.443 0 C-N-CA 118.689 -1.204 . . . . 0.0 109.092 -175.024 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 92.6 m-20 -65.79 -46.9 76.96 Favored 'General case' 0 C--O 1.231 0.116 0 N-CA-C 112.488 0.551 . . . . 0.0 112.488 177.166 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 13.6 tm-20 -65.02 -47.77 76.25 Favored 'General case' 0 N--CA 1.448 -0.573 0 C-N-CA 121.096 -0.241 . . . . 0.0 110.55 -179.027 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 80' ' ' THR . . . . . 0.568 HG21 ' HB3' ' A' ' 94' ' ' CYS . 68.4 p -67.27 -28.33 67.94 Favored 'General case' 0 N--CA 1.45 -0.463 0 CA-C-O 119.502 -0.285 . . . . 0.0 110.913 179.727 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 36.8 ttp-105 -69.93 -26.88 64.35 Favored 'General case' 0 C--N 1.338 0.088 0 CA-C-N 118.544 0.611 . . . . 0.0 110.182 173.401 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 22.5 m -86.29 -29.36 23.12 Favored 'General case' 0 N--CA 1.454 -0.242 0 N-CA-C 112.965 0.728 . . . . 0.0 112.965 -177.669 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 73.1 m-20 -136.41 10.22 3.2 Favored 'General case' 0 C--N 1.341 0.211 0 N-CA-C 113.758 1.022 . . . . 0.0 113.758 -172.852 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 21.9 t -155.12 -158.47 0.84 Allowed 'General case' 0 CA--C 1.533 0.311 0 CA-C-N 118.689 0.677 . . . . 0.0 110.216 -177.253 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 19.7 t-20 -151.35 139.17 19.85 Favored 'General case' 0 CA--C 1.532 0.254 0 N-CA-C 110.071 -0.344 . . . . 0.0 110.071 178.686 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 29.0 t -76.59 -5.4 47.56 Favored 'General case' 0 C--N 1.339 0.141 0 N-CA-C 113.064 0.765 . . . . 0.0 113.064 -174.557 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 80.1 p -73.38 -7.87 53.49 Favored 'General case' 0 C--O 1.231 0.095 0 CA-C-N 118.431 0.56 . . . . 0.0 110.181 175.427 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 77.6 p -75.2 53.49 0.64 Allowed 'General case' 0 CA--C 1.53 0.197 0 C-N-CA 124.301 1.041 . . . . 0.0 110.314 176.192 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 89' ' ' ASN . . . . . 0.403 ' HA ' ' HB1' ' A' ' 95' ' ' ALA . 69.3 m-80 -61.12 77.41 0.01 OUTLIER 'General case' 0 C--N 1.342 0.277 0 C-N-CA 125.407 1.483 . . . . 0.0 112.785 -176.657 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -155.73 163.35 25.01 Favored Pre-proline 0 N--CA 1.454 -0.259 0 C-N-CA 124.557 1.143 . . . . 0.0 108.465 172.747 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_exo -58.48 154.87 39.1 Favored 'Trans proline' 0 N--CA 1.453 -0.875 0 C-N-CA 123.415 2.743 . . . . 0.0 111.707 177.419 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 89.31 17.17 56.07 Favored Glycine 0 CA--C 1.528 0.851 0 CA-C-O 119.525 -0.597 . . . . 0.0 113.238 176.427 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -156.21 165.37 36.58 Favored 'General case' 0 N--CA 1.457 -0.076 0 CA-C-N 117.904 0.852 . . . . 0.0 109.557 178.724 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 94' ' ' CYS . . . . . 0.568 ' HB3' HG21 ' A' ' 80' ' ' THR . 31.5 p -55.55 -23.08 24.75 Favored 'General case' 0 N--CA 1.453 -0.317 0 C-N-CA 123.611 0.764 . . . . 0.0 110.813 178.729 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 95' ' ' ALA . . . . . 0.403 ' HB1' ' HA ' ' A' ' 89' ' ' ASN . . . -60.18 -60.35 3.96 Favored 'General case' 0 N--CA 1.445 -0.681 0 N-CA-C 110.098 -0.334 . . . . 0.0 110.098 -176.076 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 75.0 t60 -72.71 -31.45 65.02 Favored 'General case' 0 N--CA 1.451 -0.386 0 O-C-N 122.052 -0.405 . . . . 0.0 110.728 179.417 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -64.33 -53.67 45.04 Favored 'General case' 0 N--CA 1.452 -0.348 0 CA-C-O 119.686 -0.197 . . . . 0.0 111.366 -178.36 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 98' ' ' ILE . . . . . 0.424 HD13 ' HB2' ' A' ' 94' ' ' CYS . 1.9 mp -70.91 -34.31 55.33 Favored 'Isoleucine or valine' 0 C--N 1.339 0.109 0 CA-C-N 118.074 0.397 . . . . 0.0 110.244 -179.757 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 73.0 m-20 -62.56 -42.28 99.44 Favored 'General case' 0 N--CA 1.456 -0.165 0 CA-C-N 118.159 0.436 . . . . 0.0 110.883 177.719 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 92.2 m -74.54 -31.78 62.23 Favored 'General case' 0 N--CA 1.455 -0.178 0 N-CA-C 110.443 -0.206 . . . . 0.0 110.443 -178.705 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -70.82 -41.11 71.98 Favored 'General case' 0 N--CA 1.452 -0.359 0 C-N-CA 122.632 0.373 . . . . 0.0 110.742 -179.01 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -62.47 -20.74 61.6 Favored Glycine 0 CA--C 1.529 0.928 0 CA-C-O 119.63 -0.539 . . . . 0.0 113.741 -173.767 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 55.9 mm-40 -85.58 -36.06 20.66 Favored 'General case' 0 N--CA 1.455 -0.21 0 CA-C-N 118.362 1.081 . . . . 0.0 112.666 -179.837 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 59.0 t -92.14 -26.57 4.89 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.155 0 O-C-N 123.26 0.35 . . . . 0.0 111.765 -176.985 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 105' ' ' ILE . . . . . . . . . . . . . 10.5 tp -62.45 -26.0 39.32 Favored 'Isoleucine or valine' 0 C--N 1.338 0.075 0 O-C-N 122.111 -0.368 . . . . 0.0 111.672 -174.126 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 24.0 pt20 -69.73 -40.69 76.04 Favored 'General case' 0 N--CA 1.451 -0.404 0 C-N-CA 120.96 -0.296 . . . . 0.0 110.695 -178.765 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 76.8 mm-40 -80.89 -26.15 37.05 Favored 'General case' 0 N--CA 1.454 -0.252 0 CA-C-N 118.367 0.531 . . . . 0.0 110.743 176.696 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 6.8 tt -67.69 -42.59 81.81 Favored 'General case' 0 N--CA 1.454 -0.248 0 N-CA-C 108.891 -0.781 . . . . 0.0 108.891 176.277 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 69.2 mt -68.9 -45.42 70.95 Favored 'General case' 0 N--CA 1.449 -0.475 0 N-CA-C 109.192 -0.67 . . . . 0.0 109.192 173.921 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 43.2 t -47.4 -52.07 17.91 Favored 'General case' 0 C--O 1.234 0.264 0 CA-C-N 118.041 0.382 . . . . 0.0 111.087 178.471 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 40.7 t0 -62.09 -43.8 98.05 Favored 'General case' 0 N--CA 1.455 -0.175 0 N-CA-C 109.135 -0.691 . . . . 0.0 109.135 179.362 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -65.08 -39.69 93.56 Favored 'General case' 0 N--CA 1.45 -0.472 0 N-CA-C 112.237 0.458 . . . . 0.0 112.237 -176.424 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 113' ' ' ILE . . . . . . . . . . . . . 26.8 mm -69.08 -39.44 79.53 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.502 0 CA-C-N 119.133 0.879 . . . . 0.0 109.756 -176.714 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -74.95 -43.83 51.87 Favored 'General case' 0 N--CA 1.453 -0.291 0 C-N-CA 120.624 -0.431 . . . . 0.0 111.878 178.935 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 33.3 ttmt -80.0 -30.74 39.7 Favored 'General case' 0 C--O 1.227 -0.11 0 N-CA-C 113.892 1.071 . . . . 0.0 113.892 -173.159 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 116' ' ' SER . . . . . 0.457 ' HB2' ' CB ' ' A' ' 120' ' ' HIS . 50.6 p -80.0 157.28 26.84 Favored 'General case' 0 CA--C 1.529 0.166 0 N-CA-C 111.974 0.361 . . . . 0.0 111.974 -174.139 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 53.1 t30 -76.21 166.5 23.37 Favored 'General case' 0 N--CA 1.454 -0.226 0 C-N-CA 123.323 0.649 . . . . 0.0 110.269 -179.056 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 118' ' ' GLN . . . . . . . . . . . . . 21.2 mm100 -55.11 -38.46 68.19 Favored 'General case' 0 CA--C 1.528 0.13 0 N-CA-C 112.778 0.658 . . . . 0.0 112.778 -172.426 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 8.0 p30 -69.4 -37.77 77.66 Favored 'General case' 0 N--CA 1.457 -0.084 0 N-CA-C 109.667 -0.494 . . . . 0.0 109.667 178.617 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 120' ' ' HIS . . . . . 0.457 ' CB ' ' HB2' ' A' ' 116' ' ' SER . 31.0 m170 -65.47 -42.11 92.61 Favored 'General case' 0 N--CA 1.45 -0.451 0 N-CA-C 109.445 -0.576 . . . . 0.0 109.445 176.798 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 52.8 mttm -56.74 -38.69 72.75 Favored 'General case' 0 C--N 1.341 0.234 0 N-CA-C 109.299 -0.63 . . . . 0.0 109.299 178.147 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 3.5 tm-20 -68.18 -48.93 63.95 Favored 'General case' 0 N--CA 1.456 -0.142 0 CA-C-O 119.47 -0.3 . . . . 0.0 111.71 179.179 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 40.9 mmtm -58.67 -33.65 70.36 Favored 'General case' 0 N--CA 1.456 -0.133 0 CA-C-N 118.112 0.414 . . . . 0.0 111.05 178.31 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 124' ' ' ILE . . . . . . . . . . . . . 57.1 mt -74.17 -37.41 46.18 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.291 0 N-CA-C 109.606 -0.516 . . . . 0.0 109.606 178.122 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 5.9 tpt180 -68.09 -36.68 80.2 Favored 'General case' 0 N--CA 1.45 -0.451 0 O-C-N 122.07 -0.394 . . . . 0.0 111.066 -176.84 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 126' ' ' MET . . . . . . . . . . . . . 5.6 ppp? -75.05 -27.03 59.86 Favored 'General case' 0 C--O 1.226 -0.139 0 N-CA-C 109.913 -0.402 . . . . 0.0 109.913 176.255 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 1.1 mp -62.11 -39.34 92.18 Favored 'General case' 0 CA--C 1.528 0.119 0 CA-C-N 117.928 0.331 . . . . 0.0 110.269 172.066 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -69.44 -37.81 77.53 Favored 'General case' 0 N--CA 1.457 -0.085 0 CA-C-N 118.162 0.437 . . . . 0.0 109.96 178.158 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 18.6 t70 -59.05 -45.03 91.8 Favored 'General case' 0 N--CA 1.452 -0.337 0 N-CA-C 109.27 -0.641 . . . . 0.0 109.27 175.666 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 55.0 mt -60.14 -35.68 63.19 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.24 0 N-CA-C 110.407 -0.22 . . . . 0.0 110.407 179.909 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 131' ' ' TRP . . . . . . . . . . . . . 46.2 m0 -75.08 -34.58 61.79 Favored 'General case' 0 N--CA 1.453 -0.305 0 N-CA-C 112.937 0.717 . . . . 0.0 112.937 -178.589 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 62.8 m-20 -69.69 -30.36 68.0 Favored 'General case' 0 N--CA 1.456 -0.16 0 CA-C-N 118.313 0.506 . . . . 0.0 110.325 179.107 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 23.3 mtp180 -75.27 -34.49 61.35 Favored 'General case' 0 N--CA 1.455 -0.197 0 C-N-CA 123.393 0.677 . . . . 0.0 109.988 176.439 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 46.6 m -76.74 -14.8 59.9 Favored 'General case' 0 N--CA 1.452 -0.353 0 C-N-CA 123.24 0.616 . . . . 0.0 111.555 -179.943 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 135' ' ' GLY . . . . . . . . . . . . . . . 79.77 16.15 77.91 Favored Glycine 0 CA--C 1.53 1.015 0 CA-C-O 119.341 -0.699 . . . . 0.0 113.773 174.379 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 136' ' ' LEU . . . . . . . . . . . . . 10.7 mp -70.69 -28.58 64.87 Favored 'General case' 0 CA--C 1.53 0.176 0 CA-C-N 118.687 1.244 . . . . 0.0 110.749 179.158 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 137' ' ' PHE . . . . . 0.406 ' C ' ' H ' ' A' ' 139' ' ' LYS . 22.1 m-85 42.69 55.49 4.24 Favored 'General case' 0 CA--C 1.531 0.242 0 C-N-CA 124.014 0.925 . . . . 0.0 112.705 175.12 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 138' ' ' GLN . . . . . . . . . . . . . 18.9 mp0 -69.45 28.35 0.03 OUTLIER 'General case' 0 CA--C 1.534 0.35 0 C-N-CA 123.611 0.765 . . . . 0.0 112.978 -177.784 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 139' ' ' LYS . . . . . 0.406 ' H ' ' C ' ' A' ' 137' ' ' PHE . 65.6 pttt 47.96 20.08 0.22 Allowed 'General case' 0 CA--C 1.532 0.284 0 C-N-CA 125.92 1.688 . . . . 0.0 113.451 -177.854 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 140' ' ' SER . . . . . . . . . . . . . 38.7 t -76.46 54.92 0.96 Allowed 'General case' 0 N--CA 1.455 -0.218 0 C-N-CA 124.464 1.105 . . . . 0.0 111.124 -179.51 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 141' ' ' TYR . . . . . . . . . . . . . 29.8 m-85 -129.36 3.65 5.14 Favored 'General case' 0 CA--C 1.529 0.145 0 N-CA-C 111.869 0.322 . . . . 0.0 111.869 -176.558 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 142' ' ' LEU . . . . . . . . . . . . . 75.0 mt -81.22 165.57 21.37 Favored 'General case' 0 N--CA 1.453 -0.299 0 C-N-CA 122.735 0.414 . . . . 0.0 110.599 178.93 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 74.0 m-20 -61.51 -14.22 27.45 Favored 'General case' 0 CA--C 1.53 0.206 0 C-N-CA 122.449 0.3 . . . . 0.0 110.907 178.032 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 144' ' ' ALA . . . . . 0.47 ' HA ' ' HE3' ' A' ' 148' ' ' LYS . . . -58.82 -31.81 68.81 Favored 'General case' 0 N--CA 1.45 -0.465 0 N-CA-C 109.887 -0.412 . . . . 0.0 109.887 176.735 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 145' ' ' ILE . . . . . . . . . . . . . 26.7 mm -75.1 -27.45 19.83 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.251 0 N-CA-C 109.794 -0.447 . . . . 0.0 109.794 178.549 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 146' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -71.6 -14.77 62.17 Favored 'General case' 0 N--CA 1.454 -0.24 0 N-CA-C 108.77 -0.826 . . . . 0.0 108.77 174.586 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 147' ' ' SER . . . . . . . . . . . . . 17.2 t 65.09 43.47 3.69 Favored 'General case' 0 N--CA 1.454 -0.247 0 N-CA-C 114.136 1.162 . . . . 0.0 114.136 169.282 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 148' ' ' LYS . . . . . 0.47 ' HE3' ' HA ' ' A' ' 144' ' ' ALA . 2.5 mptt 42.25 -85.8 0.01 OUTLIER 'General case' 0 N--CA 1.464 0.263 0 C-N-CA 126.535 1.934 . . . . 0.0 113.963 170.434 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 149' ' ' CYS . . . . . . . . . . . . . 63.4 m -58.7 -39.45 80.79 Favored 'General case' 0 N--CA 1.449 -0.495 0 O-C-N 121.989 -0.444 . . . . 0.0 110.086 -179.075 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 150' ' ' PHE . . . . . . . . . . . . . 91.1 t80 -68.58 -18.26 64.3 Favored 'General case' 0 N--CA 1.453 -0.298 0 CA-C-N 117.983 0.356 . . . . 0.0 111.152 179.942 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 151' ' ' ALA . . . . . . . . . . . . . . . -75.58 -39.88 57.43 Favored 'General case' 0 N--CA 1.451 -0.391 0 O-C-N 121.964 -0.46 . . . . 0.0 110.194 176.199 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 152' ' ' MET . . . . . . . . . . . . . 89.4 mtp -75.75 -36.92 59.73 Favored 'General case' 0 CA--C 1.532 0.287 0 N-CA-C 110.132 -0.321 . . . . 0.0 110.132 175.429 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 153' ' ' ASP . . . . . . . . . . . . . 50.5 m-20 -86.92 14.57 7.1 Favored 'General case' 0 CA--C 1.531 0.238 0 C-N-CA 125.436 1.494 . . . . 0.0 113.119 -178.05 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 154' ' ' LEU . . . . . . . . . . . . . 3.7 pp -57.49 155.34 9.61 Favored 'General case' 0 N--CA 1.456 -0.15 0 CA-C-N 118.575 0.625 . . . . 0.0 111.828 -175.799 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 155' ' ' GLU . . . . . . . . . . . . . 8.1 mp0 -84.13 -41.64 16.87 Favored 'General case' 0 N--CA 1.453 -0.324 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.523 179.431 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 156' ' ' HIS . . . . . . . . . . . . . 98.2 m-70 -156.59 165.14 37.14 Favored 'General case' 0 N--CA 1.455 -0.202 0 C-N-CA 124.349 1.059 . . . . 0.0 109.538 -177.743 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 157' ' ' HIS . . . . . . . . . . . . . 49.7 m170 -84.05 2.4 39.35 Favored 'General case' 0 CA--C 1.53 0.184 0 C-N-CA 123.044 0.538 . . . . 0.0 111.558 178.208 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 158' ' ' HIS . . . . . . . . . . . . . 69.7 m-70 -72.56 -7.68 51.37 Favored 'General case' 0 CA--C 1.529 0.137 0 N-CA-C 112.523 0.564 . . . . 0.0 112.523 -177.211 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 159' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 C--O 1.251 1.166 0 CA-C-O 117.527 -1.225 . . . . 0.0 110.518 178.932 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B 2052 ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.476 0.843 0 N-CA-C 109.8 -0.445 . . . . 0.0 109.8 . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B 2053 ' ' ASP . . . . . . . . . . . . . 6.3 p-10 -71.91 163.01 28.6 Favored 'General case' 0 N--CA 1.449 -0.479 0 N-CA-C 107.764 -1.199 . . . . 0.0 107.764 171.01 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B 2054 ' ' ASP . . . . . . . . . . . . . 41.2 t0 62.79 170.89 0.14 Allowed 'General case' 0 CA--C 1.535 0.366 0 CA-C-O 121.669 0.747 . . . . 0.0 111.026 -173.369 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B 2055 ' ' GLU . . . . . . . . . . . . . 63.2 tt0 -68.05 90.78 0.33 Allowed 'General case' 0 N--CA 1.451 -0.378 0 C-N-CA 125.265 1.426 . . . . 0.0 109.709 179.469 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B 2056 ' ' ASP . . . . . . . . . . . . . 18.1 p30 -72.27 7.2 1.84 Allowed 'General case' 0 CA--C 1.534 0.35 0 N-CA-C 113.166 0.802 . . . . 0.0 113.166 -174.5 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B 2057 ' ' ASP . . . . . . . . . . . . . 65.7 t0 -155.42 94.77 1.63 Allowed 'General case' 0 N--CA 1.454 -0.252 0 N-CA-C 107.725 -1.213 . . . . 0.0 107.725 168.988 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B 2058 ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -67.77 2.57 1.86 Allowed 'General case' 0 C--N 1.34 0.179 0 N-CA-C 113.367 0.877 . . . . 0.0 113.367 -173.898 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B 2059 ' ' THR . . . . . . . . . . . . . 38.0 m 44.48 74.18 0.84 Allowed Pre-proline 0 C--N 1.34 0.16 0 C-N-CA 124.66 1.184 . . . . 0.0 111.771 169.691 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B 2060 ' ' PRO . . . . . . . . . . . . . 55.2 Cg_endo -65.97 122.42 9.97 Favored 'Trans proline' 0 N--CA 1.451 -0.971 0 C-N-CA 123.076 2.518 . . . . 0.0 110.733 -176.119 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B 2061 ' ' SER . . . . . . . . . . . . . 39.5 t -75.16 144.23 42.87 Favored 'General case' 0 N--CA 1.452 -0.361 0 CA-C-N 116.222 -0.444 . . . . 0.0 109.904 177.153 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B 2062 ' ' ILE . . . . . . . . . . . . . 6.4 tp -159.83 141.8 4.61 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.204 0 CA-C-O 120.792 0.33 . . . . 0.0 110.733 -178.1 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B 2063 ' ' SER . . . . . . . . . . . . . 31.2 t . . . . . 0 C--O 1.252 1.201 0 CA-C-O 117.819 -1.086 . . . . 0.0 110.465 -178.932 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 86.2 mmm . . . . . 0 N--CA 1.472 0.671 0 CA-C-O 120.289 0.09 . . . . 0.0 110.898 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 2' ' ' GLN . . . . . 0.481 ' HG2' ' H ' ' A' ' 3' ' ' GLN . 7.8 tt0 -159.33 -164.81 1.44 Allowed 'General case' 0 N--CA 1.454 -0.228 0 N-CA-C 107.901 -1.148 . . . . 0.0 107.901 178.099 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . 0.481 ' H ' ' HG2' ' A' ' 2' ' ' GLN . 19.5 mm100 -73.97 41.45 0.13 Allowed 'General case' 0 CA--C 1.532 0.262 0 C-N-CA 123.425 0.69 . . . . 0.0 111.564 -179.802 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 84.6 m-20 56.77 14.38 1.78 Allowed 'General case' 0 C--N 1.34 0.191 0 C-N-CA 124.595 1.158 . . . . 0.0 113.314 -174.495 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 31.8 p30 -99.83 4.15 45.07 Favored 'General case' 0 C--N 1.329 -0.295 0 C-N-CA 123.848 0.859 . . . . 0.0 110.421 175.641 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 23.5 p-10 -90.56 -30.58 17.14 Favored 'General case' 0 N--CA 1.451 -0.408 0 N-CA-C 107.003 -1.48 . . . . 0.0 107.003 171.256 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 7' ' ' PHE . . . . . 0.494 ' CD1' ' HD3' ' A' ' 45' ' ' LYS . 1.5 t80 -54.58 -34.45 61.95 Favored 'General case' 0 N--CA 1.45 -0.447 0 CA-C-N 114.839 -1.073 . . . . 0.0 109.311 175.006 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 50.9 tp60 -51.82 -35.64 45.06 Favored 'General case' 0 N--CA 1.454 -0.234 0 C-N-CA 124.564 1.145 . . . . 0.0 111.802 -178.157 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 30.3 m-80 -73.0 -34.13 66.21 Favored 'General case' 0 N--CA 1.455 -0.196 0 N-CA-C 109.826 -0.435 . . . . 0.0 109.826 -179.762 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 10' ' ' PHE . . . . . 0.451 ' CE2' ' HB2' ' A' ' 32' ' ' LEU . 5.1 t80 -69.54 -38.95 77.69 Favored 'General case' 0 N--CA 1.447 -0.59 0 C-N-CA 123.57 0.748 . . . . 0.0 109.166 175.774 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 93.3 t -65.47 -53.18 42.52 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.426 0 N-CA-C 109.167 -0.679 . . . . 0.0 109.167 178.548 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -57.59 -29.18 64.26 Favored 'General case' 0 N--CA 1.454 -0.246 0 C-N-CA 122.554 0.341 . . . . 0.0 111.359 178.884 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 87.2 m -72.31 -39.1 68.5 Favored 'General case' 0 N--CA 1.456 -0.16 0 N-CA-C 109.345 -0.613 . . . . 0.0 109.345 176.263 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -64.74 -45.61 85.73 Favored 'General case' 0 N--CA 1.454 -0.236 0 N-CA-C 109.457 -0.572 . . . . 0.0 109.457 178.356 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 57.5 mm-40 -63.83 -32.12 73.53 Favored 'General case' 0 N--CA 1.453 -0.302 0 N-CA-C 109.357 -0.609 . . . . 0.0 109.357 178.37 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 69.7 m -66.25 -34.13 77.32 Favored 'General case' 0 N--CA 1.45 -0.473 0 CA-C-O 118.722 -0.656 . . . . 0.0 110.188 177.456 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 17' ' ' PHE . . . . . 0.435 ' CD1' HD11 ' A' ' 68' ' ' ILE . 42.8 m-85 -67.77 -39.33 84.13 Favored 'General case' 0 C--N 1.343 0.296 0 CA-C-N 119.036 0.835 . . . . 0.0 110.152 176.274 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . 0.425 ' HG2' ' CE1' ' A' ' 53' ' ' TYR . 46.0 mttt -60.14 -31.2 69.86 Favored 'General case' 0 C--N 1.341 0.208 0 CA-C-N 118.285 0.493 . . . . 0.0 109.844 -179.715 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 45.8 t0 -74.71 -16.78 60.74 Favored 'General case' 0 CA--C 1.534 0.359 0 CA-C-N 115.33 -0.85 . . . . 0.0 112.36 -179.676 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . 0.4 HD11 ' HB2' ' A' ' 25' ' ' SER . 81.8 mt -73.29 158.72 34.59 Favored 'General case' 0 N--CA 1.456 -0.138 0 O-C-N 121.528 -0.732 . . . . 0.0 112.07 -176.796 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 1.5 mppt? -98.3 -2.97 38.24 Favored 'General case' 0 CA--C 1.533 0.317 0 CA-C-N 115.106 -0.952 . . . . 0.0 109.7 176.087 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 87.0 p -120.65 -20.08 7.2 Favored 'General case' 0 C--N 1.34 0.168 0 C-N-CA 123.885 0.874 . . . . 0.0 111.031 179.428 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 77.03 -28.71 1.63 Allowed Glycine 0 CA--C 1.53 0.986 0 C-N-CA 124.093 0.854 . . . . 0.0 111.952 179.424 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 92.8 mt -85.89 150.21 3.98 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.341 0 N-CA-C 108.889 -0.782 . . . . 0.0 108.889 175.181 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . 0.5 ' HA ' ' HA ' ' B' 2056 ' ' ASP . 29.7 t -161.56 94.96 0.99 Allowed 'General case' 0 CA--C 1.513 -0.47 0 N-CA-C 109.159 -0.682 . . . . 0.0 109.159 170.006 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . 0.55 ' H ' ' HA ' ' B' 2056 ' ' ASP . . . -55.56 -34.56 60.36 Favored Glycine 0 N--CA 1.445 -0.722 0 N-CA-C 110.881 -0.887 . . . . 0.0 110.881 -177.646 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 15.8 t -65.28 -54.44 29.24 Favored 'General case' 0 N--CA 1.455 -0.218 0 CA-C-N 118.334 1.067 . . . . 0.0 109.905 179.327 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 17.4 mmt85 -68.19 -38.06 81.61 Favored 'General case' 0 N--CA 1.455 -0.217 0 C-N-CA 122.3 0.24 . . . . 0.0 110.69 -176.523 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 75.6 mt -59.71 -43.49 91.55 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.634 0 N-CA-C 108.615 -0.883 . . . . 0.0 108.615 176.109 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 31.6 mtmm -67.02 -27.61 67.55 Favored 'General case' 0 C--N 1.34 0.19 0 CA-C-O 118.928 -0.558 . . . . 0.0 111.466 178.108 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.55 -58.61 5.38 Favored 'General case' 0 C--N 1.343 0.291 0 CA-C-N 118.848 0.749 . . . . 0.0 110.028 -179.969 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.548 HD12 ' N ' ' A' ' 33' ' ' THR . 2.3 pp -75.31 -19.23 59.77 Favored 'General case' 0 CA--C 1.529 0.144 0 C-N-CA 119.887 -0.725 . . . . 0.0 111.589 -175.964 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . 0.548 ' N ' HD12 ' A' ' 32' ' ' LEU . 37.9 m -71.61 -40.93 69.49 Favored 'General case' 0 N--CA 1.456 -0.158 0 N-CA-C 107.8 -1.185 . . . . 0.0 107.8 176.517 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 92.6 m -68.21 -37.24 80.67 Favored 'General case' 0 N--CA 1.453 -0.323 0 C-N-CA 121.078 -0.249 . . . . 0.0 110.384 -178.563 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 24.1 t80 -63.06 -37.62 87.93 Favored 'General case' 0 N--CA 1.456 -0.135 0 N-CA-C 109.992 -0.373 . . . . 0.0 109.992 175.749 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -73.52 -36.5 65.73 Favored 'General case' 0 N--CA 1.45 -0.434 0 C-N-CA 122.471 0.309 . . . . 0.0 110.761 -179.026 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -71.32 -34.58 70.69 Favored 'General case' 0 N--CA 1.455 -0.183 0 C-N-CA 122.568 0.347 . . . . 0.0 110.547 179.363 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 43.5 t0 -69.72 -22.81 63.36 Favored 'General case' 0 CA--C 1.534 0.344 0 C-N-CA 122.544 0.338 . . . . 0.0 110.745 176.462 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 39' ' ' HIS . . . . . 0.401 ' HB2' HD11 ' A' ' 42' ' ' ILE . 96.5 m-70 -151.68 101.23 2.76 Favored 'General case' 0 N--CA 1.454 -0.24 0 N-CA-C 111.914 0.338 . . . . 0.0 111.914 -175.461 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 40' ' ' ILE . . . . . 0.58 ' H ' HD13 ' A' ' 40' ' ' ILE . 0.0 OUTLIER -78.67 -12.78 13.57 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.294 0 N-CA-C 109.728 -0.471 . . . . 0.0 109.728 174.187 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 17.2 m-20 -57.87 -19.43 29.28 Favored 'General case' 0 N--CA 1.454 -0.235 0 C-N-CA 123.774 0.83 . . . . 0.0 112.655 -176.817 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . 0.401 HD11 ' HB2' ' A' ' 39' ' ' HIS . 0.0 OUTLIER -112.29 19.82 6.79 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.245 0 C-N-CA 123.31 0.644 . . . . 0.0 111.388 178.091 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 3.1 pp20? -52.89 -28.1 21.64 Favored 'General case' 0 CA--C 1.532 0.255 0 O-C-N 121.856 -0.528 . . . . 0.0 111.728 178.055 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 36.6 t -64.97 -48.42 74.11 Favored 'General case' 0 CA--C 1.532 0.269 0 N-CA-C 111.634 0.235 . . . . 0.0 111.634 -177.26 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . 0.494 ' HD3' ' CD1' ' A' ' 7' ' ' PHE . 17.6 ptpt -73.35 -23.6 60.24 Favored 'General case' 0 C--N 1.341 0.2 0 CA-C-N 117.95 0.341 . . . . 0.0 110.398 179.275 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 67.1 mt -72.58 -51.19 29.63 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.318 0 C-N-CA 122.999 0.52 . . . . 0.0 110.278 -178.835 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 36.6 mm -66.78 -38.35 81.33 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.352 0 N-CA-C 109.996 -0.372 . . . . 0.0 109.996 -179.716 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 33.3 t -67.85 -34.98 77.74 Favored 'General case' 0 N--CA 1.454 -0.272 0 C-N-CA 120.778 -0.369 . . . . 0.0 111.378 -179.046 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 39.7 tp -77.79 -33.67 52.5 Favored 'General case' 0 N--CA 1.451 -0.395 0 O-C-N 121.652 -0.655 . . . . 0.0 112.407 -176.46 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . 0.426 HD12 HG12 ' A' ' 69' ' ' ILE . 4.2 pt -70.28 -43.08 78.83 Favored 'Isoleucine or valine' 0 C--N 1.34 0.173 0 CA-C-N 118.832 0.742 . . . . 0.0 110.378 177.55 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 51' ' ' ILE . . . . . 0.404 ' HA ' HD21 ' A' ' 108' ' ' LEU . 32.3 pt -63.12 -37.32 79.09 Favored 'Isoleucine or valine' 0 N--CA 1.461 0.101 0 C-N-CA 119.444 -0.903 . . . . 0.0 110.766 177.949 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 92.6 m-20 -68.51 -41.5 79.87 Favored 'General case' 0 N--CA 1.452 -0.346 0 O-C-N 121.937 -0.477 . . . . 0.0 111.571 178.409 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 53' ' ' TYR . . . . . 0.425 ' CE1' ' HG2' ' A' ' 18' ' ' LYS . 11.2 t80 -64.15 -42.75 96.66 Favored 'General case' 0 CA--C 1.523 -0.078 0 CA-C-N 118.891 0.769 . . . . 0.0 109.227 177.027 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 24.1 t -68.75 -24.72 64.48 Favored 'General case' 0 N--CA 1.453 -0.323 0 N-CA-C 112.105 0.409 . . . . 0.0 112.105 -176.665 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 73.4 mtm180 -86.18 -31.72 21.62 Favored 'General case' 0 N--CA 1.457 -0.094 0 CA-C-N 118.7 0.682 . . . . 0.0 111.823 179.946 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 47.4 mt -84.86 -43.6 13.98 Favored 'General case' 0 CA--C 1.528 0.118 0 N-CA-C 113.02 0.748 . . . . 0.0 113.02 -179.22 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 16.7 p -60.65 155.26 51.76 Favored Pre-proline 0 CA--C 1.538 0.493 0 N-CA-C 113.705 1.002 . . . . 0.0 113.705 -173.322 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 72.3 Cg_endo -75.67 -177.76 3.82 Favored 'Trans proline' 0 N--CA 1.457 -0.619 0 C-N-CA 124.848 3.698 . . . . 0.0 111.545 177.188 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -55.02 -50.91 67.87 Favored 'General case' 0 CA--C 1.53 0.201 0 N-CA-C 114.908 1.447 . . . . 0.0 114.908 -171.913 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 45.3 m -66.99 -39.34 87.12 Favored 'General case' 0 C--N 1.331 -0.199 0 O-C-N 121.743 -0.598 . . . . 0.0 109.964 -176.609 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 71.2 m80 -75.43 -17.47 60.16 Favored 'General case' 0 N--CA 1.45 -0.437 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.526 177.378 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . 0.4 ' HE2' ' HB2' ' A' ' 62' ' ' LYS . 10.9 tppt? -66.95 -45.08 78.88 Favored 'General case' 0 N--CA 1.457 -0.086 0 N-CA-C 109.065 -0.716 . . . . 0.0 109.065 174.081 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -63.91 -42.76 97.32 Favored 'General case' 0 N--CA 1.454 -0.267 0 N-CA-C 108.32 -0.993 . . . . 0.0 108.32 177.789 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -66.15 -33.84 86.47 Favored Glycine 0 CA--C 1.53 0.98 0 N-CA-C 111.95 -0.46 . . . . 0.0 111.95 178.331 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 63.2 m -64.74 -42.16 95.39 Favored 'General case' 0 N--CA 1.456 -0.141 0 CA-C-N 117.927 0.864 . . . . 0.0 110.342 177.601 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 80.0 mt -68.71 -27.23 65.76 Favored 'General case' 0 N--CA 1.455 -0.224 0 N-CA-C 110.277 -0.268 . . . . 0.0 110.277 179.421 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 1.0 OUTLIER -68.42 -38.73 81.48 Favored 'General case' 0 N--CA 1.455 -0.203 0 CA-C-N 117.736 0.244 . . . . 0.0 111.413 175.739 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 68' ' ' ILE . . . . . 0.435 HD11 ' CD1' ' A' ' 17' ' ' PHE . 14.7 mt -66.42 -53.64 34.09 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.445 0 N-CA-C 109.178 -0.675 . . . . 0.0 109.178 176.679 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 69' ' ' ILE . . . . . 0.426 HG12 HD12 ' A' ' 50' ' ' ILE . 81.3 mt -50.27 -37.11 13.79 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.19 0 C-N-CA 124.233 1.013 . . . . 0.0 111.678 174.413 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 12.8 t70 -69.05 -46.2 68.47 Favored 'General case' 0 N--CA 1.455 -0.195 0 CA-C-N 118.292 0.496 . . . . 0.0 111.109 179.915 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 30.7 t -64.06 -55.51 21.64 Favored 'General case' 0 N--CA 1.45 -0.464 0 CA-C-N 116.58 -0.282 . . . . 0.0 110.646 -175.968 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -74.36 -32.9 32.25 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.246 0 N-CA-C 110.192 -0.299 . . . . 0.0 110.192 -177.18 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -66.7 -55.26 18.14 Favored Glycine 0 C--N 1.34 0.777 0 N-CA-C 111.589 -0.604 . . . . 0.0 111.589 -174.555 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 33.9 mtm105 -68.7 -37.52 79.58 Favored 'General case' 0 N--CA 1.455 -0.182 0 C-N-CA 120.099 -0.64 . . . . 0.0 110.088 179.158 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -64.7 -29.95 70.96 Favored 'General case' 0 N--CA 1.452 -0.368 0 C-N-CA 120.1 -0.64 . . . . 0.0 110.624 -179.624 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 1.3 m-30 -69.73 -46.0 66.89 Favored 'General case' 0 N--CA 1.454 -0.274 0 CA-C-N 118.401 0.546 . . . . 0.0 110.494 175.832 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -65.01 -49.09 71.57 Favored 'General case' 0 N--CA 1.449 -0.475 0 C-N-CA 118.788 -1.165 . . . . 0.0 108.047 -179.634 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 89.2 m-20 -55.92 -44.34 78.21 Favored 'General case' 0 CA--C 1.53 0.176 0 N-CA-C 112.725 0.639 . . . . 0.0 112.725 -179.689 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 8.3 tm-20 -63.42 -51.85 64.02 Favored 'General case' 0 N--CA 1.45 -0.438 0 CA-C-N 118.548 0.613 . . . . 0.0 111.32 -178.808 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 80' ' ' THR . . . . . 0.557 HG21 ' HB3' ' A' ' 94' ' ' CYS . 59.2 p -65.47 -26.24 67.84 Favored 'General case' 0 N--CA 1.454 -0.237 0 CA-C-N 117.83 0.286 . . . . 0.0 110.567 -179.957 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 35.5 ttp180 -75.62 -20.07 58.79 Favored 'General case' 0 N--CA 1.448 -0.542 0 C-N-CA 123.937 0.895 . . . . 0.0 111.051 174.349 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 27.5 m -95.85 -35.46 11.48 Favored 'General case' 0 CA--C 1.53 0.198 0 C-N-CA 122.924 0.49 . . . . 0.0 111.82 179.476 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 4.9 m-80 -145.69 156.11 43.42 Favored 'General case' 0 N--CA 1.456 -0.146 0 C-N-CA 122.946 0.498 . . . . 0.0 110.803 -176.643 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 42.7 t -80.73 139.66 35.98 Favored 'General case' 0 N--CA 1.455 -0.221 0 N-CA-C 109.767 -0.457 . . . . 0.0 109.767 174.03 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 6.4 m120 -87.12 164.01 16.65 Favored 'General case' 0 N--CA 1.454 -0.243 0 CA-C-O 120.673 0.273 . . . . 0.0 110.431 177.484 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 88.1 p -82.58 12.21 4.88 Favored 'General case' 0 CA--C 1.529 0.168 0 C-N-CA 123.364 0.665 . . . . 0.0 111.353 178.306 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 42.1 t -67.39 161.97 24.02 Favored 'General case' 0 N--CA 1.454 -0.275 0 C-N-CA 123.205 0.602 . . . . 0.0 111.186 179.55 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 44.9 t -139.71 13.71 2.51 Favored 'General case' 0 CA--C 1.531 0.24 0 C-N-CA 123.256 0.623 . . . . 0.0 110.597 179.068 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 9.9 m120 -148.28 172.72 13.93 Favored 'General case' 0 N--CA 1.454 -0.254 0 C-N-CA 124.168 0.987 . . . . 0.0 108.879 -178.168 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 90' ' ' LYS . . . . . 0.438 ' N ' ' HD2' ' A' ' 91' ' ' PRO . 81.5 tttt -66.37 -51.35 43.53 Favored Pre-proline 0 N--CA 1.451 -0.38 0 CA-C-O 118.431 -0.795 . . . . 0.0 110.629 177.444 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 91' ' ' PRO . . . . . 0.438 ' HD2' ' N ' ' A' ' 90' ' ' LYS . 67.2 Cg_endo -67.34 154.97 72.39 Favored 'Trans proline' 0 N--CA 1.453 -0.899 0 C-N-CA 122.18 1.92 . . . . 0.0 109.193 172.146 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 85.55 16.25 64.43 Favored Glycine 0 CA--C 1.525 0.674 0 N-CA-C 110.788 -0.925 . . . . 0.0 110.788 -176.272 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -155.8 167.15 31.33 Favored 'General case' 0 N--CA 1.454 -0.255 0 C-N-CA 123.7 0.8 . . . . 0.0 109.333 -179.218 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 94' ' ' CYS . . . . . 0.557 ' HB3' HG21 ' A' ' 80' ' ' THR . 30.1 p -58.15 -20.01 37.32 Favored 'General case' 0 N--CA 1.453 -0.307 0 C-N-CA 122.703 0.401 . . . . 0.0 110.807 179.087 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -58.53 -60.47 3.74 Favored 'General case' 0 N--CA 1.447 -0.577 0 C-N-CA 122.34 0.256 . . . . 0.0 110.702 -176.514 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 75.3 t60 -74.01 -32.65 63.48 Favored 'General case' 0 N--CA 1.451 -0.407 0 C-N-CA 121.003 -0.279 . . . . 0.0 110.496 -179.86 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -64.46 -53.44 48.15 Favored 'General case' 0 N--CA 1.451 -0.402 0 C-N-CA 122.407 0.283 . . . . 0.0 111.124 -176.26 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 1.7 mp -72.42 -33.12 44.6 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.291 0 N-CA-C 110.056 -0.35 . . . . 0.0 110.056 -178.737 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 1.4 m120 -66.42 -41.25 89.49 Favored 'General case' 0 C--O 1.225 -0.199 0 CA-C-N 118.27 0.486 . . . . 0.0 111.1 177.976 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 96.7 m -73.5 -32.59 64.35 Favored 'General case' 0 N--CA 1.457 -0.122 0 CA-C-N 118.242 0.474 . . . . 0.0 110.894 -177.675 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 60.5 tp -73.2 -39.6 65.44 Favored 'General case' 0 N--CA 1.45 -0.463 0 N-CA-C 111.528 0.196 . . . . 0.0 111.528 -177.268 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -69.31 -16.9 71.74 Favored Glycine 0 CA--C 1.529 0.944 0 CA-C-O 119.713 -0.493 . . . . 0.0 114.031 -173.828 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 6.2 mm-40 -87.76 -32.08 19.31 Favored 'General case' 0 CA--C 1.52 -0.173 0 CA-C-N 118.322 1.061 . . . . 0.0 111.538 178.92 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 81.7 t -93.69 -20.68 6.23 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.09 0 C-N-CA 122.759 0.424 . . . . 0.0 112.119 -177.499 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 105' ' ' ILE . . . . . 0.403 HD12 ' HA ' ' A' ' 105' ' ' ILE . 10.7 tp -60.54 -22.5 25.9 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.224 0 O-C-N 121.571 -0.706 . . . . 0.0 112.099 -175.167 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 26.4 pt20 -67.77 -25.67 65.73 Favored 'General case' 0 CA--C 1.53 0.201 0 O-C-N 121.982 -0.448 . . . . 0.0 110.511 177.236 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 72.2 mt-10 -74.3 -43.04 58.43 Favored 'General case' 0 N--CA 1.454 -0.254 0 N-CA-C 109.474 -0.565 . . . . 0.0 109.474 176.816 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 108' ' ' LEU . . . . . 0.404 HD21 ' HA ' ' A' ' 51' ' ' ILE . 10.4 mp -67.4 -45.11 77.14 Favored 'General case' 0 N--CA 1.452 -0.364 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.239 -177.847 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 3.0 mp -65.94 -53.33 40.59 Favored 'General case' 0 N--CA 1.451 -0.379 0 CA-C-O 119.146 -0.454 . . . . 0.0 110.584 -178.219 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 15.4 m -54.39 -47.22 72.94 Favored 'General case' 0 C--O 1.233 0.198 0 CA-C-N 118.139 0.427 . . . . 0.0 110.501 -178.262 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 40.5 t0 -62.21 -43.37 98.98 Favored 'General case' 0 N--CA 1.452 -0.365 0 N-CA-C 109.309 -0.626 . . . . 0.0 109.309 178.117 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 112' ' ' ALA . . . . . 0.4 ' HA ' ' HG2' ' A' ' 62' ' ' LYS . . . -67.87 -36.89 81.05 Favored 'General case' 0 N--CA 1.447 -0.619 0 CA-C-O 119.135 -0.46 . . . . 0.0 111.438 -175.148 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 113' ' ' ILE . . . . . 0.456 ' O ' ' HE2' ' A' ' 121' ' ' LYS . 19.9 mm -68.79 -40.85 81.94 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.426 0 C-N-CA 118.805 -1.158 . . . . 0.0 110.1 -179.434 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -75.56 -39.09 58.7 Favored 'General case' 0 N--CA 1.454 -0.237 0 N-CA-C 112.837 0.68 . . . . 0.0 112.837 179.836 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 115' ' ' LYS . . . . . 0.61 ' HE2' ' HA ' ' A' ' 115' ' ' LYS . 0.6 OUTLIER -78.85 -38.41 38.0 Favored 'General case' 0 N--CA 1.456 -0.165 0 N-CA-C 113.342 0.867 . . . . 0.0 113.342 -177.711 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 116' ' ' SER . . . . . 0.453 ' HB2' ' CB ' ' A' ' 120' ' ' HIS . 52.6 p -74.56 157.23 35.82 Favored 'General case' 0 CA--C 1.529 0.146 0 CA-C-N 117.918 0.326 . . . . 0.0 111.744 -172.628 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 56.5 t30 -79.57 166.21 22.15 Favored 'General case' 0 CA--C 1.531 0.23 0 C-N-CA 122.877 0.471 . . . . 0.0 110.61 -178.997 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 118' ' ' GLN . . . . . . . . . . . . . 3.4 pt20 -49.1 -46.27 44.51 Favored 'General case' 0 CA--C 1.532 0.25 0 N-CA-C 112.823 0.675 . . . . 0.0 112.823 -174.34 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 6.8 p30 -65.42 -35.85 82.18 Favored 'General case' 0 N--CA 1.456 -0.149 0 C-N-CA 123.059 0.544 . . . . 0.0 111.358 179.122 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 120' ' ' HIS . . . . . 0.453 ' CB ' ' HB2' ' A' ' 116' ' ' SER . 32.3 m170 -68.12 -43.91 77.3 Favored 'General case' 0 N--CA 1.448 -0.544 0 N-CA-C 110.145 -0.317 . . . . 0.0 110.145 176.666 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 121' ' ' LYS . . . . . 0.456 ' HE2' ' O ' ' A' ' 113' ' ' ILE . 76.0 mttt -57.0 -38.99 73.85 Favored 'General case' 0 C--N 1.342 0.254 0 N-CA-C 109.514 -0.55 . . . . 0.0 109.514 179.896 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 2.8 tm-20 -65.43 -47.61 75.61 Favored 'General case' 0 N--CA 1.456 -0.172 0 C-N-CA 122.402 0.281 . . . . 0.0 110.614 178.905 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 62.4 mttp -65.95 -28.92 69.27 Favored 'General case' 0 N--CA 1.454 -0.233 0 CA-C-O 119.836 -0.126 . . . . 0.0 111.075 -179.558 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 124' ' ' ILE . . . . . . . . . . . . . 59.2 mt -70.73 -42.97 77.7 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.297 0 N-CA-C 109.436 -0.579 . . . . 0.0 109.436 176.071 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 125' ' ' ARG . . . . . 0.468 HH11 ' HA ' ' A' ' 125' ' ' ARG . 7.3 mmm180 -59.27 -46.39 88.67 Favored 'General case' 0 N--CA 1.451 -0.383 0 CA-C-O 118.982 -0.532 . . . . 0.0 111.236 -179.503 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 126' ' ' MET . . . . . . . . . . . . . 27.6 ptm -65.47 -33.47 76.0 Favored 'General case' 0 N--CA 1.451 -0.401 0 C-N-CA 119.278 -0.969 . . . . 0.0 109.66 178.814 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 18.7 tp -69.61 -31.72 70.01 Favored 'General case' 0 CA--C 1.533 0.307 0 CA-C-N 118.025 0.375 . . . . 0.0 111.617 179.654 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 92.9 mt -75.76 -38.06 58.73 Favored 'General case' 0 N--CA 1.456 -0.167 0 O-C-N 121.909 -0.494 . . . . 0.0 110.531 177.378 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 129' ' ' ASP . . . . . 0.417 ' O ' ' HD2' ' A' ' 133' ' ' ARG . 54.7 m-20 -60.29 -38.23 82.97 Favored 'General case' 0 N--CA 1.454 -0.226 0 N-CA-C 109.117 -0.698 . . . . 0.0 109.117 176.031 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 130' ' ' ILE . . . . . 0.563 HG12 HG23 ' B' 2062 ' ' ILE . 36.5 mt -63.15 -40.7 90.02 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.359 0 C-N-CA 124.32 1.048 . . . . 0.0 110.816 176.08 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 131' ' ' TRP . . . . . . . . . . . . . 48.7 m0 -68.22 -39.5 82.35 Favored 'General case' 0 N--CA 1.452 -0.349 0 C-N-CA 120.009 -0.677 . . . . 0.0 111.178 176.949 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 50.4 m-20 -64.39 -28.91 70.01 Favored 'General case' 0 CA--C 1.531 0.227 0 CA-C-N 117.97 0.35 . . . . 0.0 110.773 179.451 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 133' ' ' ARG . . . . . 0.417 ' HD2' ' O ' ' A' ' 129' ' ' ASP . 33.2 mtt85 -74.77 -34.67 62.51 Favored 'General case' 0 C--N 1.339 0.145 0 C-N-CA 122.997 0.519 . . . . 0.0 111.087 175.125 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 25.6 p -72.26 -15.35 61.92 Favored 'General case' 0 N--CA 1.452 -0.333 0 N-CA-C 112.813 0.671 . . . . 0.0 112.813 -172.955 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 135' ' ' GLY . . . . . . . . . . . . . . . 83.16 11.24 81.32 Favored Glycine 0 CA--C 1.529 0.944 0 CA-C-O 119.393 -0.67 . . . . 0.0 112.759 179.6 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 136' ' ' LEU . . . . . . . . . . . . . 20.5 mt -60.84 165.37 4.07 Favored 'General case' 0 CA--C 1.531 0.248 0 CA-C-N 118.05 0.925 . . . . 0.0 110.032 175.403 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 137' ' ' PHE . . . . . . . . . . . . . 7.4 t80 -72.9 57.13 0.43 Allowed 'General case' 0 CA--C 1.531 0.23 0 C-N-CA 123.924 0.89 . . . . 0.0 111.123 -179.105 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 138' ' ' GLN . . . . . . . . . . . . . 16.1 mm100 -68.55 168.81 12.16 Favored 'General case' 0 N--CA 1.451 -0.383 0 C-N-CA 124.289 1.036 . . . . 0.0 110.72 178.429 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 139' ' ' LYS . . . . . . . . . . . . . 34.9 mmtp -130.15 162.09 29.64 Favored 'General case' 0 N--CA 1.453 -0.298 0 N-CA-C 108.994 -0.743 . . . . 0.0 108.994 -178.398 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 140' ' ' SER . . . . . . . . . . . . . 44.2 t -63.77 156.69 26.46 Favored 'General case' 0 N--CA 1.452 -0.346 0 CA-C-O 120.815 0.34 . . . . 0.0 110.202 179.48 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 141' ' ' TYR . . . . . . . . . . . . . 10.1 m-30 -76.49 53.91 0.89 Allowed 'General case' 0 CA--C 1.532 0.266 0 C-N-CA 123.219 0.607 . . . . 0.0 110.175 -179.847 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 142' ' ' LEU . . . . . 0.447 ' H ' HD23 ' A' ' 142' ' ' LEU . 2.5 pt? -62.57 172.54 1.56 Allowed 'General case' 0 CA--C 1.531 0.226 0 N-CA-C 112.19 0.441 . . . . 0.0 112.19 -176.652 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 4.1 m120 -53.0 -23.75 8.04 Favored 'General case' 0 N--CA 1.455 -0.176 0 C-N-CA 124.103 0.961 . . . . 0.0 113.057 -173.545 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . -71.58 -51.77 21.62 Favored 'General case' 0 N--CA 1.452 -0.338 0 CA-C-N 118.435 0.561 . . . . 0.0 109.949 178.729 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 145' ' ' ILE . . . . . . . . . . . . . 26.3 mm -64.76 -31.16 52.61 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.265 0 N-CA-C 110.206 -0.294 . . . . 0.0 110.206 178.134 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 146' ' ' ARG . . . . . . . . . . . . . 30.7 tpt180 -67.94 -37.1 81.2 Favored 'General case' 0 N--CA 1.452 -0.334 0 C-N-CA 122.886 0.474 . . . . 0.0 110.386 179.976 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 147' ' ' SER . . . . . . . . . . . . . 33.2 t 44.34 32.03 0.65 Allowed 'General case' 0 CA--C 1.535 0.397 0 C-N-CA 123.857 0.863 . . . . 0.0 112.767 176.859 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 48.12 -122.59 1.54 Allowed 'General case' 0 CA--C 1.536 0.44 0 C-N-CA 124.577 1.151 . . . . 0.0 112.4 176.893 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 149' ' ' CYS . . . . . . . . . . . . . 49.4 m -58.68 -28.9 66.18 Favored 'General case' 0 N--CA 1.455 -0.219 0 N-CA-C 112.815 0.672 . . . . 0.0 112.815 -173.836 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 150' ' ' PHE . . . . . . . . . . . . . 82.0 m-85 -64.34 -22.04 66.82 Favored 'General case' 0 N--CA 1.453 -0.307 0 CA-C-O 119.252 -0.404 . . . . 0.0 111.332 -177.523 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 151' ' ' ALA . . . . . . . . . . . . . . . -94.34 -28.61 15.46 Favored 'General case' 0 N--CA 1.456 -0.13 0 CA-C-N 118.202 0.455 . . . . 0.0 110.312 171.57 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 152' ' ' MET . . . . . . . . . . . . . 95.2 mtp -64.86 -14.59 59.98 Favored 'General case' 0 N--CA 1.456 -0.175 0 N-CA-C 111.631 0.234 . . . . 0.0 111.631 179.149 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 153' ' ' ASP . . . . . . . . . . . . . 69.7 m-20 -58.7 -16.79 18.07 Favored 'General case' 0 CA--C 1.53 0.191 0 N-CA-C 112.205 0.446 . . . . 0.0 112.205 171.974 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 154' ' ' LEU . . . . . . . . . . . . . 40.0 mt -104.45 13.86 31.12 Favored 'General case' 0 C--N 1.34 0.194 0 C-N-CA 123.062 0.545 . . . . 0.0 110.96 176.937 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 155' ' ' GLU . . . . . . . . . . . . . 57.9 mt-10 -127.51 14.3 7.07 Favored 'General case' 0 CA--C 1.536 0.418 0 C-N-CA 123.095 0.558 . . . . 0.0 112.34 -174.758 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 156' ' ' HIS . . . . . . . . . . . . . 48.0 m170 -65.51 -2.36 3.3 Favored 'General case' 0 N--CA 1.456 -0.165 0 O-C-N 121.787 -0.571 . . . . 0.0 111.498 175.605 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 157' ' ' HIS . . . . . . . . . . . . . 11.7 m80 -80.19 -4.66 53.97 Favored 'General case' 0 C--O 1.236 0.36 0 C-N-CA 124.86 1.264 . . . . 0.0 112.645 -179.485 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 158' ' ' HIS . . . . . . . . . . . . . 63.8 t60 -70.38 159.38 34.26 Favored 'General case' 0 C--O 1.243 0.735 0 C-N-CA 124.437 1.095 . . . . 0.0 110.048 -179.526 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 159' ' ' HIS . . . . . . . . . . . . . 17.8 t-160 . . . . . 0 CA--C 1.569 1.693 0 CA-C-O 115.589 -2.148 . . . . 0.0 112.891 -179.962 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' B' B 2052 ' ' ASP . . . . . . . . . . . . . 21.0 p-10 . . . . . 0 N--CA 1.476 0.859 0 N-CA-C 110.395 -0.224 . . . . 0.0 110.395 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' B' B 2053 ' ' ASP . . . . . . . . . . . . . 35.7 m-20 -85.13 158.89 20.27 Favored 'General case' 0 N--CA 1.451 -0.405 0 CA-C-O 120.958 0.409 . . . . 0.0 111.189 178.666 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B 2054 ' ' ASP . . . . . . . . . . . . . 32.2 t0 -158.66 179.76 8.81 Favored 'General case' 0 CA--C 1.53 0.201 0 N-CA-C 108.729 -0.841 . . . . 0.0 108.729 -178.878 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B 2055 ' ' GLU . . . . . . . . . . . . . 76.7 mm-40 -63.31 140.08 58.84 Favored 'General case' 0 N--CA 1.457 -0.115 0 N-CA-C 112.558 0.577 . . . . 0.0 112.558 -179.072 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B 2056 ' ' ASP . . . . . 0.55 ' HA ' ' H ' ' A' ' 26' ' ' GLY . 25.7 m-20 -102.95 30.31 4.87 Favored 'General case' 0 CA--C 1.533 0.302 0 C-N-CA 124.651 1.18 . . . . 0.0 110.412 176.985 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B 2057 ' ' ASP . . . . . . . . . . . . . 50.4 p-10 -74.24 56.1 0.62 Allowed 'General case' 0 CA--C 1.533 0.31 0 C-N-CA 124.705 1.202 . . . . 0.0 113.19 -174.681 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B 2058 ' ' TYR . . . . . . . . . . . . . 85.8 t80 -147.18 139.39 24.54 Favored 'General case' 0 C--N 1.34 0.161 0 O-C-N 121.539 -0.725 . . . . 0.0 110.923 173.467 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B 2059 ' ' THR . . . . . . . . . . . . . 2.9 m -174.55 125.1 0.39 Allowed Pre-proline 0 CA--C 1.531 0.225 0 C-N-CA 125.855 1.662 . . . . 0.0 106.688 170.917 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B 2060 ' ' PRO . . . . . . . . . . . . . 96.8 Cg_endo -73.8 165.68 31.61 Favored 'Trans proline' 0 N--CA 1.452 -0.921 0 C-N-CA 123.303 2.669 . . . . 0.0 110.508 179.293 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B 2061 ' ' SER . . . . . . . . . . . . . 86.0 p -144.77 20.67 1.64 Allowed 'General case' 0 N--CA 1.456 -0.166 0 N-CA-C 112.852 0.686 . . . . 0.0 112.852 -174.913 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B 2062 ' ' ILE . . . . . 0.563 HG23 HG12 ' A' ' 130' ' ' ILE . 1.2 tt -75.92 76.87 0.53 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.305 0 CA-C-O 121.847 0.832 . . . . 0.0 109.134 176.418 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B 2063 ' ' SER . . . . . . . . . . . . . 47.6 t . . . . . 0 C--O 1.252 1.205 0 CA-C-O 118.184 -0.913 . . . . 0.0 111.652 179.627 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 4.0 mpp? . . . . . 0 N--CA 1.473 0.713 0 N-CA-C 110.13 -0.322 . . . . 0.0 110.13 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 24.4 mp0 -74.5 -162.16 0.15 Allowed 'General case' 0 N--CA 1.45 -0.442 0 C-N-CA 124.004 0.922 . . . . 0.0 109.045 175.661 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 58.8 tt0 -67.79 89.15 0.26 Allowed 'General case' 0 CA--C 1.531 0.246 0 N-CA-C 107.755 -1.202 . . . . 0.0 107.755 171.62 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 79.9 m-20 -73.85 20.34 0.1 Allowed 'General case' 0 C--N 1.338 0.087 0 N-CA-C 115.532 1.679 . . . . 0.0 115.532 -170.986 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 47.8 p30 -83.39 0.63 45.2 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 121.472 0.653 . . . . 0.0 110.636 176.957 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 29.7 p-10 -82.04 -30.93 31.16 Favored 'General case' 0 N--CA 1.451 -0.389 0 N-CA-C 107.786 -1.19 . . . . 0.0 107.786 174.025 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 7' ' ' PHE . . . . . 0.511 ' CD1' ' HD3' ' A' ' 45' ' ' LYS . 1.3 t80 -59.14 -33.99 71.54 Favored 'General case' 0 N--CA 1.446 -0.67 0 C-N-CA 125.416 1.487 . . . . 0.0 109.981 -179.978 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 51.2 tp60 -49.76 -37.24 28.84 Favored 'General case' 0 N--CA 1.451 -0.395 0 C-N-CA 124.347 1.059 . . . . 0.0 111.609 -179.006 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 25.5 m-80 -73.94 -33.27 63.86 Favored 'General case' 0 N--CA 1.452 -0.356 0 O-C-N 122.202 -0.311 . . . . 0.0 110.397 -179.478 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 10' ' ' PHE . . . . . 0.417 ' CE2' ' HB2' ' A' ' 32' ' ' LEU . 6.5 t80 -71.23 -40.36 71.12 Favored 'General case' 0 N--CA 1.449 -0.515 0 C-N-CA 123.311 0.645 . . . . 0.0 109.499 177.511 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 89.1 t -63.6 -53.46 44.71 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.417 0 N-CA-C 108.407 -0.96 . . . . 0.0 108.407 179.071 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -59.54 -29.34 67.83 Favored 'General case' 0 N--CA 1.455 -0.221 0 C-N-CA 122.748 0.419 . . . . 0.0 111.774 -179.659 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 92.3 m -71.73 -37.12 70.64 Favored 'General case' 0 CA--C 1.531 0.216 0 N-CA-C 108.901 -0.777 . . . . 0.0 108.901 176.206 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.466 HD21 ' HB2' ' A' ' 53' ' ' TYR . 5.6 tp -69.03 -41.05 78.22 Favored 'General case' 0 N--CA 1.452 -0.352 0 CA-C-O 120.981 0.42 . . . . 0.0 110.379 178.751 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 64.1 mm-40 -64.88 -30.98 72.0 Favored 'General case' 0 N--CA 1.45 -0.447 0 N-CA-C 108.378 -0.971 . . . . 0.0 108.378 176.668 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 23.1 t -73.48 -20.45 60.68 Favored 'General case' 0 N--CA 1.453 -0.288 0 CA-C-N 115.844 -0.616 . . . . 0.0 109.894 178.375 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 17' ' ' PHE . . . . . 0.453 ' CD1' ' HA ' ' A' ' 14' ' ' LEU . 22.9 m-85 -75.43 -35.66 60.92 Favored 'General case' 0 N--CA 1.455 -0.188 0 C-N-CA 120.181 -0.607 . . . . 0.0 110.512 168.62 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 68.2 mttt -62.0 -28.79 69.82 Favored 'General case' 0 C--N 1.339 0.127 0 CA-C-N 118.37 0.532 . . . . 0.0 109.776 179.066 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 19.7 t0 -64.31 -20.89 66.38 Favored 'General case' 0 CA--C 1.533 0.323 0 CA-C-N 115.706 -0.679 . . . . 0.0 111.885 176.86 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 43.3 mt -70.79 155.17 41.12 Favored 'General case' 0 N--CA 1.457 -0.082 0 O-C-N 121.476 -0.765 . . . . 0.0 111.885 -175.192 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 1.4 mppt? -100.99 -3.72 28.88 Favored 'General case' 0 CA--C 1.528 0.116 0 N-CA-C 109.06 -0.719 . . . . 0.0 109.06 173.168 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 82.9 p -121.83 -20.4 6.42 Favored 'General case' 0 CA--C 1.528 0.096 0 C-N-CA 124.507 1.123 . . . . 0.0 111.091 -178.924 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 82.7 -16.8 24.04 Favored Glycine 0 CA--C 1.53 0.995 0 C-N-CA 124.153 0.882 . . . . 0.0 113.499 176.213 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 81.5 mt -101.43 148.5 7.24 Favored 'Isoleucine or valine' 0 CA--C 1.528 0.113 0 CA-C-N 118.452 1.126 . . . . 0.0 110.73 -179.671 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 41.9 t -162.54 85.59 0.56 Allowed 'General case' 0 CA--C 1.519 -0.23 0 N-CA-C 110.04 -0.356 . . . . 0.0 110.04 178.82 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . 0.428 ' O ' ' HE2' ' A' ' 30' ' ' LYS . . . -51.15 -39.72 42.68 Favored Glycine 0 CA--C 1.523 0.551 0 CA-C-O 119.168 -0.795 . . . . 0.0 112.236 -175.635 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 91.4 p -66.0 -48.03 72.54 Favored 'General case' 0 N--CA 1.454 -0.243 0 CA-C-N 118.999 1.399 . . . . 0.0 110.952 -176.807 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 54.5 mtm180 -73.15 -34.57 66.14 Favored 'General case' 0 CA--C 1.527 0.09 0 CA-C-N 118.014 0.37 . . . . 0.0 110.57 -179.351 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 65.1 mt -59.05 -48.45 86.67 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.487 0 N-CA-C 109.057 -0.72 . . . . 0.0 109.057 173.584 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . 0.428 ' HE2' ' O ' ' A' ' 26' ' ' GLY . 49.2 mtmt -68.75 -23.18 64.3 Favored 'General case' 0 N--CA 1.456 -0.173 0 CA-C-O 119.012 -0.518 . . . . 0.0 111.505 -179.564 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . 0.445 ' HA ' ' HE2' ' A' ' 31' ' ' LYS . 4.1 mmpt? -66.35 -57.14 8.1 Favored 'General case' 0 C--N 1.341 0.213 0 CA-C-N 118.693 0.679 . . . . 0.0 110.443 176.255 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.489 HD12 ' N ' ' A' ' 33' ' ' THR . 2.3 pp -75.43 -18.85 59.79 Favored 'General case' 0 CA--C 1.531 0.247 0 C-N-CA 119.615 -0.834 . . . . 0.0 111.505 -178.105 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . 0.489 ' N ' HD12 ' A' ' 32' ' ' LEU . 60.1 m -72.88 -38.42 66.99 Favored 'General case' 0 N--CA 1.455 -0.222 0 N-CA-C 109.077 -0.712 . . . . 0.0 109.077 175.678 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 57.9 m -69.08 -35.59 76.67 Favored 'General case' 0 N--CA 1.453 -0.312 0 N-CA-C 110.001 -0.37 . . . . 0.0 110.001 179.918 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 9.1 t80 -62.17 -39.51 92.91 Favored 'General case' 0 C--O 1.231 0.122 0 N-CA-C 109.626 -0.509 . . . . 0.0 109.626 174.446 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -71.61 -36.79 70.92 Favored 'General case' 0 N--CA 1.448 -0.526 0 CA-C-O 119.564 -0.255 . . . . 0.0 111.685 -179.644 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -70.0 -34.07 72.85 Favored 'General case' 0 N--CA 1.456 -0.168 0 CA-C-N 117.915 0.325 . . . . 0.0 111.045 -179.825 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 43.9 t0 -68.91 -23.93 64.24 Favored 'General case' 0 CA--C 1.533 0.325 0 C-N-CA 122.132 0.173 . . . . 0.0 110.633 176.934 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 39' ' ' HIS . . . . . 0.41 ' HB2' HD11 ' A' ' 42' ' ' ILE . 97.8 m-70 -151.93 104.6 3.01 Favored 'General case' 0 N--CA 1.456 -0.167 0 N-CA-C 112.199 0.444 . . . . 0.0 112.199 -174.517 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 40' ' ' ILE . . . . . 0.581 ' H ' HD13 ' A' ' 40' ' ' ILE . 0.0 OUTLIER -79.0 -12.03 13.25 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.302 0 C-N-CA 122.736 0.414 . . . . 0.0 110.149 174.165 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 16.0 m-20 -59.44 -11.73 4.95 Favored 'General case' 0 CA--C 1.53 0.176 0 C-N-CA 123.418 0.687 . . . . 0.0 112.787 -176.794 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . 0.41 HD11 ' HB2' ' A' ' 39' ' ' HIS . 0.0 OUTLIER -119.46 18.06 6.58 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.198 0 C-N-CA 124.068 0.947 . . . . 0.0 111.667 177.799 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 3.0 pp20? -53.88 -28.91 39.19 Favored 'General case' 0 CA--C 1.53 0.193 0 O-C-N 121.379 -0.825 . . . . 0.0 111.296 178.092 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 47.1 t -65.21 -44.24 88.94 Favored 'General case' 0 CA--C 1.533 0.289 0 N-CA-C 111.899 0.333 . . . . 0.0 111.899 -177.878 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . 0.511 ' HD3' ' CD1' ' A' ' 7' ' ' PHE . 15.0 ptpt -74.87 -25.67 59.13 Favored 'General case' 0 CA--C 1.53 0.185 0 CA-C-N 118.385 0.539 . . . . 0.0 109.816 179.012 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 67.2 mt -72.72 -51.68 26.61 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.251 0 C-N-CA 123.076 0.55 . . . . 0.0 110.314 -177.476 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 38.8 mm -67.11 -39.95 84.27 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.112 0 N-CA-C 110.119 -0.326 . . . . 0.0 110.119 -179.768 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 48.0 t -66.72 -33.59 75.98 Favored 'General case' 0 N--CA 1.453 -0.313 0 C-N-CA 120.745 -0.382 . . . . 0.0 111.201 -178.841 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . 0.41 ' HG ' HD22 ' A' ' 14' ' ' LEU . 44.4 tp -78.68 -37.55 41.5 Favored 'General case' 0 N--CA 1.451 -0.397 0 N-CA-C 112.749 0.648 . . . . 0.0 112.749 -177.474 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . 0.487 HD12 HG12 ' A' ' 69' ' ' ILE . 3.6 pt -67.4 -44.01 87.3 Favored 'Isoleucine or valine' 0 C--N 1.34 0.162 0 CA-C-N 118.924 0.784 . . . . 0.0 110.172 178.933 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 16.9 pt -65.48 -38.05 81.53 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.203 0 C-N-CA 119.858 -0.737 . . . . 0.0 111.477 178.758 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 47.6 t0 -60.86 -53.63 54.95 Favored 'General case' 0 CA--C 1.528 0.104 0 CA-C-N 118.484 0.584 . . . . 0.0 110.21 177.469 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 53' ' ' TYR . . . . . 0.466 ' HB2' HD21 ' A' ' 14' ' ' LEU . 3.5 t80 -61.16 -32.49 72.22 Favored 'General case' 0 C--O 1.225 -0.21 0 CA-C-O 118.813 -0.613 . . . . 0.0 109.839 179.173 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 17.2 p -63.46 -35.99 82.26 Favored 'General case' 0 N--CA 1.456 -0.16 0 CA-C-N 118.693 0.679 . . . . 0.0 110.859 -179.89 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 1.9 tpp180 -79.49 -39.69 31.52 Favored 'General case' 0 N--CA 1.455 -0.195 0 C-N-CA 122.146 0.178 . . . . 0.0 111.181 -177.57 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 79.6 mt -77.75 -45.28 25.11 Favored 'General case' 0 N--CA 1.455 -0.215 0 C-N-CA 123.764 0.825 . . . . 0.0 113.196 -176.468 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 13.6 p -64.38 159.64 57.3 Favored Pre-proline 0 CA--C 1.533 0.3 0 N-CA-C 113.882 1.067 . . . . 0.0 113.882 -171.628 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 33.4 Cg_exo -58.03 175.65 0.45 Allowed 'Trans proline' 0 N--CA 1.454 -0.796 0 C-N-CA 125.012 3.808 . . . . 0.0 112.827 173.884 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 35.8 p-10 -63.6 -42.19 98.28 Favored 'General case' 0 CA--C 1.53 0.189 0 C-N-CA 123.916 0.886 . . . . 0.0 112.171 -174.945 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 20.0 m -72.57 -35.48 67.97 Favored 'General case' 0 N--CA 1.452 -0.362 0 C-N-CA 122.702 0.401 . . . . 0.0 110.015 -178.203 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 51.3 m80 -75.17 -23.72 57.78 Favored 'General case' 0 N--CA 1.452 -0.337 0 C-N-CA 122.814 0.446 . . . . 0.0 110.252 177.817 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 22.3 ttmm -71.94 -35.41 69.61 Favored 'General case' 0 N--CA 1.455 -0.184 0 N-CA-C 109.327 -0.619 . . . . 0.0 109.327 174.527 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -62.76 -44.29 96.58 Favored 'General case' 0 CA--C 1.532 0.269 0 N-CA-C 107.155 -1.424 . . . . 0.0 107.155 172.078 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -65.59 -29.69 75.73 Favored Glycine 0 CA--C 1.526 0.736 0 N-CA-C 111.474 -0.65 . . . . 0.0 111.474 179.99 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 35.3 t -65.56 -41.52 92.86 Favored 'General case' 0 N--CA 1.452 -0.351 0 CA-C-N 117.469 0.635 . . . . 0.0 109.449 176.814 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 81.4 mt -67.74 -27.44 66.79 Favored 'General case' 0 N--CA 1.453 -0.276 0 N-CA-C 110.473 -0.195 . . . . 0.0 110.473 178.157 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 67' ' ' TYR . . . . . 0.414 ' CD2' HD11 ' A' ' 127' ' ' LEU . 2.4 m-85 -70.09 -37.99 75.58 Favored 'General case' 0 C--N 1.34 0.153 0 CA-C-N 117.983 0.356 . . . . 0.0 110.731 174.873 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 68' ' ' ILE . . . . . 0.446 HD11 ' CE1' ' A' ' 17' ' ' PHE . 13.9 mt -69.95 -54.2 20.19 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.451 0 N-CA-C 109.259 -0.645 . . . . 0.0 109.259 178.297 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 69' ' ' ILE . . . . . 0.487 HG12 HD12 ' A' ' 50' ' ' ILE . 68.5 mt -48.11 -37.39 6.9 Favored 'Isoleucine or valine' 0 C--N 1.34 0.154 0 C-N-CA 124.141 0.976 . . . . 0.0 111.478 173.834 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 23.9 t70 -69.18 -43.89 73.31 Favored 'General case' 0 CA--C 1.52 -0.196 0 CA-C-N 118.912 0.778 . . . . 0.0 110.909 179.386 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 25.3 m -66.96 -56.01 12.05 Favored 'General case' 0 N--CA 1.449 -0.523 0 O-C-N 123.416 0.448 . . . . 0.0 110.024 -174.506 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -74.68 -32.97 30.26 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.386 0 N-CA-C 109.948 -0.39 . . . . 0.0 109.948 -176.944 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -65.57 -58.46 9.26 Favored Glycine 0 C--N 1.339 0.71 0 N-CA-C 111.388 -0.685 . . . . 0.0 111.388 -175.412 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 46.4 mtm105 -69.26 -36.41 77.1 Favored 'General case' 0 N--CA 1.456 -0.166 0 CA-C-N 117.455 0.628 . . . . 0.0 110.542 -178.972 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -64.23 -29.38 70.48 Favored 'General case' 0 N--CA 1.45 -0.433 0 C-N-CA 119.645 -0.822 . . . . 0.0 110.707 179.658 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 1.6 m-30 -71.27 -45.98 61.94 Favored 'General case' 0 C--N 1.342 0.244 0 CA-C-N 118.594 0.634 . . . . 0.0 110.637 175.399 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -64.58 -45.11 88.39 Favored 'General case' 0 N--CA 1.45 -0.452 0 N-CA-C 108.027 -1.101 . . . . 0.0 108.027 -178.123 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 92.2 m-20 -55.92 -46.85 78.34 Favored 'General case' 0 C--O 1.231 0.082 0 N-CA-C 113.463 0.912 . . . . 0.0 113.463 173.927 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 12.4 tm-20 -64.13 -47.44 79.92 Favored 'General case' 0 N--CA 1.449 -0.48 0 CA-C-N 118.604 0.638 . . . . 0.0 111.054 -178.341 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 80' ' ' THR . . . . . 0.563 HG21 ' HB3' ' A' ' 94' ' ' CYS . 75.7 p -69.34 -27.23 65.17 Favored 'General case' 0 N--CA 1.453 -0.304 0 CA-C-O 119.692 -0.194 . . . . 0.0 110.685 -179.409 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 36.4 ttp-105 -70.34 -27.69 64.56 Favored 'General case' 0 N--CA 1.451 -0.395 0 CA-C-N 118.096 0.407 . . . . 0.0 110.189 172.618 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 32.2 m -86.5 -35.94 19.29 Favored 'General case' 0 N--CA 1.453 -0.276 0 N-CA-C 113.025 0.75 . . . . 0.0 113.025 -176.417 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 53.2 m-20 -128.14 12.43 6.61 Favored 'General case' 0 CA--C 1.519 -0.242 0 N-CA-C 114.709 1.374 . . . . 0.0 114.709 -174.72 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 30.0 t 60.57 -21.26 0.03 OUTLIER 'General case' 0 N--CA 1.451 -0.41 0 N-CA-C 116.474 2.027 . . . . 0.0 116.474 173.959 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 85' ' ' ASN . . . . . 0.471 ' OD1' HG22 ' A' ' 80' ' ' THR . 1.1 m-80 55.72 -175.66 0.05 OUTLIER 'General case' 0 CA--C 1.533 0.323 0 C-N-CA 124.047 0.939 . . . . 0.0 111.058 -174.402 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 70.3 m -68.05 139.54 56.27 Favored 'General case' 0 N--CA 1.456 -0.13 0 O-C-N 122.016 -0.428 . . . . 0.0 111.133 -178.805 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 88.9 p -87.99 37.55 0.81 Allowed 'General case' 0 CA--C 1.532 0.263 0 C-N-CA 123.647 0.779 . . . . 0.0 111.378 -179.481 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 37.9 t -152.43 164.62 37.16 Favored 'General case' 0 N--CA 1.455 -0.222 0 N-CA-C 109.882 -0.414 . . . . 0.0 109.882 -177.309 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 59.4 m-20 55.96 -163.93 0.14 Allowed 'General case' 0 CA--C 1.53 0.201 0 C-N-CA 123.583 0.753 . . . . 0.0 111.049 -175.536 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 90' ' ' LYS . . . . . 0.715 ' H ' ' HD2' ' A' ' 91' ' ' PRO . 83.0 tttt -144.13 -50.49 0.02 OUTLIER Pre-proline 0 CA--C 1.531 0.24 0 CA-C-O 118.286 -0.864 . . . . 0.0 111.708 177.356 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 91' ' ' PRO . . . . . 0.715 ' HD2' ' H ' ' A' ' 90' ' ' LYS . 56.3 Cg_endo -64.47 149.88 89.23 Favored 'Trans proline' 0 N--CA 1.45 -1.047 0 N-CA-C 108.467 -1.397 . . . . 0.0 108.467 172.269 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 90.23 17.06 54.49 Favored Glycine 0 CA--C 1.524 0.628 0 CA-C-O 119.417 -0.657 . . . . 0.0 112.277 -177.289 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 38.5 p -151.61 172.5 15.95 Favored 'General case' 0 C--N 1.341 0.201 0 CA-C-N 117.946 0.873 . . . . 0.0 110.203 176.739 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 94' ' ' CYS . . . . . 0.563 ' HB3' HG21 ' A' ' 80' ' ' THR . 26.2 p -59.98 -20.99 60.61 Favored 'General case' 0 N--CA 1.449 -0.493 0 CA-C-N 115.621 -0.718 . . . . 0.0 109.936 175.682 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -60.29 -55.26 35.84 Favored 'General case' 0 N--CA 1.448 -0.53 0 N-CA-C 109.398 -0.593 . . . . 0.0 109.398 -177.261 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 69.3 t60 -75.46 -34.74 60.95 Favored 'General case' 0 N--CA 1.448 -0.546 0 CA-C-N 116.736 -0.211 . . . . 0.0 110.906 179.68 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -66.18 -49.41 67.45 Favored 'General case' 0 N--CA 1.451 -0.413 0 O-C-N 123.09 0.244 . . . . 0.0 111.126 -176.17 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 98' ' ' ILE . . . . . 0.434 HD13 ' HB2' ' A' ' 94' ' ' CYS . 1.7 mp -72.79 -34.62 47.4 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.251 0 CA-C-O 119.234 -0.413 . . . . 0.0 109.986 179.699 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 1.4 m120 -66.14 -40.23 90.47 Favored 'General case' 0 N--CA 1.453 -0.289 0 CA-C-N 118.612 0.642 . . . . 0.0 111.293 178.715 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 92.6 m -75.19 -34.85 61.56 Favored 'General case' 0 N--CA 1.454 -0.256 0 CA-C-N 118.008 0.367 . . . . 0.0 110.838 -178.471 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 58.8 tp -75.65 -38.77 58.58 Favored 'General case' 0 N--CA 1.451 -0.417 0 C-N-CA 122.886 0.474 . . . . 0.0 111.013 -178.589 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -67.18 -23.58 73.15 Favored Glycine 0 CA--C 1.528 0.856 0 CA-C-O 119.542 -0.588 . . . . 0.0 113.441 -173.479 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 16.3 mm-40 -74.63 -35.77 62.91 Favored 'General case' 0 CA--C 1.52 -0.188 0 CA-C-N 118.158 0.979 . . . . 0.0 111.179 179.41 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 25.9 m -101.77 -13.43 8.41 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.138 0 N-CA-C 113.379 0.881 . . . . 0.0 113.379 -176.114 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 105' ' ' ILE . . . . . . . . . . . . . 11.0 tp -61.84 -27.24 41.89 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.161 0 CA-C-N 119.18 0.9 . . . . 0.0 111.564 -175.282 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 19.8 pt20 -67.0 -29.86 69.8 Favored 'General case' 0 N--CA 1.453 -0.277 0 N-CA-C 109.994 -0.373 . . . . 0.0 109.994 176.704 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 86.1 mt-10 -75.75 -41.31 53.63 Favored 'General case' 0 N--CA 1.454 -0.265 0 N-CA-C 109.918 -0.401 . . . . 0.0 109.918 175.806 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 9.9 mp -64.66 -41.97 95.72 Favored 'General case' 0 C--N 1.34 0.164 0 N-CA-C 110.361 -0.237 . . . . 0.0 110.361 -178.472 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 72.3 mt -66.85 -50.78 61.44 Favored 'General case' 0 N--CA 1.453 -0.284 0 N-CA-C 109.833 -0.432 . . . . 0.0 109.833 178.952 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 16.8 m -59.51 -45.79 90.71 Favored 'General case' 0 C--O 1.232 0.155 0 CA-C-N 117.724 0.238 . . . . 0.0 111.022 -178.744 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 44.7 t0 -62.83 -38.44 90.77 Favored 'General case' 0 N--CA 1.454 -0.234 0 N-CA-C 108.932 -0.766 . . . . 0.0 108.932 179.258 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -68.03 -31.65 71.47 Favored 'General case' 0 N--CA 1.446 -0.645 0 CA-C-O 119.352 -0.356 . . . . 0.0 111.611 -176.531 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 113' ' ' ILE . . . . . . . . . . . . . 31.2 mm -70.38 -44.1 77.68 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.269 0 C-N-CA 118.856 -1.137 . . . . 0.0 109.362 178.011 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -72.91 -33.92 66.29 Favored 'General case' 0 N--CA 1.452 -0.334 0 N-CA-C 113.033 0.753 . . . . 0.0 113.033 -178.483 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -79.45 -37.01 37.94 Favored 'General case' 0 C--N 1.34 0.174 0 CA-C-N 118.293 0.497 . . . . 0.0 111.805 -179.186 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 116' ' ' SER . . . . . 0.496 ' HB2' ' CB ' ' A' ' 120' ' ' HIS . 21.0 p -85.45 164.6 17.78 Favored 'General case' 0 N--CA 1.449 -0.488 0 CA-C-O 120.93 0.395 . . . . 0.0 112.019 -171.431 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 20.4 m-80 -78.43 -100.19 0.02 OUTLIER 'General case' 0 N--CA 1.455 -0.204 0 N-CA-C 113.557 0.947 . . . . 0.0 113.557 -171.095 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 118' ' ' GLN . . . . . 0.482 ' HA ' ' HE2' ' A' ' 121' ' ' LYS . 14.8 mm100 -136.84 -49.84 0.64 Allowed 'General case' 0 CA--C 1.52 -0.174 0 CA-C-O 120.862 0.363 . . . . 0.0 110.355 -179.005 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 119' ' ' ASP . . . . . 0.407 ' N ' ' OD1' ' A' ' 119' ' ' ASP . 10.3 p-10 -62.9 -39.17 93.72 Favored 'General case' 0 N--CA 1.453 -0.3 0 N-CA-C 108.471 -0.937 . . . . 0.0 108.471 175.206 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 120' ' ' HIS . . . . . 0.496 ' CB ' ' HB2' ' A' ' 116' ' ' SER . 39.9 m170 -66.04 -40.91 91.36 Favored 'General case' 0 N--CA 1.45 -0.457 0 CA-C-N 115.687 -0.688 . . . . 0.0 110.881 176.477 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 121' ' ' LYS . . . . . 0.482 ' HE2' ' HA ' ' A' ' 118' ' ' GLN . 38.2 mtmt -63.67 -34.85 78.77 Favored 'General case' 0 N--CA 1.455 -0.213 0 N-CA-C 109.795 -0.446 . . . . 0.0 109.795 179.443 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 4.8 tm-20 -64.41 -48.66 74.55 Favored 'General case' 0 N--CA 1.456 -0.131 0 CA-C-N 117.705 0.23 . . . . 0.0 110.418 178.239 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 69.7 mmtt -59.8 -30.82 69.16 Favored 'General case' 0 N--CA 1.455 -0.214 0 CA-C-N 116.786 -0.188 . . . . 0.0 111.459 179.222 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 124' ' ' ILE . . . . . . . . . . . . . 51.3 mt -74.75 -34.34 33.7 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.293 0 O-C-N 121.882 -0.511 . . . . 0.0 110.183 178.681 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 125' ' ' ARG . . . . . 0.433 ' HE ' ' CE1' ' A' ' 159' ' ' HIS . 24.1 mmt180 -68.46 -35.83 78.12 Favored 'General case' 0 N--CA 1.455 -0.189 0 CA-C-O 119.361 -0.352 . . . . 0.0 111.244 178.394 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 126' ' ' MET . . . . . . . . . . . . . 27.8 ptm -71.91 -33.48 68.32 Favored 'General case' 0 C--N 1.34 0.154 0 C-N-CA 119.333 -0.947 . . . . 0.0 109.514 177.659 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 127' ' ' LEU . . . . . 0.414 HD11 ' CD2' ' A' ' 67' ' ' TYR . 65.2 mt -70.7 -25.7 63.08 Favored 'General case' 0 C--N 1.341 0.2 0 CA-C-N 118.109 0.413 . . . . 0.0 110.167 175.882 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 55.3 tp -68.99 -42.97 75.82 Favored 'General case' 0 N--CA 1.452 -0.327 0 N-CA-C 109.793 -0.447 . . . . 0.0 109.793 177.875 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 12.9 t70 -61.46 -46.2 91.04 Favored 'General case' 0 N--CA 1.456 -0.133 0 N-CA-C 109.576 -0.528 . . . . 0.0 109.576 175.641 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 72.9 mt -59.86 -40.42 82.7 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.392 0 CA-C-N 116.362 -0.381 . . . . 0.0 110.991 -177.42 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 131' ' ' TRP . . . . . . . . . . . . . 46.1 m0 -76.73 -25.11 53.15 Favored 'General case' 0 N--CA 1.453 -0.306 0 N-CA-C 112.754 0.65 . . . . 0.0 112.754 178.535 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 31.7 t0 -74.66 -28.78 61.0 Favored 'General case' 0 N--CA 1.456 -0.16 0 CA-C-N 118.282 0.492 . . . . 0.0 110.185 178.607 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 133' ' ' ARG . . . . . 0.488 HH21 ' C ' ' B' 2063 ' ' SER . 18.4 mtp180 -75.22 -41.69 57.06 Favored 'General case' 0 N--CA 1.456 -0.158 0 C-N-CA 124.243 1.017 . . . . 0.0 109.875 175.555 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 37.1 t -75.28 -10.45 59.47 Favored 'General case' 0 N--CA 1.454 -0.263 0 C-N-CA 123.19 0.596 . . . . 0.0 111.798 -179.238 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 135' ' ' GLY . . . . . . . . . . . . . . . 74.49 1.7 61.8 Favored Glycine 0 CA--C 1.527 0.832 0 CA-C-O 119.373 -0.682 . . . . 0.0 112.222 179.786 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 136' ' ' LEU . . . . . 0.442 HD23 ' HA ' ' A' ' 136' ' ' LEU . 13.4 mt -76.86 -17.42 58.98 Favored 'General case' 0 CA--C 1.529 0.151 0 CA-C-N 118.103 0.952 . . . . 0.0 111.057 178.294 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 137' ' ' PHE . . . . . . . . . . . . . 54.2 t80 -93.16 140.58 29.36 Favored 'General case' 0 N--CA 1.452 -0.371 0 N-CA-C 109.131 -0.692 . . . . 0.0 109.131 173.078 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 138' ' ' GLN . . . . . . . . . . . . . 20.8 pt20 -67.63 123.61 20.94 Favored 'General case' 0 N--CA 1.453 -0.321 0 N-CA-C 108.953 -0.758 . . . . 0.0 108.953 178.099 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 139' ' ' LYS . . . . . . . . . . . . . 26.2 mtpp -76.43 22.74 0.16 Allowed 'General case' 0 CA--C 1.53 0.182 0 C-N-CA 122.542 0.337 . . . . 0.0 111.407 -178.258 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 140' ' ' SER . . . . . . . . . . . . . 79.4 p -82.31 -16.69 48.43 Favored 'General case' 0 N--CA 1.456 -0.175 0 C-N-CA 123.878 0.871 . . . . 0.0 110.344 176.719 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 141' ' ' TYR . . . . . . . . . . . . . 74.2 m-85 48.17 55.3 8.95 Favored 'General case' 0 C--N 1.342 0.246 0 C-N-CA 124.052 0.941 . . . . 0.0 112.468 177.098 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 142' ' ' LEU . . . . . . . . . . . . . 64.2 mt -63.41 156.12 26.96 Favored 'General case' 0 C--O 1.233 0.187 0 CA-C-O 121.164 0.507 . . . . 0.0 112.141 -176.407 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 24.9 p-10 -71.31 -21.68 62.04 Favored 'General case' 0 N--CA 1.456 -0.137 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.89 -179.981 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . -62.18 -41.45 98.35 Favored 'General case' 0 N--CA 1.452 -0.343 0 N-CA-C 109.939 -0.393 . . . . 0.0 109.939 179.363 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 145' ' ' ILE . . . . . . . . . . . . . 18.2 mm -63.15 -29.1 46.41 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.317 0 C-N-CA 122.22 0.208 . . . . 0.0 110.913 177.275 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 146' ' ' ARG . . . . . 0.506 HH11 ' HG2' ' A' ' 146' ' ' ARG . 5.5 mmt-85 -73.21 -27.54 61.67 Favored 'General case' 0 C--N 1.339 0.134 0 N-CA-C 109.527 -0.546 . . . . 0.0 109.527 178.451 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 147' ' ' SER . . . . . . . . . . . . . 48.2 t 55.09 43.2 29.99 Favored 'General case' 0 N--CA 1.456 -0.129 0 C-N-CA 123.502 0.721 . . . . 0.0 111.849 177.836 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 148' ' ' LYS . . . . . 0.511 ' HE2' ' HA ' ' A' ' 148' ' ' LYS . 6.2 mmpt? -58.58 -18.52 30.62 Favored 'General case' 0 N--CA 1.453 -0.296 0 N-CA-C 113.347 0.869 . . . . 0.0 113.347 -175.534 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 149' ' ' CYS . . . . . . . . . . . . . 23.6 p -69.2 -50.69 45.14 Favored 'General case' 0 N--CA 1.452 -0.359 0 CA-C-N 118.795 0.725 . . . . 0.0 109.441 177.301 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 150' ' ' PHE . . . . . . . . . . . . . 36.5 t80 -71.55 -18.61 62.24 Favored 'General case' 0 N--CA 1.454 -0.26 0 N-CA-C 109.963 -0.384 . . . . 0.0 109.963 179.76 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 151' ' ' ALA . . . . . . . . . . . . . . . -74.84 -39.35 61.66 Favored 'General case' 0 N--CA 1.45 -0.427 0 N-CA-C 110.243 -0.28 . . . . 0.0 110.243 176.106 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 152' ' ' MET . . . . . . . . . . . . . 97.3 mtp -75.88 -18.61 59.35 Favored 'General case' 0 N--CA 1.456 -0.141 0 C-N-CA 122.378 0.271 . . . . 0.0 111.142 177.508 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 153' ' ' ASP . . . . . . . . . . . . . 67.3 m-20 -69.55 -5.57 25.21 Favored 'General case' 0 CA--C 1.53 0.211 0 C-N-CA 122.504 0.321 . . . . 0.0 111.033 171.21 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 154' ' ' LEU . . . . . . . . . . . . . 80.9 mt -124.54 151.91 44.12 Favored 'General case' 0 N--CA 1.454 -0.247 0 C-N-CA 123.511 0.724 . . . . 0.0 110.028 179.191 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 155' ' ' GLU . . . . . . . . . . . . . 43.2 mp0 -67.51 -13.44 62.05 Favored 'General case' 0 N--CA 1.455 -0.199 0 C-N-CA 122.689 0.396 . . . . 0.0 111.057 -178.822 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 156' ' ' HIS . . . . . . . . . . . . . 26.6 m80 -78.07 -15.99 58.42 Favored 'General case' 0 N--CA 1.454 -0.23 0 C-N-CA 122.913 0.485 . . . . 0.0 111.978 -179.892 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 157' ' ' HIS . . . . . . . . . . . . . 95.2 m-70 55.69 10.25 0.51 Allowed 'General case' 0 CA--C 1.533 0.302 0 C-N-CA 123.835 0.854 . . . . 0.0 112.931 -176.552 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 158' ' ' HIS . . . . . . . . . . . . . 99.3 m-70 -148.72 172.11 15.13 Favored 'General case' 0 N--CA 1.454 -0.246 0 C-N-CA 124.539 1.136 . . . . 0.0 109.419 -179.242 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 159' ' ' HIS . . . . . 0.433 ' CE1' ' HE ' ' A' ' 125' ' ' ARG . 17.9 p-80 . . . . . 0 C--O 1.252 1.215 0 CA-C-O 116.413 -1.756 . . . . 0.0 110.117 178.325 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B 2052 ' ' ASP . . . . . . . . . . . . . 2.9 m-20 . . . . . 0 N--CA 1.474 0.754 0 N-CA-C 110.598 -0.149 . . . . 0.0 110.598 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' B' B 2053 ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -123.03 165.66 16.41 Favored 'General case' 0 CA--C 1.535 0.394 0 C-N-CA 124.067 0.947 . . . . 0.0 109.179 -177.434 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B 2054 ' ' ASP . . . . . 0.485 ' CG ' ' H ' ' B' 2055 ' ' GLU . 11.6 p-10 -155.81 -114.36 0.03 OUTLIER 'General case' 0 CA--C 1.538 0.509 0 CA-C-N 118.54 0.609 . . . . 0.0 112.286 -170.946 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B 2055 ' ' GLU . . . . . 0.485 ' H ' ' CG ' ' B' 2054 ' ' ASP . 67.9 tt0 -72.19 61.99 0.47 Allowed 'General case' 0 CA--C 1.532 0.265 0 C-N-CA 125.645 1.578 . . . . 0.0 109.461 178.438 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B 2056 ' ' ASP . . . . . . . . . . . . . 10.4 m-20 -68.13 15.64 0.05 OUTLIER 'General case' 0 N--CA 1.455 -0.199 0 N-CA-C 113.899 1.074 . . . . 0.0 113.899 -176.866 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B 2057 ' ' ASP . . . . . . . . . . . . . 40.3 t0 -154.61 62.06 0.67 Allowed 'General case' 0 N--CA 1.454 -0.226 0 CA-C-N 118.371 0.532 . . . . 0.0 110.486 175.097 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B 2058 ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -50.48 129.98 23.01 Favored 'General case' 0 N--CA 1.454 -0.265 0 N-CA-C 109.499 -0.556 . . . . 0.0 109.499 175.49 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B 2059 ' ' THR . . . . . . . . . . . . . 72.3 p -91.2 111.47 48.8 Favored Pre-proline 0 C--O 1.233 0.192 0 N-CA-C 109.562 -0.533 . . . . 0.0 109.562 179.923 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B 2060 ' ' PRO . . . . . . . . . . . . . 98.1 Cg_endo -73.85 128.06 12.08 Favored 'Trans proline' 0 N--CA 1.45 -1.041 0 C-N-CA 123.219 2.613 . . . . 0.0 111.245 -178.856 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B 2061 ' ' SER . . . . . . . . . . . . . 74.0 p -81.09 132.32 35.35 Favored 'General case' 0 N--CA 1.453 -0.295 0 N-CA-C 107.988 -1.115 . . . . 0.0 107.988 172.935 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B 2062 ' ' ILE . . . . . 0.437 HD11 ' HB2' ' A' ' 133' ' ' ARG . 3.8 tp -153.21 129.42 1.81 Allowed 'Isoleucine or valine' 0 C--N 1.341 0.196 0 N-CA-C 112.515 0.561 . . . . 0.0 112.515 -174.367 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B 2063 ' ' SER . . . . . 0.488 ' C ' HH21 ' A' ' 133' ' ' ARG . 39.7 m . . . . . 0 C--O 1.251 1.137 0 CA-C-O 117.674 -1.155 . . . . 0.0 109.748 174.701 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 93.5 mmm . . . . . 0 N--CA 1.471 0.617 0 N-CA-C 110.386 -0.227 . . . . 0.0 110.386 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 6.7 tt0 -149.9 14.09 0.81 Allowed 'General case' 0 N--CA 1.455 -0.201 0 CA-C-O 120.715 0.293 . . . . 0.0 111.211 177.045 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 17.9 pm0 -76.79 52.16 0.82 Allowed 'General case' 0 CA--C 1.53 0.201 0 C-N-CA 123.552 0.741 . . . . 0.0 109.209 175.847 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 70.5 m-20 61.07 15.99 6.7 Favored 'General case' 0 N--CA 1.456 -0.127 0 C-N-CA 124.999 1.32 . . . . 0.0 113.612 -174.777 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 45.1 p-10 -97.03 1.69 50.49 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.513 0.673 . . . . 0.0 110.504 173.633 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 24.1 p-10 -91.55 -32.61 15.48 Favored 'General case' 0 N--CA 1.451 -0.385 0 N-CA-C 106.98 -1.489 . . . . 0.0 106.98 171.851 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 7' ' ' PHE . . . . . 0.471 ' CD1' ' HD3' ' A' ' 45' ' ' LYS . 1.2 t80 -56.51 -34.37 66.92 Favored 'General case' 0 N--CA 1.449 -0.509 0 C-N-CA 125.144 1.378 . . . . 0.0 109.248 176.49 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 51.7 tp60 -49.77 -37.49 30.04 Favored 'General case' 0 N--CA 1.453 -0.308 0 C-N-CA 124.452 1.101 . . . . 0.0 111.861 -178.606 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 23.9 m-80 -73.02 -34.54 66.43 Favored 'General case' 0 N--CA 1.454 -0.232 0 CA-C-O 120.871 0.367 . . . . 0.0 110.23 -179.487 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 10' ' ' PHE . . . . . 0.458 ' CD2' ' HB2' ' A' ' 32' ' ' LEU . 9.1 t80 -70.05 -39.18 75.87 Favored 'General case' 0 N--CA 1.449 -0.498 0 C-N-CA 123.442 0.697 . . . . 0.0 109.454 176.777 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 98.7 t -64.56 -51.44 67.65 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.299 0 N-CA-C 108.757 -0.831 . . . . 0.0 108.757 178.978 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -59.21 -31.41 69.01 Favored 'General case' 0 N--CA 1.455 -0.175 0 CA-C-N 117.639 0.2 . . . . 0.0 111.529 179.737 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 46.8 m -71.17 -41.51 70.25 Favored 'General case' 0 N--CA 1.457 -0.111 0 N-CA-C 109.075 -0.713 . . . . 0.0 109.075 176.56 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -62.47 -41.61 98.9 Favored 'General case' 0 N--CA 1.451 -0.421 0 N-CA-C 109.482 -0.562 . . . . 0.0 109.482 177.929 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 61.4 mm-40 -66.38 -27.81 68.16 Favored 'General case' 0 N--CA 1.453 -0.314 0 C-N-CA 123.491 0.716 . . . . 0.0 110.137 179.312 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 16.0 p -70.9 -30.65 67.05 Favored 'General case' 0 N--CA 1.455 -0.19 0 N-CA-C 110.08 -0.341 . . . . 0.0 110.08 177.068 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 17' ' ' PHE . . . . . 0.48 ' CD1' HD11 ' A' ' 68' ' ' ILE . 24.4 m-85 -71.45 -32.03 67.86 Favored 'General case' 0 N--CA 1.457 -0.123 0 C-N-CA 120.675 -0.41 . . . . 0.0 110.764 173.672 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 76.4 mttt -67.21 -28.1 67.79 Favored 'General case' 0 C--O 1.232 0.171 0 CA-C-O 121.276 0.56 . . . . 0.0 109.939 172.1 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 41.0 t0 -76.09 -38.97 56.33 Favored 'General case' 0 CA--C 1.531 0.217 0 CA-C-N 115.861 -0.609 . . . . 0.0 110.676 -179.252 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 74.5 mt -74.89 128.74 36.29 Favored 'General case' 0 N--CA 1.454 -0.245 0 N-CA-C 109.187 -0.671 . . . . 0.0 109.187 175.05 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . 0.529 ' HA ' ' HE3' ' A' ' 21' ' ' LYS . 0.4 OUTLIER -73.8 -12.48 60.71 Favored 'General case' 0 CA--C 1.53 0.177 0 O-C-N 121.857 -0.527 . . . . 0.0 110.485 176.946 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 80.7 p -88.04 -23.88 23.64 Favored 'General case' 0 N--CA 1.457 -0.105 0 C-N-CA 123.176 0.59 . . . . 0.0 110.388 174.395 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 70.63 -12.31 2.04 Favored Glycine 0 CA--C 1.531 1.051 0 C-N-CA 124.698 1.142 . . . . 0.0 113.582 177.763 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 74.4 mt -106.22 148.91 10.1 Favored 'Isoleucine or valine' 0 C--N 1.334 -0.092 0 CA-C-N 118.073 0.936 . . . . 0.0 110.858 -179.47 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 31.2 t -166.91 100.48 0.55 Allowed 'General case' 0 CA--C 1.519 -0.24 0 N-CA-C 108.755 -0.831 . . . . 0.0 108.755 174.979 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -50.38 -41.44 40.44 Favored Glycine 0 CA--C 1.523 0.586 0 CA-C-O 119.375 -0.681 . . . . 0.0 111.431 -176.85 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . 0.598 ' HB3' ' HA ' ' B' 2052 ' ' ASP . 29.5 t -62.89 -52.17 64.13 Favored 'General case' 0 N--CA 1.454 -0.268 0 CA-C-N 118.484 1.142 . . . . 0.0 110.895 -178.084 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 72.3 mtt180 -70.8 -35.65 72.62 Favored 'General case' 0 CA--C 1.522 -0.122 0 C-N-CA 122.82 0.448 . . . . 0.0 110.499 -176.719 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 61.3 mt -58.09 -46.73 88.13 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.575 0 N-CA-C 108.114 -1.069 . . . . 0.0 108.114 174.719 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 63.9 mttt -65.6 -28.12 68.9 Favored 'General case' 0 C--N 1.341 0.211 0 CA-C-O 118.692 -0.671 . . . . 0.0 111.858 178.433 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.3 -57.33 10.74 Favored 'General case' 0 C--N 1.342 0.264 0 CA-C-N 118.935 0.789 . . . . 0.0 109.783 179.694 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.546 HD12 ' N ' ' A' ' 33' ' ' THR . 1.6 pp -75.63 -19.09 59.44 Favored 'General case' 0 N--CA 1.453 -0.279 0 C-N-CA 119.427 -0.909 . . . . 0.0 111.911 -177.356 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . 0.546 ' N ' HD12 ' A' ' 32' ' ' LEU . 52.2 m -72.46 -36.44 68.5 Favored 'General case' 0 N--CA 1.454 -0.24 0 N-CA-C 108.455 -0.942 . . . . 0.0 108.455 176.925 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 96.0 m -72.5 -36.41 68.38 Favored 'General case' 0 N--CA 1.451 -0.387 0 CA-C-N 116.613 -0.267 . . . . 0.0 110.432 -179.942 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 12.2 t80 -61.21 -40.2 93.08 Favored 'General case' 0 N--CA 1.456 -0.16 0 N-CA-C 109.608 -0.516 . . . . 0.0 109.608 174.779 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -70.1 -34.67 73.41 Favored 'General case' 0 N--CA 1.448 -0.555 0 CA-C-N 116.072 -0.513 . . . . 0.0 111.135 -179.475 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 22.1 mt -71.1 -39.97 71.8 Favored 'General case' 0 N--CA 1.453 -0.313 0 C-N-CA 122.315 0.246 . . . . 0.0 111.22 179.776 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 44.4 t0 -64.69 -24.46 67.58 Favored 'General case' 0 N--CA 1.453 -0.285 0 C-N-CA 122.447 0.299 . . . . 0.0 110.784 176.864 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 39' ' ' HIS . . . . . 0.433 ' HB2' HD11 ' A' ' 42' ' ' ILE . 97.9 m-70 -149.82 102.06 3.11 Favored 'General case' 0 N--CA 1.454 -0.267 0 C-N-CA 122.499 0.319 . . . . 0.0 111.716 -176.082 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 40' ' ' ILE . . . . . 0.546 ' H ' HD13 ' A' ' 40' ' ' ILE . 0.0 OUTLIER -81.0 -15.49 12.58 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.279 0 C-N-CA 123.038 0.535 . . . . 0.0 110.872 177.009 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 2.9 m-20 -58.9 -20.12 48.55 Favored 'General case' 0 N--CA 1.454 -0.263 0 N-CA-C 112.546 0.572 . . . . 0.0 112.546 -177.128 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . 0.433 HD11 ' HB2' ' A' ' 39' ' ' HIS . 0.0 OUTLIER -104.35 17.65 5.14 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.258 0 C-N-CA 123.277 0.631 . . . . 0.0 111.792 176.497 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 3.0 pp20? -54.57 -27.99 42.72 Favored 'General case' 0 CA--C 1.529 0.16 0 O-C-N 121.75 -0.594 . . . . 0.0 111.281 178.299 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 32.8 t -63.93 -48.32 77.01 Favored 'General case' 0 N--CA 1.454 -0.234 0 N-CA-C 111.788 0.292 . . . . 0.0 111.788 -178.708 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . 0.471 ' HD3' ' CD1' ' A' ' 7' ' ' PHE . 18.2 ptpt -73.77 -23.18 59.68 Favored 'General case' 0 C--N 1.339 0.152 0 CA-C-N 118.541 0.609 . . . . 0.0 110.121 179.765 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 59.2 mt -72.85 -52.51 22.31 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.343 0 C-N-CA 122.698 0.399 . . . . 0.0 110.603 -178.999 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 39.2 mm -66.52 -36.39 77.19 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.245 0 N-CA-C 109.745 -0.465 . . . . 0.0 109.745 179.546 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 31.9 m -68.66 -40.35 80.21 Favored 'General case' 0 N--CA 1.454 -0.225 0 C-N-CA 121.114 -0.234 . . . . 0.0 111.162 -178.797 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 37.2 tp -75.97 -31.65 59.12 Favored 'General case' 0 N--CA 1.45 -0.463 0 N-CA-C 112.743 0.646 . . . . 0.0 112.743 -175.971 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . 0.505 HD12 HG12 ' A' ' 69' ' ' ILE . 3.3 pt -71.49 -43.87 71.69 Favored 'Isoleucine or valine' 0 C--N 1.34 0.163 0 CA-C-N 118.923 0.783 . . . . 0.0 110.596 177.165 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 25.1 pt -66.09 -38.14 81.34 Favored 'Isoleucine or valine' 0 C--N 1.339 0.136 0 C-N-CA 119.469 -0.892 . . . . 0.0 110.598 176.941 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 94.9 m-20 -68.87 -31.35 70.23 Favored 'General case' 0 N--CA 1.454 -0.232 0 CA-C-N 118.248 0.476 . . . . 0.0 111.34 177.471 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 7.8 t80 -60.0 -48.76 80.39 Favored 'General case' 0 N--CA 1.451 -0.376 0 N-CA-C 107.684 -1.228 . . . . 0.0 107.684 173.832 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 46.3 t -67.24 -27.76 67.49 Favored 'General case' 0 C--N 1.34 0.174 0 CA-C-N 117.82 0.282 . . . . 0.0 111.73 -179.404 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 55.2 ttp85 -75.16 -29.67 60.53 Favored 'General case' 0 N--CA 1.453 -0.309 0 N-CA-C 112.161 0.43 . . . . 0.0 112.161 -177.222 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 36.3 mt -99.37 -43.07 6.71 Favored 'General case' 0 N--CA 1.457 -0.101 0 N-CA-C 112.378 0.51 . . . . 0.0 112.378 -179.078 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 57' ' ' CYS . . . . . 0.478 ' HB2' ' HD2' ' A' ' 58' ' ' PRO . 9.0 p -67.75 161.36 67.11 Favored Pre-proline 0 CA--C 1.534 0.351 0 N-CA-C 113.226 0.824 . . . . 0.0 113.226 -173.084 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 58' ' ' PRO . . . . . 0.478 ' HD2' ' HB2' ' A' ' 57' ' ' CYS . 66.6 Cg_endo -78.5 178.47 7.53 Favored 'Trans proline' 0 N--CA 1.453 -0.871 0 C-N-CA 124.859 3.706 . . . . 0.0 111.743 178.119 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -44.49 -55.53 5.01 Favored 'General case' 0 CA--C 1.531 0.229 0 C-N-CA 126.016 1.726 . . . . 0.0 114.557 -171.182 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 47.8 m -68.93 -30.18 68.59 Favored 'General case' 0 N--CA 1.455 -0.213 0 O-C-N 122.126 -0.359 . . . . 0.0 110.827 -173.441 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 67.6 m170 -75.69 -28.5 58.68 Favored 'General case' 0 N--CA 1.451 -0.42 0 CA-C-O 119.554 -0.26 . . . . 0.0 110.412 176.795 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 61.3 mttm -65.57 -34.29 77.91 Favored 'General case' 0 C--N 1.34 0.177 0 N-CA-C 108.975 -0.75 . . . . 0.0 108.975 173.205 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . 0.515 HD11 ' HE3' ' A' ' 123' ' ' LYS . 0.2 OUTLIER -62.97 -47.54 82.73 Favored 'General case' 0 C--N 1.34 0.173 0 N-CA-C 109.088 -0.708 . . . . 0.0 109.088 175.609 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -66.42 -34.43 87.8 Favored Glycine 0 CA--C 1.524 0.6 0 CA-C-O 119.752 -0.471 . . . . 0.0 111.946 -178.287 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 27.3 t -61.3 -45.13 95.75 Favored 'General case' 0 N--CA 1.453 -0.31 0 CA-C-N 117.582 0.691 . . . . 0.0 109.543 177.452 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 80.8 mt -66.96 -27.17 67.24 Favored 'General case' 0 N--CA 1.455 -0.201 0 O-C-N 123.04 0.213 . . . . 0.0 110.517 179.363 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -71.5 -37.58 71.24 Favored 'General case' 0 C--O 1.234 0.249 0 CA-C-O 120.638 0.256 . . . . 0.0 110.964 178.198 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 68' ' ' ILE . . . . . 0.48 HD11 ' CD1' ' A' ' 17' ' ' PHE . 10.1 mt -71.5 -50.08 42.48 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.403 0 N-CA-C 109.286 -0.635 . . . . 0.0 109.286 174.498 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 69' ' ' ILE . . . . . 0.505 HG12 HD12 ' A' ' 50' ' ' ILE . 52.4 mt -48.8 -41.29 12.64 Favored 'Isoleucine or valine' 0 C--O 1.227 -0.113 0 C-N-CA 123.635 0.774 . . . . 0.0 110.78 174.977 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 10.0 t70 -67.07 -44.89 78.95 Favored 'General case' 0 N--CA 1.455 -0.218 0 CA-C-O 120.698 0.285 . . . . 0.0 110.684 179.044 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 19.6 m -69.21 -49.84 52.8 Favored 'General case' 0 N--CA 1.449 -0.483 0 CA-C-N 116.374 -0.375 . . . . 0.0 111.388 -173.762 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -75.53 -31.06 22.78 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.269 0 N-CA-C 109.678 -0.49 . . . . 0.0 109.678 -179.863 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -66.0 -49.61 57.32 Favored Glycine 0 CA--C 1.526 0.737 0 N-CA-C 111.143 -0.783 . . . . 0.0 111.143 -177.14 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 37.9 mtm105 -66.83 -43.86 82.64 Favored 'General case' 0 N--CA 1.453 -0.309 0 N-CA-C 109.585 -0.524 . . . . 0.0 109.585 177.413 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -61.77 -33.35 73.93 Favored 'General case' 0 N--CA 1.45 -0.443 0 CA-C-O 119.513 -0.28 . . . . 0.0 111.112 -176.902 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 1.5 m-30 -70.93 -46.66 62.08 Favored 'General case' 0 N--CA 1.453 -0.302 0 CA-C-N 118.162 0.437 . . . . 0.0 111.114 177.966 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -68.56 -38.49 80.79 Favored 'General case' 0 N--CA 1.45 -0.434 0 C-N-CA 117.584 -1.647 . . . . 0.0 108.057 -178.807 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 78' ' ' ASP . . . . . 0.428 ' HA ' ' HE ' ' A' ' 81' ' ' ARG . 93.8 m-20 -59.71 -48.31 82.17 Favored 'General case' 0 C--N 1.34 0.159 0 N-CA-C 112.147 0.425 . . . . 0.0 112.147 178.161 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 13.0 tm-20 -65.06 -46.74 79.95 Favored 'General case' 0 N--CA 1.446 -0.649 0 CA-C-N 117.91 0.323 . . . . 0.0 111.043 -177.425 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 80' ' ' THR . . . . . 0.503 HG21 ' HB3' ' A' ' 94' ' ' CYS . 70.5 p -68.65 -33.17 73.54 Favored 'General case' 0 N--CA 1.454 -0.241 0 CA-C-O 119.167 -0.444 . . . . 0.0 111.933 -178.257 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 81' ' ' ARG . . . . . 0.428 ' HE ' ' HA ' ' A' ' 78' ' ' ASP . 21.7 ptt180 -78.93 -23.91 44.38 Favored 'General case' 0 C--N 1.34 0.155 0 CA-C-N 118.771 0.714 . . . . 0.0 111.899 176.88 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 31.2 t -79.47 -35.3 40.52 Favored 'General case' 0 N--CA 1.454 -0.234 0 C-N-CA 123.061 0.545 . . . . 0.0 112.209 179.191 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 25.2 m-20 -125.91 137.3 53.71 Favored 'General case' 0 N--CA 1.452 -0.33 0 N-CA-C 112.092 0.404 . . . . 0.0 112.092 -169.996 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 47.1 t -79.5 48.76 0.94 Allowed 'General case' 0 CA--C 1.532 0.255 0 C-N-CA 124.146 0.978 . . . . 0.0 111.572 -178.442 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 57.3 m-20 -63.64 153.85 34.75 Favored 'General case' 0 N--CA 1.455 -0.199 0 CA-C-O 120.798 0.332 . . . . 0.0 111.114 -178.818 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 43.0 t -69.21 141.46 54.47 Favored 'General case' 0 N--CA 1.454 -0.272 0 CA-C-O 120.856 0.36 . . . . 0.0 110.071 178.841 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 78.9 p -76.52 95.54 3.91 Favored 'General case' 0 N--CA 1.453 -0.314 0 N-CA-C 109.916 -0.401 . . . . 0.0 109.916 -179.532 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 41.2 t -73.48 74.74 1.43 Allowed 'General case' 0 N--CA 1.454 -0.242 0 N-CA-C 109.02 -0.733 . . . . 0.0 109.02 175.008 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 11.5 m-80 61.15 177.2 0.11 Allowed 'General case' 0 CA--C 1.533 0.303 0 C-N-CA 124.266 1.026 . . . . 0.0 111.212 -175.913 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 60.0 tttm -67.91 -58.3 8.2 Favored Pre-proline 0 C--N 1.341 0.228 0 N-CA-C 108.706 -0.85 . . . . 0.0 108.706 174.828 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 63.7 Cg_endo -67.91 129.09 18.92 Favored 'Trans proline' 0 N--CA 1.451 -0.996 0 N-CA-C 107.51 -1.765 . . . . 0.0 107.51 169.594 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 114.64 16.82 7.31 Favored Glycine 0 CA--C 1.525 0.696 0 CA-C-O 119.468 -0.629 . . . . 0.0 112.457 -172.978 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 26.9 p -151.59 170.58 19.33 Favored 'General case' 0 N--CA 1.456 -0.17 0 C-N-CA 123.825 0.85 . . . . 0.0 110.34 177.35 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 94' ' ' CYS . . . . . 0.503 ' HB3' HG21 ' A' ' 80' ' ' THR . 23.0 p -58.93 -23.86 61.83 Favored 'General case' 0 N--CA 1.451 -0.407 0 CA-C-N 115.891 -0.595 . . . . 0.0 109.469 175.582 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -60.13 -57.68 11.77 Favored 'General case' 0 N--CA 1.447 -0.606 0 N-CA-C 109.293 -0.632 . . . . 0.0 109.293 -177.178 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 52.4 t60 -75.55 -27.02 58.49 Favored 'General case' 0 N--CA 1.451 -0.419 0 C-N-CA 121.069 -0.252 . . . . 0.0 111.565 -179.893 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -69.51 -48.3 61.0 Favored 'General case' 0 N--CA 1.453 -0.307 0 CA-C-N 117.801 0.273 . . . . 0.0 110.693 -178.652 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 98' ' ' ILE . . . . . 0.43 HD13 ' HB2' ' A' ' 94' ' ' CYS . 2.0 mp -70.57 -30.94 44.62 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.226 0 N-CA-C 109.882 -0.414 . . . . 0.0 109.882 177.815 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 4.6 m120 -63.63 -49.79 71.91 Favored 'General case' 0 N--CA 1.454 -0.266 0 CA-C-N 118.337 0.517 . . . . 0.0 110.89 175.216 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 49.7 m -70.42 -24.47 62.92 Favored 'General case' 0 N--CA 1.457 -0.11 0 O-C-N 123.131 0.269 . . . . 0.0 111.085 -175.289 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 57.2 tp -83.28 -50.24 8.6 Favored 'General case' 0 N--CA 1.45 -0.467 0 C-N-CA 122.436 0.294 . . . . 0.0 110.696 179.685 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -69.53 -18.02 73.28 Favored Glycine 0 C--N 1.338 0.658 0 CA-C-O 119.507 -0.607 . . . . 0.0 112.786 -174.237 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 26.6 pt-20 -81.8 -7.44 59.6 Favored 'General case' 0 CA--C 1.533 0.29 0 CA-C-N 118.264 1.032 . . . . 0.0 112.373 -178.832 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 17.5 m -140.61 0.02 0.51 Allowed 'Isoleucine or valine' 0 N--CA 1.463 0.213 0 N-CA-C 113.315 0.858 . . . . 0.0 113.315 176.9 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 105' ' ' ILE . . . . . . . . . . . . . 9.3 tp -60.3 -28.22 41.39 Favored 'Isoleucine or valine' 0 CA--C 1.527 0.074 0 CA-C-N 119.197 0.908 . . . . 0.0 111.953 -174.521 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 10.6 pt20 -67.15 -26.89 66.89 Favored 'General case' 0 N--CA 1.453 -0.291 0 CA-C-N 118.002 0.365 . . . . 0.0 110.319 179.261 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 59.8 mm-40 -75.51 -42.02 53.76 Favored 'General case' 0 N--CA 1.456 -0.168 0 N-CA-C 110.117 -0.327 . . . . 0.0 110.117 179.897 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -72.53 -35.26 68.03 Favored 'General case' 0 N--CA 1.454 -0.265 0 N-CA-C 109.637 -0.505 . . . . 0.0 109.637 179.708 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 68.2 mt -67.01 -53.26 32.97 Favored 'General case' 0 N--CA 1.454 -0.273 0 N-CA-C 109.974 -0.38 . . . . 0.0 109.974 176.137 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 35.9 t -53.32 -42.64 66.9 Favored 'General case' 0 C--O 1.232 0.138 0 C-N-CA 122.533 0.333 . . . . 0.0 111.86 -177.247 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 47.4 t0 -66.0 -43.11 88.68 Favored 'General case' 0 N--CA 1.451 -0.378 0 N-CA-C 109.439 -0.578 . . . . 0.0 109.439 177.113 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -67.27 -35.52 79.66 Favored 'General case' 0 N--CA 1.449 -0.504 0 CA-C-O 119.557 -0.258 . . . . 0.0 111.164 -176.387 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 113' ' ' ILE . . . . . . . . . . . . . 22.0 mm -68.55 -37.29 77.49 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.326 0 CA-C-N 118.682 0.673 . . . . 0.0 109.242 178.455 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -73.64 -38.58 64.95 Favored 'General case' 0 N--CA 1.45 -0.443 0 N-CA-C 112.094 0.405 . . . . 0.0 112.094 178.553 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 115' ' ' LYS . . . . . 0.401 ' N ' ' HZ2' ' A' ' 115' ' ' LYS . 0.0 OUTLIER -81.23 -38.68 26.55 Favored 'General case' 0 C--N 1.339 0.115 0 N-CA-C 113.075 0.769 . . . . 0.0 113.075 -175.754 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 116' ' ' SER . . . . . 0.499 ' HB2' ' CB ' ' A' ' 120' ' ' HIS . 52.5 p -81.49 158.41 24.52 Favored 'General case' 0 N--CA 1.454 -0.27 0 N-CA-C 113.314 0.857 . . . . 0.0 113.314 -169.473 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 38.9 t30 -78.92 167.92 20.44 Favored 'General case' 0 CA--C 1.531 0.224 0 C-N-CA 123.241 0.617 . . . . 0.0 110.481 -178.851 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 118' ' ' GLN . . . . . . . . . . . . . 27.8 mt-30 -56.33 -36.08 68.33 Favored 'General case' 0 CA--C 1.529 0.171 0 N-CA-C 113.054 0.761 . . . . 0.0 113.054 -171.608 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 13.3 p-10 -69.35 -37.65 77.75 Favored 'General case' 0 N--CA 1.456 -0.133 0 CA-C-O 121.176 0.512 . . . . 0.0 109.849 178.528 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 120' ' ' HIS . . . . . 0.499 ' CB ' ' HB2' ' A' ' 116' ' ' SER . 32.7 m170 -67.22 -41.14 86.22 Favored 'General case' 0 N--CA 1.45 -0.454 0 CA-C-N 115.843 -0.617 . . . . 0.0 110.112 176.63 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 50.4 mttm -58.46 -40.33 82.36 Favored 'General case' 0 C--N 1.342 0.263 0 N-CA-C 109.001 -0.741 . . . . 0.0 109.001 178.226 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 45.9 tp10 -69.91 -38.21 76.19 Favored 'General case' 0 N--CA 1.453 -0.292 0 C-N-CA 122.166 0.186 . . . . 0.0 111.202 -176.8 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 123' ' ' LYS . . . . . 0.515 ' HE3' HD11 ' A' ' 63' ' ' LEU . 50.3 mtmt -69.0 -28.21 66.39 Favored 'General case' 0 N--CA 1.453 -0.301 0 O-C-N 121.803 -0.561 . . . . 0.0 110.182 177.801 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 124' ' ' ILE . . . . . . . . . . . . . 61.5 mt -73.39 -37.68 51.65 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.297 0 N-CA-C 109.041 -0.725 . . . . 0.0 109.041 174.318 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 125' ' ' ARG . . . . . 0.462 HH11 ' HA ' ' A' ' 125' ' ' ARG . 5.7 mmm180 -60.53 -46.57 89.65 Favored 'General case' 0 N--CA 1.452 -0.331 0 CA-C-O 118.95 -0.547 . . . . 0.0 110.866 178.174 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 126' ' ' MET . . . . . . . . . . . . . 28.3 ptm -62.83 -35.75 80.95 Favored 'General case' 0 N--CA 1.452 -0.339 0 C-N-CA 118.593 -1.243 . . . . 0.0 108.736 178.12 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 2.8 mp -61.48 -35.64 78.22 Favored 'General case' 0 CA--C 1.534 0.335 0 CA-C-N 118.927 0.785 . . . . 0.0 112.033 178.59 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 128' ' ' LEU . . . . . 0.515 HD12 ' H ' ' A' ' 140' ' ' SER . 3.7 mm? -70.9 -41.76 70.83 Favored 'General case' 0 CA--C 1.527 0.092 0 CA-C-N 118.858 0.754 . . . . 0.0 109.718 178.46 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 19.4 m-20 -68.05 -30.64 69.9 Favored 'General case' 0 N--CA 1.453 -0.286 0 N-CA-C 109.704 -0.48 . . . . 0.0 109.704 179.119 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 130' ' ' ILE . . . . . 0.568 ' HA ' ' HD3' ' A' ' 133' ' ' ARG . 42.2 mt -64.24 -39.79 86.76 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.302 0 C-N-CA 122.745 0.418 . . . . 0.0 109.893 174.942 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 131' ' ' TRP . . . . . . . . . . . . . 47.4 m0 -69.8 -25.34 63.73 Favored 'General case' 0 N--CA 1.45 -0.455 0 C-N-CA 119.783 -0.767 . . . . 0.0 111.744 177.669 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 39.8 t0 -73.1 -45.78 55.13 Favored 'General case' 0 N--CA 1.454 -0.253 0 N-CA-C 110.129 -0.323 . . . . 0.0 110.129 174.855 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 133' ' ' ARG . . . . . 0.568 ' HD3' ' HA ' ' A' ' 130' ' ' ILE . 23.6 mtp85 -66.38 -38.01 86.56 Favored 'General case' 0 CA--C 1.522 -0.132 0 C-N-CA 123.353 0.661 . . . . 0.0 110.785 -178.772 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 33.6 t -75.48 -8.33 56.45 Favored 'General case' 0 N--CA 1.454 -0.246 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.697 -178.562 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 135' ' ' GLY . . . . . . . . . . . . . . . 79.02 14.54 81.84 Favored Glycine 0 CA--C 1.527 0.809 0 CA-C-O 119.549 -0.584 . . . . 0.0 113.525 175.489 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 136' ' ' LEU . . . . . . . . . . . . . 11.2 mp -71.76 -26.66 62.53 Favored 'General case' 0 CA--C 1.527 0.086 0 CA-C-N 118.493 1.147 . . . . 0.0 109.755 176.781 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 137' ' ' PHE . . . . . . . . . . . . . 20.8 m-85 54.94 12.26 0.58 Allowed 'General case' 0 CA--C 1.532 0.262 0 C-N-CA 124.815 1.246 . . . . 0.0 113.561 -179.59 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 138' ' ' GLN . . . . . . . . . . . . . 85.7 mm-40 -77.87 10.6 2.68 Favored 'General case' 0 CA--C 1.53 0.194 0 C-N-CA 122.693 0.397 . . . . 0.0 110.303 174.988 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 139' ' ' LYS . . . . . . . . . . . . . 61.2 pttt -65.42 158.65 26.14 Favored 'General case' 0 N--CA 1.452 -0.368 0 C-N-CA 123.889 0.876 . . . . 0.0 110.725 -179.34 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 140' ' ' SER . . . . . 0.515 ' H ' HD12 ' A' ' 128' ' ' LEU . 40.5 t -155.22 143.45 20.23 Favored 'General case' 0 N--CA 1.45 -0.465 0 N-CA-C 109.539 -0.541 . . . . 0.0 109.539 176.869 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 141' ' ' TYR . . . . . . . . . . . . . 70.3 m-85 -140.39 19.49 2.39 Favored 'General case' 0 N--CA 1.454 -0.272 0 C-N-CA 123.344 0.658 . . . . 0.0 110.229 -179.726 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 142' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -67.71 163.79 20.77 Favored 'General case' 0 N--CA 1.454 -0.226 0 C-N-CA 123.231 0.612 . . . . 0.0 109.41 178.335 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 17.9 p30 -63.21 -14.25 46.94 Favored 'General case' 0 N--CA 1.453 -0.276 0 N-CA-C 112.293 0.479 . . . . 0.0 112.293 -175.784 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . -67.85 -46.24 72.33 Favored 'General case' 0 N--CA 1.452 -0.344 0 N-CA-C 109.268 -0.641 . . . . 0.0 109.268 175.295 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 145' ' ' ILE . . . . . . . . . . . . . 39.8 mm -63.75 -35.93 74.78 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.212 0 C-N-CA 122.725 0.41 . . . . 0.0 110.291 177.182 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 146' ' ' ARG . . . . . . . . . . . . . 64.4 mtt180 -71.77 -23.33 61.57 Favored 'General case' 0 C--N 1.338 0.083 0 C-N-CA 122.272 0.229 . . . . 0.0 111.103 -178.162 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 147' ' ' SER . . . . . . . . . . . . . 84.3 p 46.82 51.33 12.62 Favored 'General case' 0 N--CA 1.457 -0.119 0 C-N-CA 123.766 0.826 . . . . 0.0 110.096 175.573 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 148' ' ' LYS . . . . . 0.626 ' HD3' ' H ' ' A' ' 148' ' ' LYS . 0.0 OUTLIER -46.88 -32.94 4.11 Favored 'General case' 0 CA--C 1.529 0.145 0 C-N-CA 124.88 1.272 . . . . 0.0 113.707 -172.62 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 149' ' ' CYS . . . . . . . . . . . . . 52.5 t -68.44 -57.15 6.29 Favored 'General case' 0 N--CA 1.453 -0.286 0 CA-C-N 119.062 0.846 . . . . 0.0 109.469 179.953 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 150' ' ' PHE . . . . . . . . . . . . . 45.0 m-85 -69.28 -15.62 63.39 Favored 'General case' 0 N--CA 1.453 -0.322 0 CA-C-N 116.634 -0.257 . . . . 0.0 111.304 -177.673 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 151' ' ' ALA . . . . . . . . . . . . . . . -74.85 -39.02 61.82 Favored 'General case' 0 N--CA 1.45 -0.444 0 N-CA-C 109.939 -0.393 . . . . 0.0 109.939 173.994 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 152' ' ' MET . . . . . . . . . . . . . 93.6 mtp -77.84 -21.79 50.92 Favored 'General case' 0 CA--C 1.528 0.123 0 C-N-CA 122.256 0.223 . . . . 0.0 111.585 177.11 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 153' ' ' ASP . . . . . . . . . . . . . 70.3 m-20 -72.47 -14.14 61.6 Favored 'General case' 0 CA--C 1.529 0.153 0 C-N-CA 122.628 0.371 . . . . 0.0 111.851 177.892 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 154' ' ' LEU . . . . . . . . . . . . . 88.9 mt -98.09 144.72 27.28 Favored 'General case' 0 N--CA 1.453 -0.292 0 C-N-CA 122.896 0.478 . . . . 0.0 110.016 177.335 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 155' ' ' GLU . . . . . . . . . . . . . 60.6 mt-10 -81.61 160.45 23.79 Favored 'General case' 0 N--CA 1.454 -0.266 0 CA-C-O 121.067 0.46 . . . . 0.0 111.079 179.741 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 156' ' ' HIS . . . . . . . . . . . . . 42.6 p-80 -78.39 39.27 0.32 Allowed 'General case' 0 CA--C 1.533 0.289 0 C-N-CA 124.417 1.087 . . . . 0.0 112.094 -177.594 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 157' ' ' HIS . . . . . . . . . . . . . 45.9 m170 -64.69 157.96 25.92 Favored 'General case' 0 CA--C 1.53 0.18 0 CA-C-O 120.938 0.399 . . . . 0.0 110.958 -179.754 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 158' ' ' HIS . . . . . . . . . . . . . 38.3 m80 -86.98 14.53 7.22 Favored 'General case' 0 CA--C 1.528 0.119 0 C-N-CA 123.337 0.655 . . . . 0.0 112.286 -179.97 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 159' ' ' HIS . . . . . . . . . . . . . 44.2 m80 . . . . . 0 C--O 1.251 1.137 0 CA-C-O 116.918 -1.515 . . . . 0.0 110.79 -175.83 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' B' B 2052 ' ' ASP . . . . . 0.598 ' HA ' ' HB3' ' A' ' 27' ' ' SER . 15.1 m-20 . . . . . 0 N--CA 1.476 0.84 0 N-CA-C 111.881 0.326 . . . . 0.0 111.881 . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B 2053 ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -69.71 18.16 0.05 OUTLIER 'General case' 0 CA--C 1.533 0.304 0 C-N-CA 124.306 1.042 . . . . 0.0 111.863 178.709 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B 2054 ' ' ASP . . . . . 0.488 ' H ' ' C ' ' B' 2052 ' ' ASP . 19.7 p30 -129.42 -0.74 5.02 Favored 'General case' 0 N--CA 1.451 -0.379 0 C-N-CA 125.314 1.446 . . . . 0.0 110.691 -179.079 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B 2055 ' ' GLU . . . . . . . . . . . . . 36.8 mt-10 -104.96 21.71 16.56 Favored 'General case' 0 CA--C 1.529 0.136 0 C-N-CA 122.679 0.392 . . . . 0.0 110.944 177.576 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B 2056 ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -59.94 152.36 23.79 Favored 'General case' 0 N--CA 1.456 -0.132 0 N-CA-C 109.625 -0.509 . . . . 0.0 109.625 177.178 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B 2057 ' ' ASP . . . . . . . . . . . . . 59.0 m-20 49.51 41.28 20.9 Favored 'General case' 0 CA--C 1.53 0.192 0 C-N-CA 122.635 0.374 . . . . 0.0 111.156 -172.715 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B 2058 ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -51.9 144.11 12.19 Favored 'General case' 0 CA--C 1.53 0.21 0 CA-C-N 117.581 0.173 . . . . 0.0 110.977 -176.639 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B 2059 ' ' THR . . . . . . . . . . . . . 64.8 p -81.93 122.27 79.82 Favored Pre-proline 0 CA--C 1.529 0.163 0 C-N-CA 122.14 0.176 . . . . 0.0 110.785 -178.312 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B 2060 ' ' PRO . . . . . . . . . . . . . 81.4 Cg_endo -71.2 -4.84 15.73 Favored 'Trans proline' 0 N--CA 1.455 -0.749 0 C-N-CA 124.08 3.187 . . . . 0.0 111.579 -178.971 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B 2061 ' ' SER . . . . . . . . . . . . . 19.3 m 60.64 -4.23 0.13 Allowed 'General case' 0 CA--C 1.53 0.19 0 C-N-CA 125.579 1.552 . . . . 0.0 114.525 177.168 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B 2062 ' ' ILE . . . . . 0.426 HG21 HG12 ' A' ' 130' ' ' ILE . 8.6 tt -82.02 -15.88 12.02 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.176 0 CA-C-N 118.568 0.622 . . . . 0.0 109.851 173.883 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B 2063 ' ' SER . . . . . . . . . . . . . 44.5 t . . . . . 0 C--O 1.251 1.135 0 CA-C-O 117.157 -1.402 . . . . 0.0 109.573 179.441 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.6 tmt? . . . . . 0 N--CA 1.475 0.789 0 N-CA-C 110.124 -0.324 . . . . 0.0 110.124 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 2.4 pm0 -65.44 -27.66 68.68 Favored 'General case' 0 N--CA 1.451 -0.375 0 N-CA-C 108.852 -0.796 . . . . 0.0 108.852 173.09 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 39.9 tp60 -157.79 141.9 15.98 Favored 'General case' 0 N--CA 1.452 -0.333 0 C-N-CA 124.146 0.978 . . . . 0.0 108.6 170.081 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -165.51 132.91 2.92 Favored 'General case' 0 N--CA 1.446 -0.625 0 N-CA-C 105.522 -2.029 . . . . 0.0 105.522 175.312 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 10.6 m-20 -77.74 7.99 5.06 Favored 'General case' 0 N--CA 1.457 -0.122 0 C-N-CA 120.291 -0.564 . . . . 0.0 112.115 -175.622 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 41.8 t0 -84.32 -19.7 33.29 Favored 'General case' 0 N--CA 1.45 -0.468 0 N-CA-C 107.873 -1.158 . . . . 0.0 107.873 172.302 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 7' ' ' PHE . . . . . 0.557 ' CD1' ' HD3' ' A' ' 45' ' ' LYS . 1.5 t80 -55.35 -35.3 65.08 Favored 'General case' 0 N--CA 1.451 -0.404 0 N-CA-C 108.525 -0.917 . . . . 0.0 108.525 175.996 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 51.8 tp60 -51.7 -34.0 36.79 Favored 'General case' 0 N--CA 1.452 -0.326 0 C-N-CA 124.937 1.295 . . . . 0.0 111.969 -178.778 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 79.9 m-20 -74.6 -36.14 62.98 Favored 'General case' 0 N--CA 1.453 -0.282 0 N-CA-C 109.906 -0.405 . . . . 0.0 109.906 -179.932 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 10' ' ' PHE . . . . . 0.486 ' CZ ' HG12 ' A' ' 46' ' ' ILE . 2.0 t80 -68.32 -36.43 79.28 Favored 'General case' 0 N--CA 1.449 -0.503 0 C-N-CA 123.086 0.554 . . . . 0.0 109.638 174.673 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 96.0 t -69.1 -52.79 30.24 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.234 0 N-CA-C 109.606 -0.516 . . . . 0.0 109.606 178.385 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -58.9 -28.47 66.21 Favored 'General case' 0 N--CA 1.454 -0.232 0 CA-C-N 117.747 0.248 . . . . 0.0 111.478 -179.154 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 86.7 m -72.64 -39.01 67.51 Favored 'General case' 0 N--CA 1.454 -0.242 0 N-CA-C 109.099 -0.704 . . . . 0.0 109.099 175.602 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -64.39 -43.26 95.02 Favored 'General case' 0 N--CA 1.451 -0.422 0 N-CA-C 109.018 -0.734 . . . . 0.0 109.018 177.773 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 67.6 mm-40 -65.42 -26.49 68.0 Favored 'General case' 0 N--CA 1.455 -0.22 0 C-N-CA 123.85 0.86 . . . . 0.0 110.011 178.425 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 68.1 m -70.53 -30.17 66.84 Favored 'General case' 0 N--CA 1.455 -0.183 0 N-CA-C 110.015 -0.365 . . . . 0.0 110.015 176.901 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 17' ' ' PHE . . . . . 0.536 ' CD1' HD11 ' A' ' 68' ' ' ILE . 35.9 m-85 -71.98 -32.8 67.6 Favored 'General case' 0 C--N 1.338 0.088 0 C-N-CA 119.943 -0.703 . . . . 0.0 110.76 172.41 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 72.9 mttt -66.76 -25.36 66.46 Favored 'General case' 0 CA--C 1.531 0.235 0 N-CA-C 110.037 -0.357 . . . . 0.0 110.037 174.541 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 42.6 t0 -76.56 -48.74 18.32 Favored 'General case' 0 CA--C 1.529 0.15 0 N-CA-C 110.306 -0.257 . . . . 0.0 110.306 175.439 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 16.2 mt -56.23 125.26 21.01 Favored 'General case' 0 N--CA 1.457 -0.098 0 CA-C-O 120.714 0.293 . . . . 0.0 110.467 -177.64 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . 0.487 ' H ' ' HE2' ' A' ' 21' ' ' LYS . 1.0 OUTLIER -70.74 -22.57 62.4 Favored 'General case' 0 N--CA 1.456 -0.138 0 N-CA-C 109.819 -0.437 . . . . 0.0 109.819 -179.84 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 61.8 m -90.69 -13.34 34.37 Favored 'General case' 0 N--CA 1.457 -0.09 0 C-N-CA 122.901 0.48 . . . . 0.0 111.059 176.299 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 70.55 -16.83 0.92 Allowed Glycine 0 CA--C 1.529 0.923 0 C-N-CA 124.135 0.874 . . . . 0.0 112.983 -179.677 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 93.6 mt -100.41 147.67 7.53 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.135 0 CA-C-N 117.773 0.786 . . . . 0.0 111.121 -179.961 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 24.3 t -161.12 104.68 1.31 Allowed 'General case' 0 CA--C 1.517 -0.294 0 N-CA-C 108.273 -1.01 . . . . 0.0 108.273 170.808 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -59.93 -28.47 66.12 Favored Glycine 0 CA--C 1.525 0.657 0 C-N-CA 119.914 -1.136 . . . . 0.0 110.829 -176.697 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 86.3 p -72.75 -49.34 31.53 Favored 'General case' 0 N--CA 1.453 -0.303 0 CA-C-N 117.854 0.827 . . . . 0.0 110.683 -179.634 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 40.5 mtt-85 -72.55 -37.35 68.27 Favored 'General case' 0 N--CA 1.453 -0.311 0 CA-C-N 117.577 0.171 . . . . 0.0 110.632 -178.534 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 63.0 mt -60.03 -46.24 94.47 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.668 0 N-CA-C 108.704 -0.85 . . . . 0.0 108.704 175.838 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 28.8 mtmm -64.89 -29.03 69.96 Favored 'General case' 0 C--N 1.338 0.091 0 CA-C-O 119.168 -0.444 . . . . 0.0 111.284 178.747 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . 0.472 ' HA ' ' CE ' ' A' ' 31' ' ' LYS . 3.5 mmpt? -66.2 -59.21 3.97 Favored 'General case' 0 N--CA 1.456 -0.155 0 CA-C-N 118.739 0.699 . . . . 0.0 111.454 -179.15 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.493 HD12 ' N ' ' A' ' 33' ' ' THR . 0.8 OUTLIER -75.33 -16.76 60.38 Favored 'General case' 0 CA--C 1.531 0.212 0 C-N-CA 118.747 -1.181 . . . . 0.0 111.568 -179.249 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . 0.493 ' N ' HD12 ' A' ' 32' ' ' LEU . 40.5 m -71.04 -44.37 65.96 Favored 'General case' 0 N--CA 1.455 -0.194 0 N-CA-C 108.19 -1.041 . . . . 0.0 108.19 174.41 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 95.3 m -65.29 -42.74 92.79 Favored 'General case' 0 N--CA 1.453 -0.316 0 N-CA-C 109.601 -0.518 . . . . 0.0 109.601 -179.731 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 38.4 t80 -61.44 -34.31 75.2 Favored 'General case' 0 N--CA 1.453 -0.323 0 CA-C-O 120.731 0.3 . . . . 0.0 110.268 179.18 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -75.3 -25.51 57.96 Favored 'General case' 0 N--CA 1.45 -0.445 0 CA-C-O 119.378 -0.344 . . . . 0.0 111.767 177.977 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 2.2 mm? -82.93 -33.46 26.8 Favored 'General case' 0 N--CA 1.456 -0.149 0 N-CA-C 108.595 -0.891 . . . . 0.0 108.595 -178.127 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 82.7 m-20 -64.52 -28.42 69.64 Favored 'General case' 0 N--CA 1.444 -0.77 0 C-N-CA 123.595 0.758 . . . . 0.0 110.532 174.677 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 73.3 m80 -151.39 106.99 3.36 Favored 'General case' 0 N--CA 1.453 -0.286 0 C-N-CA 122.826 0.45 . . . . 0.0 111.902 -179.841 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 40' ' ' ILE . . . . . 0.62 ' H ' HD13 ' A' ' 40' ' ' ILE . 0.0 OUTLIER -78.61 -10.8 13.0 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.284 0 N-CA-C 109.593 -0.521 . . . . 0.0 109.593 172.699 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -54.85 -28.28 48.72 Favored 'General case' 0 N--CA 1.453 -0.301 0 C-N-CA 123.798 0.839 . . . . 0.0 111.75 -177.006 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -104.88 16.39 6.1 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.318 0 C-N-CA 123.47 0.708 . . . . 0.0 112.375 -179.94 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 3.1 pp20? -53.89 -31.44 49.93 Favored 'General case' 0 C--O 1.225 -0.235 0 O-C-N 121.51 -0.744 . . . . 0.0 110.375 179.66 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 37.6 t -59.42 -48.04 83.18 Favored 'General case' 0 CA--C 1.532 0.287 0 CA-C-O 119.703 -0.189 . . . . 0.0 111.32 -176.913 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . 0.557 ' HD3' ' CD1' ' A' ' 7' ' ' PHE . 18.7 ptpt -75.4 -25.48 57.62 Favored 'General case' 0 CA--C 1.531 0.23 0 CA-C-N 118.267 0.485 . . . . 0.0 110.49 179.541 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 46' ' ' ILE . . . . . 0.486 HG12 ' CZ ' ' A' ' 10' ' ' PHE . 94.5 mt -71.96 -46.45 59.88 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.254 0 N-CA-C 109.667 -0.494 . . . . 0.0 109.667 -179.339 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 39.6 mm -65.22 -34.0 67.52 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.531 0 N-CA-C 108.965 -0.754 . . . . 0.0 108.965 177.311 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 53.8 m -64.75 -35.1 79.96 Favored 'General case' 0 N--CA 1.453 -0.299 0 CA-C-O 119.649 -0.215 . . . . 0.0 111.117 178.068 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 16.1 mt -73.62 -40.58 63.7 Favored 'General case' 0 N--CA 1.452 -0.328 0 CA-C-O 118.753 -0.642 . . . . 0.0 112.528 179.516 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 9.0 pt -68.44 -40.25 81.94 Favored 'Isoleucine or valine' 0 C--N 1.339 0.124 0 CA-C-N 119.474 1.034 . . . . 0.0 111.051 -177.962 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 16.6 pt -68.99 -39.23 79.48 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.185 0 C-N-CA 120.136 -0.626 . . . . 0.0 110.709 179.333 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 50.7 t0 -64.81 -51.66 60.93 Favored 'General case' 0 N--CA 1.455 -0.194 0 N-CA-C 109.648 -0.501 . . . . 0.0 109.648 177.924 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 25.9 t80 -59.57 -53.29 59.81 Favored 'General case' 0 N--CA 1.45 -0.46 0 N-CA-C 109.543 -0.54 . . . . 0.0 109.543 -179.298 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 18.7 t -61.48 -29.53 70.03 Favored 'General case' 0 N--CA 1.452 -0.337 0 N-CA-C 111.974 0.361 . . . . 0.0 111.974 -174.344 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 5.1 tpm_? -75.5 -60.43 2.31 Favored 'General case' 0 CA--C 1.532 0.283 0 C-N-CA 122.5 0.32 . . . . 0.0 111.326 -179.5 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . 0.443 HD12 ' N ' ' A' ' 56' ' ' LEU . 9.1 mp -75.66 -28.66 58.82 Favored 'General case' 0 C--O 1.231 0.093 0 N-CA-C 114.14 1.163 . . . . 0.0 114.14 -174.966 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 57' ' ' CYS . . . . . 0.424 ' HB2' ' HD2' ' A' ' 58' ' ' PRO . 13.2 p -68.28 156.74 89.47 Favored Pre-proline 0 CA--C 1.536 0.428 0 N-CA-C 112.471 0.545 . . . . 0.0 112.471 -174.713 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 58' ' ' PRO . . . . . 0.424 ' HD2' ' HB2' ' A' ' 57' ' ' CYS . 94.0 Cg_endo -74.05 175.97 10.15 Favored 'Trans proline' 0 N--CA 1.454 -0.832 0 C-N-CA 125.046 3.83 . . . . 0.0 111.593 179.203 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 32.4 p-10 -52.66 -47.2 67.29 Favored 'General case' 0 CA--C 1.529 0.145 0 C-N-CA 124.533 1.133 . . . . 0.0 113.737 -170.847 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 40.2 t -65.23 -37.63 87.87 Favored 'General case' 0 N--CA 1.456 -0.145 0 CA-C-O 121.121 0.486 . . . . 0.0 110.462 -178.758 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 66.1 m170 -75.3 -26.36 58.64 Favored 'General case' 0 N--CA 1.452 -0.375 0 CA-C-N 116.521 -0.309 . . . . 0.0 110.232 179.836 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . 0.415 ' HE2' ' O ' ' A' ' 57' ' ' CYS . 68.7 mttm -65.93 -39.43 90.5 Favored 'General case' 0 C--N 1.342 0.249 0 N-CA-C 109.29 -0.633 . . . . 0.0 109.29 174.334 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -61.15 -48.38 81.86 Favored 'General case' 0 N--CA 1.454 -0.233 0 N-CA-C 108.313 -0.995 . . . . 0.0 108.313 176.541 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -63.99 -31.89 82.36 Favored Glycine 0 CA--C 1.524 0.642 0 N-CA-C 111.668 -0.573 . . . . 0.0 111.668 -179.21 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 37.4 p -65.85 -38.53 89.1 Favored 'General case' 0 N--CA 1.454 -0.271 0 CA-C-N 117.699 0.749 . . . . 0.0 109.887 179.011 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 82.3 mt -72.61 -25.54 61.35 Favored 'General case' 0 N--CA 1.451 -0.396 0 N-CA-C 110.026 -0.361 . . . . 0.0 110.026 178.914 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -72.45 -38.59 68.24 Favored 'General case' 0 N--CA 1.454 -0.268 0 N-CA-C 110.374 -0.232 . . . . 0.0 110.374 176.335 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 68' ' ' ILE . . . . . 0.536 HD11 ' CD1' ' A' ' 17' ' ' PHE . 18.2 mt -69.19 -46.82 77.06 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.237 0 N-CA-C 109.673 -0.491 . . . . 0.0 109.673 176.0 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 70.7 mt -56.55 -32.46 36.91 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.161 0 C-N-CA 123.031 0.532 . . . . 0.0 110.814 176.252 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 6.9 t70 -69.76 -50.08 46.83 Favored 'General case' 0 N--CA 1.452 -0.354 0 CA-C-O 119.383 -0.341 . . . . 0.0 111.132 179.38 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 99.2 p -67.5 -49.89 61.41 Favored 'General case' 0 N--CA 1.455 -0.219 0 C-N-CA 120.505 -0.478 . . . . 0.0 110.663 -175.757 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -74.89 -32.44 27.72 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.182 0 N-CA-C 109.931 -0.396 . . . . 0.0 109.931 -176.508 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -69.75 -58.53 6.27 Favored Glycine 0 C--N 1.336 0.566 0 N-CA-C 111.116 -0.794 . . . . 0.0 111.116 -176.975 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 28.7 mtp-105 -61.51 -40.95 96.46 Favored 'General case' 0 N--CA 1.45 -0.426 0 N-CA-C 109.808 -0.441 . . . . 0.0 109.808 -177.799 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -67.81 -28.23 67.41 Favored 'General case' 0 N--CA 1.451 -0.411 0 C-N-CA 120.771 -0.372 . . . . 0.0 111.331 179.993 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 1.3 m-30 -69.63 -46.23 66.68 Favored 'General case' 0 N--CA 1.455 -0.221 0 CA-C-N 118.648 0.658 . . . . 0.0 111.192 178.529 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 44.2 tp -73.51 -35.83 65.65 Favored 'General case' 0 N--CA 1.449 -0.477 0 C-N-CA 117.471 -1.691 . . . . 0.0 110.219 -179.995 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 89.0 m-20 -62.52 -46.22 89.39 Favored 'General case' 0 C--O 1.231 0.122 0 N-CA-C 112.393 0.516 . . . . 0.0 112.393 178.641 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 15.1 tm-20 -65.35 -47.75 75.39 Favored 'General case' 0 N--CA 1.444 -0.759 0 CA-C-N 118.017 0.371 . . . . 0.0 110.873 -179.026 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 76.7 p -68.23 -25.04 65.0 Favored 'General case' 0 N--CA 1.452 -0.328 0 CA-C-O 119.674 -0.203 . . . . 0.0 111.49 -179.172 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 35.4 ttp-105 -75.51 -34.05 60.79 Favored 'General case' 0 N--CA 1.457 -0.093 0 C-N-CA 122.711 0.404 . . . . 0.0 111.234 172.915 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 34.6 t -87.81 -7.6 57.06 Favored 'General case' 0 N--CA 1.456 -0.157 0 C-N-CA 123.839 0.856 . . . . 0.0 113.249 -177.876 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 40.5 t-20 -138.84 172.66 12.54 Favored 'General case' 0 N--CA 1.454 -0.253 0 C-N-CA 122.712 0.405 . . . . 0.0 110.989 -172.619 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 43.6 t -66.1 161.7 21.22 Favored 'General case' 0 N--CA 1.454 -0.263 0 C-N-CA 123.18 0.592 . . . . 0.0 110.393 179.082 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 5.8 m120 -119.35 163.58 16.98 Favored 'General case' 0 N--CA 1.453 -0.276 0 N-CA-C 109.65 -0.5 . . . . 0.0 109.65 179.9 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 60.0 p -76.36 37.99 0.17 Allowed 'General case' 0 CA--C 1.528 0.119 0 C-N-CA 123.625 0.77 . . . . 0.0 112.312 -176.731 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 21.5 t 55.08 -157.48 0.22 Allowed 'General case' 0 CA--C 1.534 0.362 0 C-N-CA 123.121 0.568 . . . . 0.0 111.024 -177.559 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 80.8 p -64.67 101.35 0.46 Allowed 'General case' 0 N--CA 1.455 -0.186 0 C-N-CA 122.961 0.504 . . . . 0.0 109.794 -179.595 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 29.6 t30 -161.09 170.1 21.11 Favored 'General case' 0 N--CA 1.453 -0.293 0 C-N-CA 123.721 0.808 . . . . 0.0 108.917 -177.349 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 90' ' ' LYS . . . . . 0.427 ' H ' ' HD2' ' A' ' 91' ' ' PRO . 31.9 mmmt -129.09 -67.19 0.02 OUTLIER Pre-proline 0 CA--C 1.532 0.25 0 CA-C-O 118.141 -0.933 . . . . 0.0 111.062 177.848 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 91' ' ' PRO . . . . . 0.427 ' HD2' ' H ' ' A' ' 90' ' ' LYS . 71.6 Cg_endo -69.53 150.22 69.32 Favored 'Trans proline' 0 N--CA 1.455 -0.787 0 C-N-CA 121.949 1.766 . . . . 0.0 110.246 -178.861 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 84.9 19.13 60.02 Favored Glycine 0 CA--C 1.523 0.567 0 CA-C-O 119.483 -0.62 . . . . 0.0 112.344 179.303 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 25.1 p -153.76 172.82 16.71 Favored 'General case' 0 N--CA 1.455 -0.195 0 C-N-CA 123.533 0.733 . . . . 0.0 110.716 178.702 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 94' ' ' CYS . . . . . 0.426 ' HB2' HD13 ' A' ' 98' ' ' ILE . 30.6 p -59.93 -21.73 61.51 Favored 'General case' 0 N--CA 1.449 -0.522 0 CA-C-N 115.467 -0.788 . . . . 0.0 110.234 175.064 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -60.22 -56.8 17.14 Favored 'General case' 0 N--CA 1.447 -0.578 0 N-CA-C 109.722 -0.473 . . . . 0.0 109.722 -176.088 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 73.7 t60 -75.17 -37.12 61.4 Favored 'General case' 0 N--CA 1.45 -0.435 0 O-C-N 122.924 0.14 . . . . 0.0 111.014 179.191 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -62.58 -50.83 69.75 Favored 'General case' 0 N--CA 1.451 -0.379 0 N-CA-C 111.821 0.304 . . . . 0.0 111.821 -177.585 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 98' ' ' ILE . . . . . 0.426 HD13 ' HB2' ' A' ' 94' ' ' CYS . 1.8 mp -73.03 -33.14 41.98 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.165 0 CA-C-N 118.233 0.469 . . . . 0.0 110.068 -179.164 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 2.1 m120 -65.0 -40.65 95.26 Favored 'General case' 0 N--CA 1.452 -0.326 0 CA-C-N 118.547 0.612 . . . . 0.0 111.465 177.129 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 96.7 m -67.2 -42.7 83.71 Favored 'General case' 0 N--CA 1.452 -0.339 0 CA-C-O 120.514 0.197 . . . . 0.0 110.532 -178.011 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 75.7 mt -74.3 -28.49 61.2 Favored 'General case' 0 N--CA 1.45 -0.439 0 C-N-CA 120.805 -0.358 . . . . 0.0 110.871 179.997 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -59.19 -25.11 59.6 Favored Glycine 0 CA--C 1.527 0.803 0 N-CA-C 111.683 -0.567 . . . . 0.0 111.683 -177.868 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 17.4 mm-40 -84.49 -41.74 16.27 Favored 'General case' 0 N--CA 1.454 -0.272 0 CA-C-N 117.965 0.882 . . . . 0.0 112.309 179.588 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 16.5 m -104.5 -4.17 9.63 Favored 'Isoleucine or valine' 0 N--CA 1.461 0.095 0 N-CA-C 114.164 1.172 . . . . 0.0 114.164 -171.501 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 105' ' ' ILE . . . . . 0.414 HD12 ' HA ' ' A' ' 105' ' ' ILE . 11.1 tp -63.69 -33.42 61.63 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.244 0 CA-C-N 119.463 1.029 . . . . 0.0 110.913 -177.421 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 23.8 pt20 -67.15 -30.22 70.15 Favored 'General case' 0 CA--C 1.531 0.237 0 C-N-CA 122.948 0.499 . . . . 0.0 110.03 178.523 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 5.8 mm-40 -74.12 -46.67 41.22 Favored 'General case' 0 N--CA 1.454 -0.245 0 C-N-CA 123.135 0.574 . . . . 0.0 110.425 177.708 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 81.6 mt -68.66 -33.58 74.24 Favored 'General case' 0 N--CA 1.455 -0.217 0 N-CA-C 110.045 -0.354 . . . . 0.0 110.045 -178.77 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 36.4 mt -65.25 -62.13 1.72 Allowed 'General case' 0 N--CA 1.449 -0.49 0 N-CA-C 109.332 -0.618 . . . . 0.0 109.332 175.171 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 25.7 t -58.13 -35.55 71.65 Favored 'General case' 0 C--N 1.338 0.107 0 N-CA-C 112.005 0.372 . . . . 0.0 112.005 -173.463 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 62.1 t0 -61.85 -44.02 97.66 Favored 'General case' 0 N--CA 1.45 -0.47 0 N-CA-C 108.979 -0.748 . . . . 0.0 108.979 176.643 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -71.47 -37.67 71.3 Favored 'General case' 0 N--CA 1.446 -0.646 0 CA-C-N 116.434 -0.348 . . . . 0.0 110.802 -178.861 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 113' ' ' ILE . . . . . 0.474 ' O ' ' HE3' ' A' ' 121' ' ' LYS . 32.9 mm -61.25 -43.59 96.78 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.259 0 N-CA-C 109.356 -0.609 . . . . 0.0 109.356 -179.403 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -74.56 -38.83 62.6 Favored 'General case' 0 N--CA 1.451 -0.422 0 N-CA-C 112.039 0.385 . . . . 0.0 112.039 -176.701 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -77.42 -34.44 54.7 Favored 'General case' 0 C--N 1.338 0.099 0 N-CA-C 112.106 0.41 . . . . 0.0 112.106 -177.585 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 116' ' ' SER . . . . . 0.513 ' HB2' ' CB ' ' A' ' 120' ' ' HIS . 29.3 p -87.72 157.55 19.03 Favored 'General case' 0 N--CA 1.454 -0.257 0 N-CA-C 113.084 0.772 . . . . 0.0 113.084 -169.43 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 53.2 t30 -75.48 167.8 21.22 Favored 'General case' 0 C--O 1.224 -0.268 0 C-N-CA 123.874 0.869 . . . . 0.0 111.052 -178.293 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 118' ' ' GLN . . . . . . . . . . . . . 19.6 mm100 -57.6 -32.51 67.26 Favored 'General case' 0 CA--C 1.527 0.085 0 C-N-CA 123.17 0.588 . . . . 0.0 111.405 -176.062 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 36.6 t0 -65.51 -45.37 83.81 Favored 'General case' 0 N--CA 1.454 -0.24 0 CA-C-O 121.701 0.762 . . . . 0.0 108.967 175.639 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 120' ' ' HIS . . . . . 0.513 ' CB ' ' HB2' ' A' ' 116' ' ' SER . 33.5 m170 -68.14 -37.31 80.92 Favored 'General case' 0 N--CA 1.449 -0.477 0 N-CA-C 109.731 -0.47 . . . . 0.0 109.731 179.852 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 121' ' ' LYS . . . . . 0.474 ' HE3' ' O ' ' A' ' 113' ' ' ILE . 61.6 mttp -60.21 -36.96 78.86 Favored 'General case' 0 CA--C 1.521 -0.17 0 N-CA-C 108.675 -0.861 . . . . 0.0 108.675 176.394 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 28.1 tt0 -65.43 -44.41 87.43 Favored 'General case' 0 N--CA 1.452 -0.359 0 C-N-CA 122.379 0.272 . . . . 0.0 110.791 -178.03 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 14.4 mptt -67.34 -36.4 81.33 Favored 'General case' 0 C--O 1.226 -0.149 0 C-N-CA 120.63 -0.428 . . . . 0.0 110.115 -179.209 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 124' ' ' ILE . . . . . . . . . . . . . 54.4 mt -68.67 -32.88 56.86 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.329 0 N-CA-C 109.07 -0.715 . . . . 0.0 109.07 176.474 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 125' ' ' ARG . . . . . 0.474 ' HD2' ' HA ' ' A' ' 125' ' ' ARG . 17.4 tpt85 -69.64 -35.49 75.26 Favored 'General case' 0 N--CA 1.447 -0.599 0 CA-C-O 119.214 -0.422 . . . . 0.0 111.889 -174.806 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 126' ' ' MET . . . . . . . . . . . . . 26.8 ptm -73.88 -38.69 64.32 Favored 'General case' 0 N--CA 1.453 -0.284 0 N-CA-C 109.19 -0.67 . . . . 0.0 109.19 175.656 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 6.4 mp -61.26 -36.33 79.7 Favored 'General case' 0 CA--C 1.53 0.175 0 N-CA-C 109.434 -0.58 . . . . 0.0 109.434 174.811 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 43.6 tp -65.73 -44.33 86.33 Favored 'General case' 0 N--CA 1.454 -0.273 0 O-C-N 122.108 -0.37 . . . . 0.0 110.941 -179.128 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 89.2 m-20 -68.0 -36.4 79.93 Favored 'General case' 0 N--CA 1.456 -0.158 0 N-CA-C 110.366 -0.235 . . . . 0.0 110.366 176.245 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 54.4 mt -63.13 -38.4 81.96 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.436 0 N-CA-C 109.316 -0.624 . . . . 0.0 109.316 177.733 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 131' ' ' TRP . . . . . . . . . . . . . 41.0 m0 -75.49 -30.77 59.97 Favored 'General case' 0 N--CA 1.454 -0.269 0 CA-C-O 119.481 -0.295 . . . . 0.0 111.481 179.403 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 51.5 t0 -65.12 -36.18 83.47 Favored 'General case' 0 N--CA 1.452 -0.351 0 N-CA-C 109.377 -0.601 . . . . 0.0 109.377 178.393 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 133' ' ' ARG . . . . . 0.472 HH21 ' C ' ' B' 2063 ' ' SER . 9.5 mtp180 -75.26 -34.62 61.4 Favored 'General case' 0 C--N 1.34 0.165 0 C-N-CA 124.028 0.931 . . . . 0.0 110.696 175.525 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 30.1 m -75.44 -25.89 57.86 Favored 'General case' 0 C--N 1.339 0.15 0 N-CA-C 111.702 0.26 . . . . 0.0 111.702 -178.044 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 135' ' ' GLY . . . . . . . . . . . . . . . 78.34 4.58 87.06 Favored Glycine 0 CA--C 1.53 1.029 0 CA-C-O 118.935 -0.925 . . . . 0.0 114.251 176.536 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 136' ' ' LEU . . . . . . . . . . . . . 7.7 mp -68.33 -20.78 64.76 Favored 'General case' 0 C--N 1.337 0.062 0 CA-C-N 119.059 1.429 . . . . 0.0 111.357 179.682 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 137' ' ' PHE . . . . . . . . . . . . . 34.3 m-85 -143.68 179.92 6.84 Favored 'General case' 0 N--CA 1.457 -0.11 0 CA-C-O 121.048 0.452 . . . . 0.0 111.291 -171.714 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 138' ' ' GLN . . . . . . . . . . . . . 28.1 mp0 -62.35 166.85 4.63 Favored 'General case' 0 N--CA 1.452 -0.343 0 C-N-CA 123.706 0.802 . . . . 0.0 111.392 -179.393 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 139' ' ' LYS . . . . . 0.537 ' HA ' ' HE2' ' A' ' 139' ' ' LYS . 10.6 mmpt? -66.25 154.73 39.11 Favored 'General case' 0 N--CA 1.455 -0.175 0 C-N-CA 123.233 0.613 . . . . 0.0 111.125 -177.263 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 140' ' ' SER . . . . . . . . . . . . . 63.9 p -70.38 20.55 0.04 OUTLIER 'General case' 0 CA--C 1.531 0.234 0 C-N-CA 125.135 1.374 . . . . 0.0 113.955 -174.826 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 141' ' ' TYR . . . . . . . . . . . . . 31.8 p90 -146.59 18.76 1.32 Allowed 'General case' 0 N--CA 1.455 -0.19 0 CA-C-N 118.708 0.685 . . . . 0.0 112.275 -177.137 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 142' ' ' LEU . . . . . 0.55 ' HG ' ' H ' ' A' ' 144' ' ' ALA . 61.4 tp -66.67 145.25 55.77 Favored 'General case' 0 N--CA 1.455 -0.22 0 CA-C-N 117.972 0.351 . . . . 0.0 110.465 -179.616 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 76.5 m-20 -63.83 -18.78 64.47 Favored 'General case' 0 N--CA 1.457 -0.098 0 N-CA-C 112.484 0.549 . . . . 0.0 112.484 -177.532 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 144' ' ' ALA . . . . . 0.55 ' H ' ' HG ' ' A' ' 142' ' ' LEU . . . -73.25 -23.16 60.3 Favored 'General case' 0 N--CA 1.45 -0.444 0 N-CA-C 112.184 0.438 . . . . 0.0 112.184 -177.759 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 145' ' ' ILE . . . . . . . . . . . . . 25.7 mm -75.1 -32.4 26.62 Favored 'Isoleucine or valine' 0 CA--C 1.524 -0.038 0 N-CA-C 109.917 -0.401 . . . . 0.0 109.917 -177.78 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 146' ' ' ARG . . . . . . . . . . . . . 14.4 ptt-85 -85.13 -61.44 1.77 Allowed 'General case' 0 N--CA 1.453 -0.279 0 N-CA-C 109.206 -0.665 . . . . 0.0 109.206 172.695 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 147' ' ' SER . . . . . . . . . . . . . 28.8 t 43.07 23.01 0.03 OUTLIER 'General case' 0 CA--C 1.533 0.301 0 C-N-CA 125.661 1.584 . . . . 0.0 114.895 176.078 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 37.5 mtmt 48.38 26.72 1.19 Allowed 'General case' 0 CA--C 1.535 0.401 0 CA-C-N 118.373 0.533 . . . . 0.0 112.063 -175.13 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 149' ' ' CYS . . . . . . . . . . . . . 42.6 t -59.12 -23.91 62.53 Favored 'General case' 0 N--CA 1.454 -0.238 0 O-C-N 122.039 -0.413 . . . . 0.0 111.578 -175.326 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 150' ' ' PHE . . . . . . . . . . . . . 91.4 t80 -67.17 -31.02 71.15 Favored 'General case' 0 N--CA 1.454 -0.258 0 O-C-N 121.867 -0.521 . . . . 0.0 110.304 177.244 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 151' ' ' ALA . . . . . . . . . . . . . . . -78.81 -26.32 44.28 Favored 'General case' 0 N--CA 1.452 -0.349 0 N-CA-C 109.988 -0.375 . . . . 0.0 109.988 175.56 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 152' ' ' MET . . . . . . . . . . . . . 86.6 mtp -75.41 -23.32 57.01 Favored 'General case' 0 CA--C 1.529 0.17 0 CA-C-O 119.61 -0.233 . . . . 0.0 111.591 176.466 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 153' ' ' ASP . . . . . . . . . . . . . 93.2 m-20 -74.81 -14.25 60.67 Favored 'General case' 0 N--CA 1.457 -0.119 0 N-CA-C 112.812 0.671 . . . . 0.0 112.812 179.53 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 154' ' ' LEU . . . . . . . . . . . . . 4.6 pp -119.42 156.25 30.51 Favored 'General case' 0 N--CA 1.451 -0.398 0 CA-C-O 121.224 0.535 . . . . 0.0 111.456 -178.67 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 155' ' ' GLU . . . . . . . . . . . . . 78.7 mm-40 -73.83 165.01 25.88 Favored 'General case' 0 CA--C 1.527 0.086 0 C-N-CA 123.461 0.704 . . . . 0.0 112.849 -174.965 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 156' ' ' HIS . . . . . . . . . . . . . 80.0 m-70 60.82 13.11 4.19 Favored 'General case' 0 CA--C 1.529 0.138 0 N-CA-C 114.641 1.349 . . . . 0.0 114.641 177.63 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 157' ' ' HIS . . . . . . . . . . . . . 96.8 m-70 -146.38 168.0 22.2 Favored 'General case' 0 N--CA 1.456 -0.16 0 C-N-CA 123.123 0.569 . . . . 0.0 110.46 178.541 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 158' ' ' HIS . . . . . . . . . . . . . 48.9 p-80 -157.97 177.18 11.62 Favored 'General case' 0 N--CA 1.453 -0.303 0 C-N-CA 123.505 0.722 . . . . 0.0 109.1 -178.314 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 159' ' ' HIS . . . . . . . . . . . . . 31.9 p-80 . . . . . 0 C--O 1.247 0.942 0 CA-C-O 117.78 -1.105 . . . . 0.0 110.873 179.441 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' B' B 2052 ' ' ASP . . . . . . . . . . . . . 2.9 m-20 . . . . . 0 N--CA 1.471 0.598 0 N-CA-C 110.854 -0.054 . . . . 0.0 110.854 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' B' B 2053 ' ' ASP . . . . . . . . . . . . . 9.1 m-20 -119.48 169.35 10.12 Favored 'General case' 0 N--CA 1.456 -0.155 0 C-N-CA 123.832 0.853 . . . . 0.0 109.852 -177.741 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B 2054 ' ' ASP . . . . . . . . . . . . . 19.8 p-10 -99.14 -20.28 16.73 Favored 'General case' 0 N--CA 1.454 -0.268 0 C-N-CA 122.484 0.314 . . . . 0.0 111.408 178.633 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B 2055 ' ' GLU . . . . . . . . . . . . . 83.4 tt0 -79.45 78.4 5.98 Favored 'General case' 0 N--CA 1.454 -0.246 0 N-CA-C 109.221 -0.659 . . . . 0.0 109.221 175.758 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B 2056 ' ' ASP . . . . . . . . . . . . . 49.2 p-10 -79.82 7.2 9.15 Favored 'General case' 0 CA--C 1.533 0.323 0 N-CA-C 112.942 0.719 . . . . 0.0 112.942 -174.92 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B 2057 ' ' ASP . . . . . . . . . . . . . 41.0 t0 -151.66 161.15 43.15 Favored 'General case' 0 N--CA 1.455 -0.218 0 C-N-CA 122.79 0.436 . . . . 0.0 109.828 178.645 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B 2058 ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -123.45 -5.67 8.21 Favored 'General case' 0 CA--C 1.531 0.237 0 N-CA-C 109.27 -0.641 . . . . 0.0 109.27 175.561 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B 2059 ' ' THR . . . . . . . . . . . . . 7.5 m 48.12 74.33 0.83 Allowed Pre-proline 0 C--N 1.341 0.23 0 C-N-CA 126.092 1.757 . . . . 0.0 112.982 171.928 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B 2060 ' ' PRO . . . . . . . . . . . . . 61.3 Cg_endo -67.99 158.08 58.97 Favored 'Trans proline' 0 N--CA 1.454 -0.823 0 C-N-CA 123.206 2.604 . . . . 0.0 110.289 177.34 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B 2061 ' ' SER . . . . . . . . . . . . . 46.5 t -151.34 157.48 42.53 Favored 'General case' 0 C--O 1.233 0.228 0 C-N-CA 123.054 0.542 . . . . 0.0 110.246 -179.349 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B 2062 ' ' ILE . . . . . 0.435 HD13 ' HB2' ' A' ' 133' ' ' ARG . 19.2 tt -167.07 157.56 1.07 Allowed 'Isoleucine or valine' 0 N--CA 1.454 -0.24 0 C-N-CA 123.173 0.589 . . . . 0.0 110.532 -177.757 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B 2063 ' ' SER . . . . . 0.472 ' C ' HH21 ' A' ' 133' ' ' ARG . 82.9 p . . . . . 0 C--O 1.249 1.059 0 CA-C-O 117.156 -1.402 . . . . 0.0 110.325 175.266 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 85.6 mtp . . . . . 0 N--CA 1.472 0.657 0 CA-C-O 119.374 -0.346 . . . . 0.0 111.526 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 80.9 mt-30 -143.74 -3.76 0.88 Allowed 'General case' 0 CA--C 1.531 0.223 0 N-CA-C 112.546 0.573 . . . . 0.0 112.546 -177.816 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 17.8 pt20 -151.66 14.4 0.65 Allowed 'General case' 0 C--O 1.232 0.142 0 N-CA-C 107.928 -1.138 . . . . 0.0 107.928 178.134 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 1.3 p30 -161.58 172.57 16.13 Favored 'General case' 0 N--CA 1.446 -0.668 0 C-N-CA 125.368 1.467 . . . . 0.0 108.951 -167.511 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 4.2 m-20 57.33 18.05 4.1 Favored 'General case' 0 N--CA 1.456 -0.17 0 C-N-CA 124.254 1.022 . . . . 0.0 113.111 -177.518 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 24.9 p-10 -73.85 -34.1 64.37 Favored 'General case' 0 N--CA 1.455 -0.21 0 N-CA-C 109.429 -0.582 . . . . 0.0 109.429 -177.688 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 7' ' ' PHE . . . . . 0.513 ' CD1' ' HD3' ' A' ' 45' ' ' LYS . 1.5 t80 -58.07 -36.48 72.88 Favored 'General case' 0 N--CA 1.446 -0.672 0 C-N-CA 123.173 0.589 . . . . 0.0 111.403 -176.972 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 51.7 tp60 -57.92 -32.17 67.5 Favored 'General case' 0 N--CA 1.453 -0.312 0 C-N-CA 122.689 0.395 . . . . 0.0 111.473 -176.959 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 49.6 t30 -69.44 -33.97 73.74 Favored 'General case' 0 N--CA 1.454 -0.264 0 N-CA-C 109.663 -0.495 . . . . 0.0 109.663 177.826 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 10' ' ' PHE . . . . . 0.506 ' CE2' ' HB2' ' A' ' 32' ' ' LEU . 12.0 t80 -70.33 -40.89 73.87 Favored 'General case' 0 N--CA 1.45 -0.446 0 N-CA-C 109.479 -0.563 . . . . 0.0 109.479 177.427 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 91.3 t -63.0 -55.63 22.4 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.372 0 N-CA-C 108.394 -0.965 . . . . 0.0 108.394 179.544 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -57.79 -29.44 64.87 Favored 'General case' 0 N--CA 1.451 -0.384 0 C-N-CA 122.847 0.459 . . . . 0.0 112.072 179.737 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 95.2 m -72.33 -41.05 66.95 Favored 'General case' 0 CA--C 1.529 0.162 0 CA-C-N 118.864 0.756 . . . . 0.0 109.297 177.208 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.523 ' HA ' ' CD1' ' A' ' 17' ' ' PHE . 10.8 tp -65.84 -42.65 90.22 Favored 'General case' 0 N--CA 1.454 -0.244 0 CA-C-O 121.053 0.454 . . . . 0.0 109.847 178.743 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 77.3 mm-40 -63.65 -32.8 74.39 Favored 'General case' 0 N--CA 1.452 -0.364 0 C-N-CA 123.947 0.899 . . . . 0.0 109.488 177.02 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 70.7 m -69.36 -22.43 63.74 Favored 'General case' 0 N--CA 1.451 -0.421 0 CA-C-O 119.011 -0.518 . . . . 0.0 110.422 177.149 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 17' ' ' PHE . . . . . 0.523 ' CD1' ' HA ' ' A' ' 14' ' ' LEU . 17.0 m-85 -74.49 -38.14 62.95 Favored 'General case' 0 C--N 1.343 0.324 0 CA-C-N 118.572 0.624 . . . . 0.0 110.83 170.303 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . 0.436 ' HG2' ' CE1' ' A' ' 53' ' ' TYR . 61.5 mttt -63.72 -23.51 67.39 Favored 'General case' 0 C--N 1.34 0.194 0 CA-C-O 120.786 0.327 . . . . 0.0 110.443 178.924 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 32.0 t0 -75.74 -9.47 58.62 Favored 'General case' 0 CA--C 1.538 0.488 0 C-N-CA 123.397 0.679 . . . . 0.0 112.711 176.315 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . 0.486 ' CD1' ' HB2' ' A' ' 25' ' ' SER . 66.9 mt -88.87 171.65 9.76 Favored 'General case' 0 N--CA 1.455 -0.188 0 O-C-N 121.556 -0.715 . . . . 0.0 112.865 -176.443 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 2.1 mppt? -77.79 -25.77 49.21 Favored 'General case' 0 N--CA 1.453 -0.295 0 CA-C-N 115.661 -0.7 . . . . 0.0 110.694 178.725 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 9.4 t -147.58 9.51 0.92 Allowed 'General case' 0 CA--C 1.522 -0.105 0 N-CA-C 113.166 0.802 . . . . 0.0 113.166 -175.879 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 70.23 -13.94 1.37 Allowed Glycine 0 CA--C 1.528 0.856 0 C-N-CA 123.819 0.723 . . . . 0.0 113.234 176.374 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 83.8 mt -65.95 129.31 30.16 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.196 0 N-CA-C 107.282 -1.377 . . . . 0.0 107.282 175.546 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . 0.486 ' HB2' ' CD1' ' A' ' 20' ' ' LEU . 3.0 t -159.61 73.56 0.57 Allowed 'General case' 0 CA--C 1.518 -0.261 0 N-CA-C 110.198 -0.297 . . . . 0.0 110.198 -171.357 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -44.6 -51.14 8.09 Favored Glycine 0 CA--C 1.527 0.789 0 CA-C-O 118.838 -0.979 . . . . 0.0 114.126 -170.305 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . 0.432 ' HA ' ' HE3' ' A' ' 30' ' ' LYS . 37.1 p -70.34 -39.03 74.94 Favored 'General case' 0 N--CA 1.455 -0.184 0 CA-C-N 119.615 1.707 . . . . 0.0 111.072 -173.913 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 87.5 mtt180 -74.18 -39.83 62.94 Favored 'General case' 0 N--CA 1.454 -0.259 0 CA-C-N 117.812 0.278 . . . . 0.0 110.715 -179.36 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 61.7 mt -56.63 -46.09 82.67 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.634 0 N-CA-C 108.782 -0.822 . . . . 0.0 108.782 173.753 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . 0.432 ' HE3' ' HA ' ' A' ' 27' ' ' SER . 51.4 mtmt -66.75 -29.08 68.97 Favored 'General case' 0 C--N 1.34 0.168 0 CA-C-O 118.984 -0.532 . . . . 0.0 111.332 179.261 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . 0.468 ' HA ' ' CE ' ' A' ' 31' ' ' LYS . 3.3 mmpt? -66.13 -55.64 15.41 Favored 'General case' 0 N--CA 1.458 -0.073 0 CA-C-N 118.795 0.725 . . . . 0.0 111.014 -179.075 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.506 ' HB2' ' CE2' ' A' ' 10' ' ' PHE . 1.6 pp -76.12 -18.88 58.96 Favored 'General case' 0 CA--C 1.532 0.264 0 C-N-CA 119.427 -0.909 . . . . 0.0 111.702 -179.71 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . 0.468 ' N ' HD12 ' A' ' 32' ' ' LEU . 33.2 m -71.13 -40.69 71.24 Favored 'General case' 0 N--CA 1.456 -0.156 0 N-CA-C 108.746 -0.835 . . . . 0.0 108.746 174.834 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 97.9 m -66.75 -41.2 88.17 Favored 'General case' 0 N--CA 1.45 -0.444 0 N-CA-C 109.776 -0.453 . . . . 0.0 109.776 179.388 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 22.1 t80 -60.62 -34.97 75.03 Favored 'General case' 0 C--O 1.226 -0.145 0 N-CA-C 109.938 -0.393 . . . . 0.0 109.938 177.337 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -73.46 -28.45 61.95 Favored 'General case' 0 N--CA 1.449 -0.49 0 CA-C-O 119.25 -0.405 . . . . 0.0 111.522 178.817 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 2.6 mm? -82.38 -34.26 28.43 Favored 'General case' 0 CA--C 1.52 -0.193 0 N-CA-C 109.259 -0.645 . . . . 0.0 109.259 -177.564 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 83.0 m-20 -64.93 -26.74 68.44 Favored 'General case' 0 N--CA 1.442 -0.85 0 C-N-CA 123.829 0.852 . . . . 0.0 110.675 174.463 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 75.7 m80 -151.59 105.64 3.17 Favored 'General case' 0 N--CA 1.452 -0.329 0 C-N-CA 122.985 0.514 . . . . 0.0 111.264 -177.959 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 40' ' ' ILE . . . . . 0.6 ' H ' HD13 ' A' ' 40' ' ' ILE . 0.0 OUTLIER -81.22 -14.59 12.59 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.378 0 C-N-CA 123.323 0.649 . . . . 0.0 110.7 175.481 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 94.5 m-20 -61.35 -11.65 10.89 Favored 'General case' 0 CA--C 1.528 0.103 0 N-CA-C 112.924 0.713 . . . . 0.0 112.924 -178.366 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -111.12 16.15 8.08 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.163 0 C-N-CA 123.23 0.612 . . . . 0.0 111.33 176.17 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 3.0 pp20? -52.77 -32.56 44.23 Favored 'General case' 0 CA--C 1.531 0.228 0 O-C-N 121.649 -0.657 . . . . 0.0 110.668 177.236 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 40.7 t -58.71 -48.35 81.43 Favored 'General case' 0 C--O 1.234 0.267 0 N-CA-C 112.519 0.562 . . . . 0.0 112.519 -179.362 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . 0.513 ' HD3' ' CD1' ' A' ' 7' ' ' PHE . 18.7 ptpt -72.33 -25.9 61.72 Favored 'General case' 0 CA--C 1.53 0.187 0 CA-C-N 118.35 0.523 . . . . 0.0 110.193 179.69 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 70.4 mt -72.39 -48.8 46.2 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.257 0 N-CA-C 109.969 -0.382 . . . . 0.0 109.969 -178.236 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 39.6 mm -64.34 -35.67 74.89 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.232 0 N-CA-C 109.296 -0.631 . . . . 0.0 109.296 178.766 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 49.0 m -63.73 -38.93 92.95 Favored 'General case' 0 N--CA 1.453 -0.289 0 CA-C-N 116.836 -0.166 . . . . 0.0 111.1 179.993 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 35.7 mt -76.25 -32.81 59.08 Favored 'General case' 0 N--CA 1.45 -0.467 0 N-CA-C 113.545 0.943 . . . . 0.0 113.545 -178.917 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 15.5 pt -69.81 -40.62 79.23 Favored 'Isoleucine or valine' 0 CA--C 1.523 -0.089 0 CA-C-N 119.647 1.112 . . . . 0.0 110.298 179.294 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 25.8 pt -69.05 -38.53 78.45 Favored 'Isoleucine or valine' 0 CA--C 1.527 0.095 0 C-N-CA 120.068 -0.653 . . . . 0.0 110.528 178.838 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 95.9 m-20 -70.26 -39.36 75.02 Favored 'General case' 0 N--CA 1.456 -0.172 0 CA-C-O 119.281 -0.39 . . . . 0.0 112.007 177.848 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 53' ' ' TYR . . . . . 0.436 ' CE1' ' HG2' ' A' ' 18' ' ' LYS . 13.9 t80 -65.55 -46.61 78.86 Favored 'General case' 0 N--CA 1.453 -0.3 0 N-CA-C 108.707 -0.849 . . . . 0.0 108.707 177.384 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 23.1 m -61.71 -31.9 72.08 Favored 'General case' 0 N--CA 1.455 -0.218 0 O-C-N 123.096 0.248 . . . . 0.0 110.869 -178.327 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 56.2 ttp85 -75.43 -53.34 8.85 Favored 'General case' 0 N--CA 1.451 -0.381 0 C-N-CA 123.494 0.718 . . . . 0.0 112.023 -177.181 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 38.0 mt -76.1 -41.53 50.05 Favored 'General case' 0 N--CA 1.456 -0.158 0 N-CA-C 113.025 0.75 . . . . 0.0 113.025 -173.666 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 8.5 p -64.76 157.1 76.32 Favored Pre-proline 0 CA--C 1.535 0.37 0 N-CA-C 112.842 0.682 . . . . 0.0 112.842 -172.717 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 93.7 Cg_endo -74.66 175.85 10.56 Favored 'Trans proline' 0 N--CA 1.457 -0.664 0 C-N-CA 124.777 3.652 . . . . 0.0 111.131 178.945 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 23.1 p-10 -51.65 -50.06 61.09 Favored 'General case' 0 N--CA 1.456 -0.159 0 C-N-CA 124.31 1.044 . . . . 0.0 113.606 -172.061 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 81.9 p -64.92 -35.71 82.04 Favored 'General case' 0 N--CA 1.452 -0.351 0 C-N-CA 120.066 -0.654 . . . . 0.0 110.148 -177.299 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 48.3 m170 -74.04 -24.77 59.59 Favored 'General case' 0 N--CA 1.455 -0.18 0 CA-C-O 119.033 -0.508 . . . . 0.0 110.263 178.499 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 64.8 mttm -65.96 -34.74 78.8 Favored 'General case' 0 C--N 1.339 0.144 0 CA-C-N 118.791 0.723 . . . . 0.0 109.484 173.984 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -63.65 -48.68 76.27 Favored 'General case' 0 CA--C 1.531 0.248 0 N-CA-C 108.339 -0.985 . . . . 0.0 108.339 174.385 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -66.45 -26.88 72.82 Favored Glycine 0 CA--C 1.525 0.717 0 N-CA-C 111.732 -0.547 . . . . 0.0 111.732 -178.979 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 48.9 m -68.3 -40.35 81.77 Favored 'General case' 0 N--CA 1.452 -0.369 0 CA-C-N 117.654 0.727 . . . . 0.0 109.226 177.297 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 78.0 mt -70.05 -23.84 63.16 Favored 'General case' 0 N--CA 1.449 -0.51 0 CA-C-N 116.633 -0.258 . . . . 0.0 110.502 178.417 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 2.3 m-85 -69.54 -40.77 76.66 Favored 'General case' 0 N--CA 1.456 -0.149 0 CA-C-N 117.703 0.229 . . . . 0.0 111.23 173.041 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 68' ' ' ILE . . . . . 0.519 HD11 ' CD1' ' A' ' 17' ' ' PHE . 8.3 mt -67.43 -43.96 87.2 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.236 0 N-CA-C 109.123 -0.695 . . . . 0.0 109.123 178.772 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 88.9 mt -60.22 -30.69 46.54 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.251 0 C-N-CA 122.717 0.407 . . . . 0.0 111.059 175.887 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 19.4 t70 -70.09 -45.03 67.84 Favored 'General case' 0 N--CA 1.454 -0.262 0 CA-C-N 118.276 0.489 . . . . 0.0 111.603 179.346 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 95.0 p -70.88 -50.08 39.03 Favored 'General case' 0 N--CA 1.45 -0.444 0 C-N-CA 120.857 -0.337 . . . . 0.0 110.381 -176.404 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -75.72 -35.25 30.49 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.218 0 N-CA-C 110.234 -0.284 . . . . 0.0 110.234 -178.108 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -65.32 -51.78 46.21 Favored Glycine 0 C--N 1.335 0.476 0 N-CA-C 111.461 -0.656 . . . . 0.0 111.461 -175.132 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 36.8 mtm105 -71.26 -42.97 68.1 Favored 'General case' 0 N--CA 1.452 -0.351 0 C-N-CA 120.218 -0.593 . . . . 0.0 110.253 179.674 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -60.54 -28.26 68.29 Favored 'General case' 0 N--CA 1.45 -0.443 0 C-N-CA 120.024 -0.67 . . . . 0.0 110.193 -178.692 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 1.8 m-30 -70.36 -55.31 9.43 Favored 'General case' 0 N--CA 1.453 -0.275 0 CA-C-N 118.242 0.473 . . . . 0.0 110.865 174.993 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 6.9 tt -65.94 -43.67 87.33 Favored 'General case' 0 N--CA 1.451 -0.423 0 C-N-CA 117.661 -1.616 . . . . 0.0 109.331 -175.955 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 56.5 m-20 -55.82 -51.45 67.45 Favored 'General case' 0 CA--C 1.528 0.116 0 C-N-CA 122.471 0.308 . . . . 0.0 111.438 -179.028 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 15.2 tm-20 -66.23 -46.1 78.35 Favored 'General case' 0 N--CA 1.446 -0.666 0 N-CA-C 111.618 0.229 . . . . 0.0 111.618 -178.246 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 80' ' ' THR . . . . . 0.418 ' HB ' ' HA ' ' A' ' 86' ' ' SER . 81.4 p -70.51 -21.51 62.74 Favored 'General case' 0 N--CA 1.451 -0.38 0 CA-C-O 119.711 -0.185 . . . . 0.0 111.341 -178.263 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -75.92 -33.21 59.86 Favored 'General case' 0 N--CA 1.453 -0.309 0 CA-C-N 117.858 0.299 . . . . 0.0 110.198 172.363 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 46.1 t -77.49 -23.47 50.31 Favored 'General case' 0 N--CA 1.457 -0.118 0 N-CA-C 112.68 0.622 . . . . 0.0 112.68 -178.945 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 72.4 m-20 -132.04 177.4 7.58 Favored 'General case' 0 CA--C 1.529 0.151 0 CA-C-O 120.986 0.422 . . . . 0.0 111.391 -172.35 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 25.0 m -68.71 -1.41 6.91 Favored 'General case' 0 CA--C 1.53 0.196 0 N-CA-C 112.718 0.636 . . . . 0.0 112.718 -179.19 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 77.0 m-20 -75.16 13.05 0.76 Allowed 'General case' 0 CA--C 1.534 0.361 0 C-N-CA 123.236 0.614 . . . . 0.0 112.123 -179.884 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 86' ' ' SER . . . . . 0.418 ' HA ' ' HB ' ' A' ' 80' ' ' THR . 98.8 p -62.62 -26.56 68.68 Favored 'General case' 0 CA--C 1.528 0.107 0 C-N-CA 123.427 0.691 . . . . 0.0 112.249 -177.496 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 47.1 t -163.47 161.82 24.39 Favored 'General case' 0 N--CA 1.454 -0.232 0 CA-C-N 118.339 0.518 . . . . 0.0 110.72 -179.787 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 87.7 p -157.84 159.49 36.72 Favored 'General case' 0 N--CA 1.449 -0.496 0 N-CA-C 109.062 -0.718 . . . . 0.0 109.062 177.515 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 5.6 m120 -74.77 21.66 0.11 Allowed 'General case' 0 CA--C 1.533 0.307 0 C-N-CA 123.416 0.686 . . . . 0.0 112.632 -178.186 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 22.3 pttm -155.83 164.87 19.86 Favored Pre-proline 0 N--CA 1.455 -0.225 0 CA-C-N 118.079 0.399 . . . . 0.0 110.417 -176.077 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 44.5 Cg_endo -63.56 118.37 5.3 Favored 'Trans proline' 0 N--CA 1.45 -1.031 0 N-CA-C 106.35 -2.212 . . . . 0.0 106.35 167.141 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 92' ' ' GLY . . . . . 0.408 ' HA2' ' O ' ' A' ' 40' ' ' ILE . . . 156.9 19.51 0.04 OUTLIER Glycine 0 CA--C 1.529 0.932 0 CA-C-O 118.896 -0.947 . . . . 0.0 114.019 -170.803 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 1.3 p -155.2 165.49 36.51 Favored 'General case' 0 C--O 1.231 0.129 0 CA-C-N 118.617 1.209 . . . . 0.0 109.607 179.46 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 94' ' ' CYS . . . . . 0.512 ' SG ' HD13 ' A' ' 98' ' ' ILE . 2.3 t -51.46 -28.91 14.48 Favored 'General case' 0 N--CA 1.454 -0.233 0 C-N-CA 123.462 0.705 . . . . 0.0 110.722 175.372 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -54.56 -62.54 1.59 Allowed 'General case' 0 N--CA 1.451 -0.403 0 CA-C-N 117.821 0.282 . . . . 0.0 110.357 -179.001 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 66.2 t60 -71.54 -32.6 68.33 Favored 'General case' 0 N--CA 1.451 -0.38 0 O-C-N 122.29 -0.256 . . . . 0.0 110.65 -177.585 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -68.39 -51.74 40.69 Favored 'General case' 0 N--CA 1.451 -0.398 0 N-CA-C 111.579 0.214 . . . . 0.0 111.579 -175.528 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 98' ' ' ILE . . . . . 0.512 HD13 ' SG ' ' A' ' 94' ' ' CYS . 1.7 mp -69.43 -34.86 64.2 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.234 0 CA-C-O 119.35 -0.357 . . . . 0.0 110.116 -178.231 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 29.5 m-80 -70.89 -40.0 72.49 Favored 'General case' 0 N--CA 1.456 -0.131 0 C-N-CA 119.995 -0.682 . . . . 0.0 112.018 178.896 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 85.3 m -74.2 -25.02 59.45 Favored 'General case' 0 N--CA 1.457 -0.104 0 CA-C-N 118.348 0.522 . . . . 0.0 111.178 -177.151 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 64.6 tp -87.57 -40.73 13.99 Favored 'General case' 0 N--CA 1.451 -0.409 0 O-C-N 122.256 -0.278 . . . . 0.0 110.506 177.582 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -69.86 -20.29 75.91 Favored Glycine 0 CA--C 1.527 0.84 0 CA-C-O 119.579 -0.567 . . . . 0.0 112.52 -175.592 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 22.9 pt-20 -79.35 -4.66 51.96 Favored 'General case' 0 N--CA 1.453 -0.295 0 CA-C-N 118.168 0.984 . . . . 0.0 111.595 179.285 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 21.9 m -139.89 3.93 0.57 Allowed 'Isoleucine or valine' 0 N--CA 1.464 0.259 0 N-CA-C 112.538 0.57 . . . . 0.0 112.538 176.834 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 105' ' ' ILE . . . . . . . . . . . . . 10.9 tp -64.43 -31.04 51.9 Favored 'Isoleucine or valine' 0 C--O 1.227 -0.104 0 CA-C-N 118.912 0.778 . . . . 0.0 111.118 -175.352 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 11.7 pt20 -67.8 -28.69 67.81 Favored 'General case' 0 N--CA 1.454 -0.23 0 O-C-N 122.017 -0.427 . . . . 0.0 110.107 179.453 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 61.6 mm-40 -75.68 -42.22 51.71 Favored 'General case' 0 N--CA 1.454 -0.243 0 N-CA-C 109.791 -0.448 . . . . 0.0 109.791 -179.35 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 88.7 mt -71.37 -34.59 70.58 Favored 'General case' 0 N--CA 1.454 -0.226 0 CA-C-N 116.67 -0.241 . . . . 0.0 110.793 -178.993 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 77.2 mt -67.04 -49.44 65.19 Favored 'General case' 0 N--CA 1.452 -0.329 0 N-CA-C 109.682 -0.488 . . . . 0.0 109.682 174.967 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 47.8 m -53.67 -39.8 65.41 Favored 'General case' 0 C--O 1.232 0.173 0 C-N-CA 122.528 0.331 . . . . 0.0 110.98 -179.575 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 29.4 t0 -67.18 -41.39 86.01 Favored 'General case' 0 N--CA 1.451 -0.421 0 CA-C-O 120.916 0.389 . . . . 0.0 110.199 177.715 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -70.87 -36.96 73.04 Favored 'General case' 0 N--CA 1.449 -0.51 0 CA-C-N 116.287 -0.415 . . . . 0.0 111.316 -176.324 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 113' ' ' ILE . . . . . 0.44 ' O ' ' HE3' ' A' ' 121' ' ' LYS . 18.3 mm -68.99 -40.98 81.59 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.185 0 N-CA-C 109.441 -0.577 . . . . 0.0 109.441 179.898 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -69.63 -27.64 65.23 Favored 'General case' 0 N--CA 1.453 -0.282 0 N-CA-C 112.048 0.388 . . . . 0.0 112.048 -179.903 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -90.09 -38.17 13.73 Favored 'General case' 0 CA--C 1.529 0.139 0 N-CA-C 112.434 0.531 . . . . 0.0 112.434 -179.472 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 116' ' ' SER . . . . . 0.446 ' HB3' ' CB ' ' A' ' 120' ' ' HIS . 2.7 m -86.51 154.33 21.18 Favored 'General case' 0 CA--C 1.528 0.125 0 N-CA-C 112.227 0.454 . . . . 0.0 112.227 -170.307 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 49.1 t30 -77.72 170.56 16.38 Favored 'General case' 0 CA--C 1.531 0.229 0 C-N-CA 123.117 0.567 . . . . 0.0 111.302 -175.954 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 118' ' ' GLN . . . . . . . . . . . . . 20.8 mm100 -57.84 -34.05 69.3 Favored 'General case' 0 N--CA 1.457 -0.079 0 C-N-CA 123.237 0.615 . . . . 0.0 112.239 -173.631 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 9.5 p30 -70.39 -40.7 73.78 Favored 'General case' 0 N--CA 1.453 -0.29 0 N-CA-C 109.377 -0.601 . . . . 0.0 109.377 176.935 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 120' ' ' HIS . . . . . 0.446 ' CB ' ' HB3' ' A' ' 116' ' ' SER . 29.0 m170 -64.41 -39.47 93.91 Favored 'General case' 0 N--CA 1.45 -0.445 0 N-CA-C 109.746 -0.464 . . . . 0.0 109.746 176.486 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 121' ' ' LYS . . . . . 0.44 ' HE3' ' O ' ' A' ' 113' ' ' ILE . 64.5 mttp -59.73 -36.39 76.5 Favored 'General case' 0 C--N 1.342 0.257 0 N-CA-C 109.725 -0.472 . . . . 0.0 109.725 176.841 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 26.8 tt0 -65.74 -43.74 88.07 Favored 'General case' 0 N--CA 1.452 -0.341 0 C-N-CA 122.625 0.37 . . . . 0.0 110.651 -178.765 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 14.3 mptt -68.28 -30.02 68.94 Favored 'General case' 0 N--CA 1.457 -0.118 0 C-N-CA 120.486 -0.486 . . . . 0.0 110.221 -179.481 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 124' ' ' ILE . . . . . . . . . . . . . 67.6 mt -73.13 -39.64 57.12 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.365 0 N-CA-C 109.385 -0.598 . . . . 0.0 109.385 177.862 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 125' ' ' ARG . . . . . 0.426 ' HD2' ' HA ' ' A' ' 125' ' ' ARG . 8.1 mmm180 -61.54 -43.72 98.34 Favored 'General case' 0 N--CA 1.451 -0.416 0 CA-C-O 118.544 -0.741 . . . . 0.0 111.593 179.051 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 126' ' ' MET . . . . . . . . . . . . . 28.2 ptm -64.68 -38.93 92.67 Favored 'General case' 0 N--CA 1.454 -0.274 0 C-N-CA 118.77 -1.172 . . . . 0.0 108.897 177.816 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 4.2 mp -61.81 -44.08 97.57 Favored 'General case' 0 N--CA 1.455 -0.223 0 CA-C-N 118.076 0.398 . . . . 0.0 111.09 178.216 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 83.9 mt -65.36 -32.66 74.42 Favored 'General case' 0 N--CA 1.456 -0.145 0 CA-C-N 118.506 0.593 . . . . 0.0 111.465 -177.832 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 45.5 m-20 -75.63 -35.51 60.45 Favored 'General case' 0 N--CA 1.453 -0.31 0 CA-C-N 118.329 0.513 . . . . 0.0 109.863 177.011 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 130' ' ' ILE . . . . . 0.441 ' HA ' ' HD3' ' A' ' 133' ' ' ARG . 66.9 mt -62.98 -33.3 59.84 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.25 0 N-CA-C 109.39 -0.596 . . . . 0.0 109.39 174.784 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 131' ' ' TRP . . . . . . . . . . . . . 43.0 m0 -71.31 -40.69 70.65 Favored 'General case' 0 N--CA 1.452 -0.339 0 N-CA-C 112.164 0.431 . . . . 0.0 112.164 179.129 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 25.5 m-20 -63.32 -31.83 73.08 Favored 'General case' 0 N--CA 1.455 -0.189 0 CA-C-N 118.516 0.598 . . . . 0.0 110.331 178.18 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 133' ' ' ARG . . . . . 0.498 ' HB2' HD13 ' B' 2062 ' ' ILE . 18.0 mtp180 -73.03 -29.17 62.8 Favored 'General case' 0 CA--C 1.529 0.137 0 C-N-CA 122.89 0.476 . . . . 0.0 111.126 178.232 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 15.2 t -74.17 -14.91 61.02 Favored 'General case' 0 CA--C 1.532 0.258 0 CA-C-N 117.855 0.298 . . . . 0.0 110.839 173.856 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 135' ' ' GLY . . . . . . . . . . . . . . . 93.37 8.63 61.06 Favored Glycine 0 CA--C 1.527 0.827 0 CA-C-O 119.554 -0.581 . . . . 0.0 112.257 179.768 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 136' ' ' LEU . . . . . . . . . . . . . 61.6 mt -64.95 162.3 16.8 Favored 'General case' 0 N--CA 1.454 -0.258 0 CA-C-N 117.74 0.77 . . . . 0.0 109.624 175.789 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 137' ' ' PHE . . . . . . . . . . . . . 12.1 m-30 -60.6 119.25 7.73 Favored 'General case' 0 N--CA 1.454 -0.237 0 N-CA-C 108.237 -1.023 . . . . 0.0 108.237 177.998 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 138' ' ' GLN . . . . . . . . . . . . . 27.9 mt-30 -70.47 152.01 44.49 Favored 'General case' 0 N--CA 1.451 -0.381 0 CA-C-O 120.935 0.398 . . . . 0.0 111.314 -174.865 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 139' ' ' LYS . . . . . 0.545 ' CD ' ' H ' ' A' ' 139' ' ' LYS . 0.0 OUTLIER -64.82 149.48 49.33 Favored 'General case' 0 N--CA 1.455 -0.224 0 N-CA-C 108.663 -0.865 . . . . 0.0 108.663 173.311 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 140' ' ' SER . . . . . 0.444 ' C ' ' H ' ' A' ' 142' ' ' LEU . 38.8 t -146.76 172.1 14.14 Favored 'General case' 0 N--CA 1.454 -0.26 0 C-N-CA 122.151 0.18 . . . . 0.0 111.076 -173.782 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 141' ' ' TYR . . . . . . . . . . . . . 44.0 m-85 62.68 -35.13 0.12 Allowed 'General case' 0 CA--C 1.53 0.184 0 C-N-CA 126.742 2.017 . . . . 0.0 113.33 -174.434 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 142' ' ' LEU . . . . . 0.444 ' H ' ' C ' ' A' ' 140' ' ' SER . 57.3 mt 59.41 -26.2 0.03 OUTLIER 'General case' 0 CA--C 1.533 0.299 0 C-N-CA 127.513 2.325 . . . . 0.0 114.709 177.627 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 21.4 t-20 -68.94 -35.76 77.15 Favored 'General case' 0 N--CA 1.454 -0.227 0 CA-C-N 119.149 0.886 . . . . 0.0 110.353 -179.718 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . -70.75 -51.25 28.38 Favored 'General case' 0 N--CA 1.45 -0.464 0 N-CA-C 109.199 -0.667 . . . . 0.0 109.199 177.258 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 145' ' ' ILE . . . . . . . . . . . . . 41.1 mm -57.16 -39.17 65.23 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.234 0 C-N-CA 122.917 0.487 . . . . 0.0 110.586 178.977 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 146' ' ' ARG . . . . . . . . . . . . . 52.1 tpt85 -73.43 -24.47 60.25 Favored 'General case' 0 N--CA 1.456 -0.152 0 O-C-N 122.171 -0.331 . . . . 0.0 110.462 177.92 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 147' ' ' SER . . . . . . . . . . . . . 32.4 t 48.98 63.55 2.08 Favored 'General case' 0 N--CA 1.455 -0.209 0 C-N-CA 123.557 0.743 . . . . 0.0 110.725 178.961 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -53.77 -14.67 0.99 Allowed 'General case' 0 CA--C 1.529 0.15 0 C-N-CA 123.643 0.777 . . . . 0.0 112.522 179.729 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 149' ' ' CYS . . . . . . . . . . . . . 48.7 t -62.87 -28.06 69.77 Favored 'General case' 0 N--CA 1.451 -0.41 0 N-CA-C 109.478 -0.564 . . . . 0.0 109.478 177.377 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 150' ' ' PHE . . . . . . . . . . . . . 53.4 t80 -62.67 -28.43 69.92 Favored 'General case' 0 N--CA 1.454 -0.257 0 N-CA-C 110.247 -0.279 . . . . 0.0 110.247 179.455 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 151' ' ' ALA . . . . . . . . . . . . . . . -83.08 -30.71 27.77 Favored 'General case' 0 N--CA 1.452 -0.33 0 C-N-CA 122.353 0.261 . . . . 0.0 110.311 175.449 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 152' ' ' MET . . . . . . . . . . . . . 90.3 mtp -74.21 -21.47 59.79 Favored 'General case' 0 C--N 1.337 0.059 0 C-N-CA 122.288 0.235 . . . . 0.0 111.246 177.765 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 153' ' ' ASP . . . . . . . . . . . . . 67.5 m-20 -74.47 -12.28 60.45 Favored 'General case' 0 CA--C 1.53 0.175 0 C-N-CA 123.532 0.733 . . . . 0.0 111.775 176.192 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 154' ' ' LEU . . . . . . . . . . . . . 78.9 mt -74.3 143.73 44.85 Favored 'General case' 0 N--CA 1.454 -0.237 0 O-C-N 122.196 -0.315 . . . . 0.0 110.899 -178.892 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 155' ' ' GLU . . . . . . . . . . . . . 23.0 pt-20 -156.01 169.62 24.04 Favored 'General case' 0 N--CA 1.454 -0.269 0 C-N-CA 123.277 0.631 . . . . 0.0 109.607 179.556 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 156' ' ' HIS . . . . . . . . . . . . . 86.2 t60 -70.06 154.18 42.26 Favored 'General case' 0 N--CA 1.456 -0.169 0 N-CA-C 110.167 -0.309 . . . . 0.0 110.167 178.428 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 157' ' ' HIS . . . . . . . . . . . . . 48.5 m170 -68.37 144.5 54.74 Favored 'General case' 0 N--CA 1.456 -0.153 0 CA-C-O 120.921 0.391 . . . . 0.0 110.986 -177.341 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 158' ' ' HIS . . . . . . . . . . . . . 26.0 p80 -153.28 2.7 0.29 Allowed 'General case' 0 CA--C 1.529 0.167 0 C-N-CA 123.159 0.584 . . . . 0.0 111.464 179.157 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 159' ' ' HIS . . . . . . . . . . . . . 21.9 t-160 . . . . . 0 C--O 1.249 1.058 0 CA-C-O 116.808 -1.568 . . . . 0.0 108.852 -178.036 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' B' B 2052 ' ' ASP . . . . . . . . . . . . . 36.4 p-10 . . . . . 0 N--CA 1.473 0.677 0 N-CA-C 109.476 -0.565 . . . . 0.0 109.476 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' B' B 2053 ' ' ASP . . . . . . . . . . . . . 45.5 m-20 -124.22 156.74 36.29 Favored 'General case' 0 CA--C 1.53 0.202 0 C-N-CA 123.622 0.769 . . . . 0.0 111.056 -178.412 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B 2054 ' ' ASP . . . . . 0.408 ' CG ' ' H ' ' B' 2055 ' ' GLU . 53.8 t0 -157.65 -164.03 1.47 Allowed 'General case' 0 CA--C 1.536 0.429 0 C-N-CA 125.05 1.34 . . . . 0.0 107.539 178.632 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B 2055 ' ' GLU . . . . . 0.411 ' C ' ' H ' ' B' 2057 ' ' ASP . 92.2 mt-10 -67.81 63.28 0.08 Allowed 'General case' 0 CA--C 1.533 0.315 0 C-N-CA 123.767 0.827 . . . . 0.0 109.61 169.592 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B 2056 ' ' ASP . . . . . . . . . . . . . 12.4 m-20 -67.69 25.65 0.02 OUTLIER 'General case' 0 CA--C 1.532 0.283 0 C-N-CA 124.854 1.261 . . . . 0.0 112.881 -178.617 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B 2057 ' ' ASP . . . . . 0.411 ' H ' ' C ' ' B' 2055 ' ' GLU . 38.2 t0 -136.74 29.72 2.87 Favored 'General case' 0 CA--C 1.531 0.237 0 C-N-CA 123.534 0.733 . . . . 0.0 110.776 -176.609 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B 2058 ' ' TYR . . . . . . . . . . . . . 8.4 t80 -50.31 132.51 24.43 Favored 'General case' 0 N--CA 1.456 -0.141 0 N-CA-C 109.524 -0.547 . . . . 0.0 109.524 177.415 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B 2059 ' ' THR . . . . . . . . . . . . . 58.5 m -140.93 109.39 6.47 Favored Pre-proline 0 N--CA 1.454 -0.256 0 N-CA-C 109.163 -0.68 . . . . 0.0 109.163 -177.272 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B 2060 ' ' PRO . . . . . . . . . . . . . 93.0 Cg_endo -76.96 167.69 24.73 Favored 'Trans proline' 0 N--CA 1.451 -0.999 0 C-N-CA 123.563 2.842 . . . . 0.0 111.194 179.982 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B 2061 ' ' SER . . . . . . . . . . . . . 91.2 p -151.62 149.61 29.34 Favored 'General case' 0 N--CA 1.453 -0.309 0 N-CA-C 108.875 -0.787 . . . . 0.0 108.875 176.807 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B 2062 ' ' ILE . . . . . 0.498 HD13 ' HB2' ' A' ' 133' ' ' ARG . 19.3 tt -165.79 160.96 0.88 Allowed 'Isoleucine or valine' 0 N--CA 1.454 -0.226 0 N-CA-C 109.922 -0.399 . . . . 0.0 109.922 -175.87 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B 2063 ' ' SER . . . . . 0.406 ' C ' HH21 ' A' ' 133' ' ' ARG . 87.9 p . . . . . 0 C--O 1.248 0.978 0 CA-C-O 116.892 -1.528 . . . . 0.0 109.95 175.317 . . . . . . . . 1 1 . 1 stop_ save_