data_2lma_residue save_MolProbity _Software.Sf_category software _Software.Sf_framecode MolProbity _Software.Entry_ID ? _Software.ID 1 _Software.Name MolProbity _Software.Version 4.0 _Software.Details . save_ save_CYRANGE _Software.Sf_category software _Software.Sf_framecode CYRANGE _Software.Entry_ID ? _Software.ID 2 _Software.Name CYRANGE _Software.Version 2.0 _Software.Details . save_ save_Structure_validation_residue _Structure_validation_residue.Sf_category structure_validation _Structure_validation_residue.Sf_framecode Structure_validation_residue _Structure_validation_residue.Entry_ID ? _Structure_validation_residue.List_ID 1 _Structure_validation_residue.PDB_accession_code 2lma _Structure_validation_residue.Date_analyzed 2016-10-07 loop_ _Residue_analysis_software.Software_ID _Residue_analysis_software.Software_label _Residue_analysis_software.Method_ID _Residue_analysis_software.Method_label _Residue_analysis_software.Entry_ID _Residue_analysis_software.Structure_validation_oneline_list_ID 1 MolProbity . . ? 1 2 CYRANGE . . ? 1 stop_ loop_ _Residue_analysis.ID _Residue_analysis.PDB_model_num _Residue_analysis.Hydrogen_positions _Residue_analysis.MolProbity_flips _Residue_analysis.Cyrange_core_flag _Residue_analysis.Two_letter_chain_ID _Residue_analysis.PDB_strand_ID _Residue_analysis.PDB_residue_no _Residue_analysis.PDB_ins_code _Residue_analysis.PDB_residue_name _Residue_analysis.Assembly_ID _Residue_analysis.Entity_assembly_ID _Residue_analysis.Entity_ID _Residue_analysis.Comp_ID _Residue_analysis.Comp_index_ID _Residue_analysis.Clash_value _Residue_analysis.Clash_source_PDB_atom_name _Residue_analysis.Clash_destination_PDB_atom_name _Residue_analysis.Clash_destination_PDB_strand_ID _Residue_analysis.Clash_destination_PDB_residue_no _Residue_analysis.Clash_destination_PDB_ins_code _Residue_analysis.Clash_destination_PDB_residue_name _Residue_analysis.Cbeta_deviation_value _Residue_analysis.Rotamer_score _Residue_analysis.Rotamer_name _Residue_analysis.Ramachandran_phi _Residue_analysis.Ramachandran_psi _Residue_analysis.Ramachandran_score _Residue_analysis.Ramachandran_evaluation _Residue_analysis.Ramachandran_type _Residue_analysis.Bond_outlier_count _Residue_analysis.Worst_bond _Residue_analysis.Worst_bond_value _Residue_analysis.Worst_bond_sigma _Residue_analysis.Angle_outlier_count _Residue_analysis.Worst_angle _Residue_analysis.Worst_angle_value _Residue_analysis.Worst_angle_sigma _Residue_analysis.RNA_phosphate_perpendicular_outlier _Residue_analysis.RNA_suitness_score _Residue_analysis.RNA_suite_conformer _Residue_analysis.RNA_suite_triage _Residue_analysis.Max_b_factor _Residue_analysis.Tau_angle _Residue_analysis.Omega_dihedral _Residue_analysis.Disulfide_chi1 _Residue_analysis.Disulfide_chi2 _Residue_analysis.Disulfide_chi3 _Residue_analysis.Disulfide_ss_angle _Residue_analysis.Disulfide_ss _Residue_analysis.Disulfide_ss_angle_prime _Residue_analysis.Disulfide_chi2prime _Residue_analysis.Disulfide_chi1prime _Residue_analysis.Outlier_count_separate_geometry _Residue_analysis.Outlier_count _Residue_analysis.Entry_ID _Residue_analysis.Structure_validation_residue_list_ID . 001 nuclear orig core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 58.0 t . . . . . 0 N--CA 1.457 -0.086 0 CA-C-O 120.817 0.341 . . . . 73.239999999999995 111.163 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 10.5 ttp -101.73 33.23 3.06 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.172 -0.467 . . . . 72.340000000000003 110.879 179.899 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 5.7 t -85.96 -3.95 59.05 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.245 -0.434 . . . . 75.319999999999993 111.182 -179.985 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . 0.645 ' C ' ' HG3' ' A' ' 19' ' ' PRO . 24.5 t -93.78 4.75 7.77 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.228 -0.442 . . . . 75.150000000000006 111.119 179.927 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 9.5 mt -143.47 3.19 0.34 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.184 -0.462 . . . . 64.510000000000005 111.16 179.922 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 17' ' ' SER . . . . . 0.788 ' C ' ' HD2' ' A' ' 19' ' ' PRO . 0.5 OUTLIER -100.26 -68.44 0.04 OUTLIER Pre-proline 0 C--N 1.329 -0.294 0 CA-C-O 121.643 0.735 . . . . 74.019999999999996 110.836 -179.895 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 18' ' ' PRO . . . . . 0.893 ' N ' ' HD2' ' A' ' 19' ' ' PRO . 54.2 Cg_endo -69.71 -27.89 26.14 Favored 'Trans proline' 0 C--O 1.231 0.154 0 C-N-CA 122.664 2.243 . . . . 70.439999999999998 112.391 179.953 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 19' ' ' PRO . . . . . 0.893 ' HD2' ' N ' ' A' ' 18' ' ' PRO . 54.0 Cg_endo -69.68 -16.52 37.93 Favored 'Trans proline' 0 C--N 1.342 0.189 0 C-N-CA 122.704 2.269 . . . . 74.519999999999996 112.352 179.934 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 2.8 mt-10 -81.93 -19.4 40.83 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.248 -0.433 . . . . 73.010000000000005 110.906 -179.982 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -59.62 -25.74 64.9 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.175 -0.466 . . . . 75.549999999999997 110.864 -179.954 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.302 0 C-N-CA 120.688 -0.768 . . . . 60.119999999999997 112.484 -179.934 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 48.1 t . . . . . 0 C--O 1.231 0.116 0 CA-C-O 120.795 0.331 . . . . 72.549999999999997 111.174 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 10.5 ttp -101.97 33.34 3.08 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.153 -0.476 . . . . 75.129999999999995 110.847 179.926 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 5.5 t -86.09 -4.03 59.08 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.242 -0.435 . . . . 65.200000000000003 111.171 -179.957 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . 0.638 ' C ' ' HG3' ' A' ' 19' ' ' PRO . 25.4 t -92.9 4.12 7.69 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.212 -0.449 . . . . 71.530000000000001 111.087 179.965 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 9.5 mt -143.34 3.37 0.35 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.164 -0.471 . . . . 74.120000000000005 111.089 179.928 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 17' ' ' SER . . . . . 0.801 ' C ' ' HD2' ' A' ' 19' ' ' PRO . 0.5 OUTLIER -99.91 -68.73 0.04 OUTLIER Pre-proline 0 C--N 1.33 -0.28 0 CA-C-O 121.688 0.756 . . . . 71.019999999999996 110.876 -179.92 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 18' ' ' PRO . . . . . 0.89 ' N ' ' HD2' ' A' ' 19' ' ' PRO . 53.9 Cg_endo -69.77 -27.89 25.86 Favored 'Trans proline' 0 C--N 1.342 0.211 0 C-N-CA 122.683 2.256 . . . . 72.310000000000002 112.324 179.977 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 19' ' ' PRO . . . . . 0.89 ' HD2' ' N ' ' A' ' 18' ' ' PRO . 54.2 Cg_endo -69.7 -16.47 37.83 Favored 'Trans proline' 0 C--N 1.342 0.202 0 C-N-CA 122.702 2.268 . . . . 73.439999999999998 112.358 179.949 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 2.8 mt-10 -81.94 -19.89 39.76 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.207 -0.451 . . . . 74.430000000000007 110.89 -179.964 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -58.64 -34.73 71.52 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.129 -0.487 . . . . 75.140000000000001 110.842 -179.911 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.303 0 C-N-CA 120.697 -0.763 . . . . 60.420000000000002 112.491 -179.975 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 48.1 t . . . . . 0 C--O 1.231 0.108 0 CA-C-O 120.857 0.36 . . . . 73.510000000000005 111.168 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 10.5 ttp -102.06 33.36 3.09 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.182 -0.463 . . . . 73.299999999999997 110.899 179.908 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 5.5 t -86.16 -3.94 59.06 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.183 -0.462 . . . . 62.119999999999997 111.153 -179.935 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . 0.642 ' C ' ' HG3' ' A' ' 19' ' ' PRO . 25.4 t -92.94 4.13 7.7 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.219 -0.446 . . . . 74.209999999999994 111.124 179.898 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 9.5 mt -143.27 3.3 0.35 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 116.152 -0.476 . . . . 72.510000000000005 111.123 179.914 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 17' ' ' SER . . . . . 0.804 ' C ' ' HD2' ' A' ' 19' ' ' PRO . 0.5 OUTLIER -99.84 -68.78 0.04 OUTLIER Pre-proline 0 C--N 1.329 -0.313 0 CA-C-O 121.676 0.75 . . . . 70.140000000000001 110.893 -179.917 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 18' ' ' PRO . . . . . 0.904 ' N ' ' HD2' ' A' ' 19' ' ' PRO . 53.7 Cg_endo -69.77 -27.86 25.92 Favored 'Trans proline' 0 C--N 1.341 0.165 0 C-N-CA 122.673 2.249 . . . . 64.299999999999997 112.36 179.952 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 19' ' ' PRO . . . . . 0.904 ' HD2' ' N ' ' A' ' 18' ' ' PRO . 53.2 Cg_endo -69.77 -16.42 37.51 Favored 'Trans proline' 0 C--N 1.341 0.176 0 C-N-CA 122.668 2.246 . . . . 75.319999999999993 112.329 179.96 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 1.5 mt-10 -81.91 -19.52 40.65 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.207 -0.451 . . . . 71.310000000000002 110.871 -179.995 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -59.56 -25.71 64.79 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.178 -0.465 . . . . 71.019999999999996 110.911 -179.918 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.342 0 C-N-CA 120.752 -0.737 . . . . 53.329999999999998 112.469 -179.963 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 50.4 t . . . . . 0 C--O 1.23 0.074 0 CA-C-O 120.862 0.363 . . . . 73.299999999999997 111.141 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 10.4 ttp -102.26 33.7 3.01 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.13 -0.486 . . . . 71.430000000000007 110.884 179.926 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 5.8 t -86.47 -3.94 59.09 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.264 -0.425 . . . . 73.349999999999994 111.143 -179.912 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . 0.651 ' C ' ' HG3' ' A' ' 19' ' ' PRO . 24.3 t -93.87 4.1 8.21 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.208 -0.451 . . . . 75.209999999999994 111.155 179.911 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 2.8 mp -142.5 3.46 0.4 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.194 -0.457 . . . . 63.409999999999997 111.144 179.893 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 17' ' ' SER . . . . . 0.792 ' C ' ' HD2' ' A' ' 19' ' ' PRO . 0.5 OUTLIER -100.19 -68.43 0.04 OUTLIER Pre-proline 0 C--N 1.329 -0.296 0 CA-C-O 121.675 0.75 . . . . 74.340000000000003 110.895 -179.962 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 18' ' ' PRO . . . . . 0.896 ' N ' ' HD2' ' A' ' 19' ' ' PRO . 53.1 Cg_endo -69.73 -27.94 26.02 Favored 'Trans proline' 0 C--N 1.341 0.144 0 C-N-CA 122.73 2.286 . . . . 73.120000000000005 112.319 179.973 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 19' ' ' PRO . . . . . 0.896 ' HD2' ' N ' ' A' ' 18' ' ' PRO . 53.9 Cg_endo -69.71 -16.42 37.74 Favored 'Trans proline' 0 C--N 1.342 0.213 0 C-N-CA 122.651 2.234 . . . . 75.150000000000006 112.366 179.952 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -81.93 -19.76 40.08 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.207 -0.451 . . . . 75.409999999999997 110.863 -179.979 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -58.63 -32.93 69.5 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.151 -0.477 . . . . 62.439999999999998 110.896 -179.891 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.45 -0.372 0 C-N-CA 120.764 -0.732 . . . . 75.219999999999999 112.502 179.979 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 61.5 t . . . . . 0 C--O 1.231 0.101 0 CA-C-O 120.833 0.349 . . . . 73.129999999999995 111.132 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 10.4 ttp -102.05 33.84 2.91 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.159 -0.473 . . . . 65.219999999999999 110.882 179.955 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 5.8 t -86.59 -3.84 59.09 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.212 -0.449 . . . . 64.140000000000001 111.193 -179.949 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . 0.657 ' C ' ' HG3' ' A' ' 19' ' ' PRO . 24.2 t -93.94 4.07 8.27 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.191 -0.459 . . . . 72.450000000000003 111.132 179.904 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 2.8 mp -142.45 3.45 0.4 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.138 -0.483 . . . . 70.109999999999999 111.127 179.872 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 17' ' ' SER . . . . . 0.787 ' C ' ' HD2' ' A' ' 19' ' ' PRO . 0.5 OUTLIER -100.18 -68.41 0.04 OUTLIER Pre-proline 0 C--N 1.329 -0.291 0 CA-C-O 121.661 0.743 . . . . 72.230000000000004 110.884 -179.952 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 18' ' ' PRO . . . . . 0.895 ' N ' ' HD2' ' A' ' 19' ' ' PRO . 53.6 Cg_endo -69.75 -27.84 26.03 Favored 'Trans proline' 0 N--CA 1.465 -0.159 0 C-N-CA 122.716 2.277 . . . . 74.209999999999994 112.37 179.961 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 19' ' ' PRO . . . . . 0.895 ' HD2' ' N ' ' A' ' 18' ' ' PRO . 54.1 Cg_endo -69.77 -16.41 37.5 Favored 'Trans proline' 0 C--N 1.342 0.203 0 C-N-CA 122.624 2.216 . . . . 72.329999999999998 112.361 179.932 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -81.95 -19.85 39.84 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.206 -0.452 . . . . 74.209999999999994 110.879 -179.949 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -58.65 -34.54 71.31 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.125 -0.488 . . . . 71.519999999999996 110.864 -179.907 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.279 0 C-N-CA 120.748 -0.739 . . . . 52.329999999999998 112.427 -179.979 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 42.4 t . . . . . 0 C--O 1.23 0.07 0 CA-C-O 120.84 0.352 . . . . 75.030000000000001 111.124 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 10.3 ttp -102.02 33.77 2.93 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.183 -0.462 . . . . 74.109999999999999 110.884 179.928 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 5.8 t -86.5 -3.91 59.09 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.214 -0.448 . . . . 70.430000000000007 111.172 -179.978 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . 0.657 ' C ' ' HG3' ' A' ' 19' ' ' PRO . 24.1 t -93.86 4.07 8.22 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.243 -0.435 . . . . 73.209999999999994 111.107 179.933 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 2.8 mp -142.48 3.45 0.4 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.197 -0.456 . . . . 64.519999999999996 111.124 179.916 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 17' ' ' SER . . . . . 0.803 ' C ' ' HD2' ' A' ' 19' ' ' PRO . 0.5 OUTLIER -100.23 -68.42 0.04 OUTLIER Pre-proline 0 C--N 1.329 -0.293 0 CA-C-O 121.629 0.728 . . . . 72.219999999999999 110.838 -179.936 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 18' ' ' PRO . . . . . 0.891 ' N ' ' HD2' ' A' ' 19' ' ' PRO . 54.0 Cg_endo -69.72 -27.93 26.07 Favored 'Trans proline' 0 C--N 1.341 0.153 0 C-N-CA 122.726 2.284 . . . . 71.120000000000005 112.338 179.995 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 19' ' ' PRO . . . . . 0.891 ' HD2' ' N ' ' A' ' 18' ' ' PRO . 54.1 Cg_endo -69.69 -16.44 37.84 Favored 'Trans proline' 0 C--N 1.341 0.172 0 C-N-CA 122.704 2.27 . . . . 63.020000000000003 112.365 179.958 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -81.99 -19.51 40.39 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.184 -0.462 . . . . 74.420000000000002 110.852 -179.953 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -59.54 -25.72 64.75 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.139 -0.482 . . . . 72.510000000000005 110.912 -179.954 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.347 0 C-N-CA 120.795 -0.717 . . . . 71.239999999999995 112.496 -179.968 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 41.4 t . . . . . 0 C--O 1.231 0.116 0 CA-C-O 120.82 0.343 . . . . 73.030000000000001 111.121 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 9.4 ttp -102.24 32.78 3.36 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.212 -0.449 . . . . 74.5 110.872 179.928 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 5.9 t -86.78 -3.76 59.09 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.209 -0.45 . . . . 74.420000000000002 111.143 -179.899 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . 0.666 ' C ' ' HG3' ' A' ' 19' ' ' PRO . 23.2 t -94.25 4.58 8.13 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.187 -0.461 . . . . 70.310000000000002 111.122 179.904 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 2.8 mp -142.46 3.28 0.4 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.157 -0.474 . . . . 75.340000000000003 111.149 179.892 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 17' ' ' SER . . . . . 0.785 ' C ' ' HD2' ' A' ' 19' ' ' PRO . 0.5 OUTLIER -100.27 -68.24 0.05 OUTLIER Pre-proline 0 C--N 1.33 -0.272 0 CA-C-O 121.688 0.756 . . . . 75.299999999999997 110.926 -179.965 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 18' ' ' PRO . . . . . 0.908 ' N ' ' HD2' ' A' ' 19' ' ' PRO . 53.8 Cg_endo -69.79 -27.8 25.88 Favored 'Trans proline' 0 C--N 1.342 0.206 0 C-N-CA 122.681 2.254 . . . . 73.129999999999995 112.362 179.946 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 19' ' ' PRO . . . . . 0.908 ' HD2' ' N ' ' A' ' 18' ' ' PRO . 53.5 Cg_endo -69.77 -16.46 37.54 Favored 'Trans proline' 0 C--N 1.342 0.205 0 C-N-CA 122.717 2.278 . . . . 74.430000000000007 112.32 179.949 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -81.94 -19.91 39.72 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.249 -0.432 . . . . 73.019999999999996 110.909 -179.954 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -58.57 -34.34 70.96 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.136 -0.484 . . . . 72.450000000000003 110.866 -179.934 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.296 0 C-N-CA 120.775 -0.726 . . . . 64.109999999999999 112.488 -179.906 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 64.1 t . . . . . 0 C--O 1.231 0.091 0 CA-C-O 120.822 0.344 . . . . 75.120000000000005 111.152 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 10.4 ttp -101.74 33.28 3.05 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.188 -0.46 . . . . 72.329999999999998 110.863 179.897 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 5.7 t -86.02 -3.97 59.06 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.219 -0.446 . . . . 72.219999999999999 111.162 -179.956 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . 0.647 ' C ' ' HG3' ' A' ' 19' ' ' PRO . 24.4 t -93.84 4.85 7.74 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.191 -0.459 . . . . 62.340000000000003 111.11 179.95 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 9.6 mt -143.47 3.04 0.34 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 116.177 -0.465 . . . . 72.299999999999997 111.121 179.943 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 17' ' ' SER . . . . . 0.8 ' C ' ' HD2' ' A' ' 19' ' ' PRO . 0.5 OUTLIER -100.18 -68.39 0.04 OUTLIER Pre-proline 0 C--N 1.329 -0.295 0 CA-C-O 121.613 0.72 . . . . 75.400000000000006 110.837 -179.911 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 18' ' ' PRO . . . . . 0.893 ' N ' ' HD2' ' A' ' 19' ' ' PRO . 54.0 Cg_endo -69.74 -27.89 26.01 Favored 'Trans proline' 0 C--O 1.232 0.203 0 C-N-CA 122.657 2.238 . . . . 72.310000000000002 112.339 179.983 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 19' ' ' PRO . . . . . 0.893 ' HD2' ' N ' ' A' ' 18' ' ' PRO . 54.1 Cg_endo -69.71 -16.78 37.91 Favored 'Trans proline' 0 C--N 1.341 0.155 0 C-N-CA 122.725 2.284 . . . . 74.409999999999997 112.383 179.921 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 24.4 tt0 -82.55 -21.26 35.41 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.177 -0.465 . . . . 73.129999999999995 110.906 179.991 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -58.22 -34.16 70.11 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.173 -0.467 . . . . 74.120000000000005 110.864 -179.92 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.292 0 C-N-CA 120.755 -0.736 . . . . 73.319999999999993 112.475 -179.957 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 58.5 t . . . . . 0 C--O 1.23 0.066 0 CA-C-O 120.833 0.349 . . . . 73.230000000000004 111.142 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 10.5 ttp -102.08 33.88 2.9 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.167 -0.469 . . . . 73.129999999999995 110.906 179.878 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 5.6 t -86.67 -3.92 59.1 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.198 -0.455 . . . . 75.450000000000003 111.186 -179.944 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . 0.661 ' C ' ' HG3' ' A' ' 19' ' ' PRO . 25.0 t -93.07 3.49 8.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.17 -0.468 . . . . 64.450000000000003 111.094 179.937 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 2.8 mp -142.45 3.71 0.4 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.171 -0.468 . . . . 71.409999999999997 111.121 179.929 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 17' ' ' SER . . . . . 0.801 ' C ' ' HD2' ' A' ' 19' ' ' PRO . 0.5 OUTLIER -99.92 -68.77 0.04 OUTLIER Pre-proline 0 C--N 1.329 -0.303 0 CA-C-O 121.681 0.753 . . . . 63.130000000000003 110.904 -179.951 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 18' ' ' PRO . . . . . 0.895 ' N ' ' HD2' ' A' ' 19' ' ' PRO . 53.7 Cg_endo -69.82 -27.86 25.69 Favored 'Trans proline' 0 C--O 1.231 0.174 0 C-N-CA 122.675 2.25 . . . . 71.510000000000005 112.334 179.963 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 19' ' ' PRO . . . . . 0.895 ' HD2' ' N ' ' A' ' 18' ' ' PRO . 53.7 Cg_endo -69.78 -16.48 37.51 Favored 'Trans proline' 0 C--N 1.341 0.145 0 C-N-CA 122.701 2.267 . . . . 74.040000000000006 112.372 179.938 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 1.5 mt-10 -81.94 -19.89 39.75 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.193 -0.458 . . . . 74.340000000000003 110.911 -179.984 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -58.59 -34.43 71.08 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.119 -0.491 . . . . 75.540000000000006 110.848 -179.91 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.289 0 C-N-CA 120.715 -0.755 . . . . 73.349999999999994 112.529 -179.929 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 23.5 t . . . . . 0 N--CA 1.457 -0.081 0 CA-C-O 120.831 0.348 . . . . 63.520000000000003 111.152 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 10.5 ttp -102.12 33.97 2.88 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.112 -0.494 . . . . 75.219999999999999 110.878 179.937 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 5.7 t -86.68 -4.0 59.12 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.247 -0.433 . . . . 73.310000000000002 111.158 -179.927 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . 0.658 ' C ' ' HG3' ' A' ' 19' ' ' PRO . 25.0 t -92.98 3.43 8.18 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 116.198 -0.455 . . . . 65.109999999999999 111.129 179.932 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 2.8 mp -142.37 3.68 0.41 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.175 -0.466 . . . . 74.439999999999998 111.178 179.95 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 17' ' ' SER . . . . . 0.803 ' C ' ' HD2' ' A' ' 19' ' ' PRO . 0.5 OUTLIER -99.95 -68.81 0.04 OUTLIER Pre-proline 0 C--N 1.33 -0.268 0 CA-C-O 121.615 0.721 . . . . 73.439999999999998 110.846 -179.942 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 18' ' ' PRO . . . . . 0.908 ' N ' ' HD2' ' A' ' 19' ' ' PRO . 54.5 Cg_endo -69.68 -27.88 26.3 Favored 'Trans proline' 0 C--N 1.341 0.166 0 C-N-CA 122.681 2.254 . . . . 74.439999999999998 112.379 179.939 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 19' ' ' PRO . . . . . 0.908 ' HD2' ' N ' ' A' ' 18' ' ' PRO . 53.9 Cg_endo -69.75 -16.57 37.65 Favored 'Trans proline' 0 C--N 1.341 0.151 0 C-N-CA 122.689 2.259 . . . . 62.32 112.378 179.922 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -81.85 -19.91 40.04 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.186 -0.461 . . . . 74.019999999999996 110.906 -179.982 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -58.54 -33.4 69.85 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.14 -0.482 . . . . 74.120000000000005 110.883 -179.933 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.314 0 C-N-CA 120.715 -0.755 . . . . 72.439999999999998 112.516 -179.929 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 61.9 t . . . . . 0 C--O 1.231 0.106 0 CA-C-O 120.801 0.334 . . . . 75.030000000000001 111.102 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 10.3 ttp -101.94 33.76 2.92 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.191 -0.459 . . . . 73.450000000000003 110.906 179.908 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 5.8 t -86.48 -3.93 59.09 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.236 -0.438 . . . . 74.310000000000002 111.177 -179.972 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . 0.645 ' C ' ' HG3' ' A' ' 19' ' ' PRO . 24.1 t -93.85 4.07 8.22 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.207 -0.451 . . . . 75.400000000000006 111.111 179.924 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 2.8 mp -142.49 3.43 0.4 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.225 -0.443 . . . . 74.430000000000007 111.128 179.954 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 17' ' ' SER . . . . . 0.804 ' C ' ' HD2' ' A' ' 19' ' ' PRO . 0.5 OUTLIER -100.24 -68.39 0.04 OUTLIER Pre-proline 0 C--N 1.33 -0.239 0 CA-C-O 121.639 0.733 . . . . 55.229999999999997 110.832 -179.91 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 18' ' ' PRO . . . . . 0.891 ' N ' ' HD2' ' A' ' 19' ' ' PRO . 53.6 Cg_endo -69.73 -27.89 26.07 Favored 'Trans proline' 0 C--N 1.341 0.179 0 C-N-CA 122.746 2.297 . . . . 73.25 112.298 179.994 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 19' ' ' PRO . . . . . 0.891 ' HD2' ' N ' ' A' ' 18' ' ' PRO . 53.4 Cg_endo -69.76 -16.45 37.58 Favored 'Trans proline' 0 C--N 1.342 0.187 0 C-N-CA 122.687 2.258 . . . . 72.25 112.355 179.972 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -81.9 -19.88 39.92 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.235 -0.439 . . . . 71.239999999999995 110.924 179.987 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -58.68 -33.95 70.72 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.123 -0.49 . . . . 73.120000000000005 110.874 -179.928 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.326 0 C-N-CA 120.782 -0.723 . . . . 74.340000000000003 112.469 -179.962 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 57.6 t . . . . . 0 C--O 1.231 0.084 0 CA-C-O 120.762 0.315 . . . . 74.099999999999994 111.122 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 10.3 ttp -102.0 33.75 2.94 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.184 -0.462 . . . . 74.239999999999995 110.86 179.898 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 5.8 t -86.52 -3.89 59.09 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.234 -0.439 . . . . 65.329999999999998 111.136 -179.948 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . 0.662 ' C ' ' HG3' ' A' ' 19' ' ' PRO . 24.3 t -93.88 4.07 8.23 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.232 -0.44 . . . . 72.310000000000002 111.116 179.926 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 2.8 mp -142.44 3.4 0.4 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.188 -0.46 . . . . 75.540000000000006 111.143 179.911 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 17' ' ' SER . . . . . 0.801 ' C ' ' HD2' ' A' ' 19' ' ' PRO . 0.5 OUTLIER -100.2 -68.36 0.04 OUTLIER Pre-proline 0 C--N 1.329 -0.325 0 CA-C-O 121.642 0.734 . . . . 71.310000000000002 110.865 -179.88 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 18' ' ' PRO . . . . . 0.89 ' N ' ' HD2' ' A' ' 19' ' ' PRO . 53.5 Cg_endo -69.82 -27.88 25.62 Favored 'Trans proline' 0 C--N 1.341 0.158 0 C-N-CA 122.678 2.252 . . . . 74.209999999999994 112.323 179.985 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 19' ' ' PRO . . . . . 0.89 ' HD2' ' N ' ' A' ' 18' ' ' PRO . 53.9 Cg_endo -69.74 -16.82 37.81 Favored 'Trans proline' 0 C--N 1.341 0.168 0 C-N-CA 122.73 2.287 . . . . 73.409999999999997 112.323 179.929 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 29.4 tt0 -82.52 -21.29 35.46 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.243 -0.435 . . . . 74.120000000000005 110.887 -179.969 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -58.28 -31.34 67.37 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.144 -0.48 . . . . 74.430000000000007 110.842 -179.884 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.325 0 C-N-CA 120.716 -0.754 . . . . 64.5 112.52 -179.945 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 60.8 t . . . . . 0 C--O 1.231 0.083 0 CA-C-O 120.81 0.338 . . . . 74.150000000000006 111.077 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 10.4 ttp -102.2 34.27 2.79 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.193 -0.458 . . . . 64.430000000000007 110.895 179.923 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 5.6 t -86.85 -4.05 59.13 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.243 -0.435 . . . . 72.140000000000001 111.162 -179.964 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . 0.66 ' C ' ' HG3' ' A' ' 19' ' ' PRO . 24.6 t -93.0 3.45 8.18 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.217 -0.447 . . . . 61.229999999999997 111.09 179.93 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 2.8 mp -142.3 3.63 0.41 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 116.19 -0.459 . . . . 75.299999999999997 111.132 179.942 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 17' ' ' SER . . . . . 0.78 ' C ' ' HD2' ' A' ' 19' ' ' PRO . 0.5 OUTLIER -99.91 -68.8 0.04 OUTLIER Pre-proline 0 C--N 1.329 -0.326 0 CA-C-O 121.618 0.723 . . . . 73.439999999999998 110.869 -179.89 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 18' ' ' PRO . . . . . 0.897 ' N ' ' HD2' ' A' ' 19' ' ' PRO . 53.3 Cg_endo -69.77 -27.91 25.86 Favored 'Trans proline' 0 C--O 1.231 0.168 0 C-N-CA 122.738 2.292 . . . . 72.409999999999997 112.326 179.975 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 19' ' ' PRO . . . . . 0.897 ' HD2' ' N ' ' A' ' 18' ' ' PRO . 54.1 Cg_endo -69.76 -16.24 37.48 Favored 'Trans proline' 0 C--N 1.341 0.181 0 C-N-CA 122.715 2.276 . . . . 72.329999999999998 112.335 179.956 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 1.8 mt-10 -82.12 -19.74 39.45 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.221 -0.445 . . . . 74.299999999999997 110.891 -179.973 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -59.39 -25.6 64.41 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.167 -0.469 . . . . 75.200000000000003 110.88 -179.891 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.45 -0.368 0 C-N-CA 120.771 -0.728 . . . . 74.120000000000005 112.513 -179.985 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 47.5 t . . . . . 0 N--CA 1.457 -0.077 0 CA-C-O 120.835 0.35 . . . . 73.129999999999995 111.092 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 10.4 ttp -102.01 33.9 2.89 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.163 -0.471 . . . . 73.140000000000001 110.92 179.903 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 5.6 t -86.71 -3.91 59.11 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.206 -0.452 . . . . 73.349999999999994 111.175 -179.913 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . 0.651 ' C ' ' HG3' ' A' ' 19' ' ' PRO . 24.7 t -93.04 3.44 8.21 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.194 -0.457 . . . . 74.099999999999994 111.155 179.866 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 2.8 mp -142.31 3.67 0.41 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.17 -0.468 . . . . 71.140000000000001 111.138 179.89 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 17' ' ' SER . . . . . 0.784 ' C ' ' HD2' ' A' ' 19' ' ' PRO . 0.5 OUTLIER -99.91 -68.78 0.04 OUTLIER Pre-proline 0 C--N 1.33 -0.274 0 CA-C-O 121.664 0.745 . . . . 74.219999999999999 110.848 -179.889 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 18' ' ' PRO . . . . . 0.892 ' N ' ' HD2' ' A' ' 19' ' ' PRO . 53.6 Cg_endo -69.75 -27.95 25.91 Favored 'Trans proline' 0 C--N 1.341 0.167 0 C-N-CA 122.752 2.301 . . . . 73.439999999999998 112.335 179.974 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 19' ' ' PRO . . . . . 0.892 ' HD2' ' N ' ' A' ' 18' ' ' PRO . 53.7 Cg_endo -69.81 -16.71 37.48 Favored 'Trans proline' 0 C--N 1.342 0.188 0 C-N-CA 122.66 2.24 . . . . 75.439999999999998 112.361 179.939 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 60.2 tt0 -82.63 -21.28 35.13 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.216 -0.447 . . . . 74.109999999999999 110.854 179.994 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -58.19 -34.24 70.15 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.223 -0.444 . . . . 74.450000000000003 110.83 -179.876 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.271 0 C-N-CA 120.754 -0.736 . . . . 72.049999999999997 112.465 -179.953 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 53.4 t . . . . . 0 C--O 1.23 0.064 0 CA-C-O 120.825 0.345 . . . . 73.329999999999998 111.135 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 10.5 ttp -101.68 33.22 3.06 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.171 -0.468 . . . . 73.099999999999994 110.9 179.887 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 5.7 t -85.92 -4.01 59.06 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.223 -0.444 . . . . 75.439999999999998 111.14 -179.94 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . 0.655 ' C ' ' HG3' ' A' ' 19' ' ' PRO . 24.5 t -93.78 4.77 7.76 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.229 -0.441 . . . . 73.120000000000005 111.13 179.966 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 9.7 mt -143.49 3.2 0.34 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.156 -0.474 . . . . 71.329999999999998 111.097 179.927 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 17' ' ' SER . . . . . 0.784 ' C ' ' HD2' ' A' ' 19' ' ' PRO . 0.5 OUTLIER -100.27 -68.42 0.04 OUTLIER Pre-proline 0 C--N 1.329 -0.291 0 CA-C-O 121.674 0.749 . . . . 73.349999999999994 110.839 -179.911 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 18' ' ' PRO . . . . . 0.89 ' N ' ' HD2' ' A' ' 19' ' ' PRO . 54.4 Cg_endo -69.71 -27.88 26.17 Favored 'Trans proline' 0 C--O 1.232 0.184 0 C-N-CA 122.683 2.255 . . . . 73.439999999999998 112.373 179.933 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 19' ' ' PRO . . . . . 0.89 ' HD2' ' N ' ' A' ' 18' ' ' PRO . 54.4 Cg_endo -69.72 -16.43 37.74 Favored 'Trans proline' 0 C--N 1.341 0.149 0 C-N-CA 122.693 2.262 . . . . 72.099999999999994 112.38 179.906 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 2.9 mt-10 -81.91 -19.92 39.83 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.194 -0.457 . . . . 75.019999999999996 110.901 -179.998 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -58.61 -34.4 71.09 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.127 -0.488 . . . . 73.230000000000004 110.914 -179.916 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.266 0 C-N-CA 120.766 -0.731 . . . . 45.149999999999999 112.472 -179.981 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 26.0 t . . . . . 0 C--O 1.231 0.117 0 CA-C-O 120.767 0.318 . . . . 73.129999999999995 111.086 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 10.6 ttp -101.93 33.43 3.04 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.215 -0.448 . . . . 75.120000000000005 110.894 179.901 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 5.5 t -86.12 -4.04 59.08 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.194 -0.457 . . . . 74.530000000000001 111.139 -179.94 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . 0.635 ' C ' ' HG3' ' A' ' 19' ' ' PRO . 25.8 t -92.89 4.15 7.66 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-N 116.228 -0.442 . . . . 64.329999999999998 111.113 179.901 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 9.3 mt -143.34 3.4 0.35 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.195 -0.457 . . . . 73.239999999999995 111.102 179.901 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 17' ' ' SER . . . . . 0.79 ' C ' ' HD2' ' A' ' 19' ' ' PRO . 0.5 OUTLIER -99.9 -68.75 0.04 OUTLIER Pre-proline 0 C--N 1.329 -0.295 0 CA-C-O 121.683 0.754 . . . . 74.439999999999998 110.882 -179.94 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 18' ' ' PRO . . . . . 0.909 ' N ' ' HD2' ' A' ' 19' ' ' PRO . 53.3 Cg_endo -69.83 -27.79 25.72 Favored 'Trans proline' 0 C--N 1.341 0.168 0 C-N-CA 122.673 2.248 . . . . 74.230000000000004 112.333 179.994 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 19' ' ' PRO . . . . . 0.909 ' HD2' ' N ' ' A' ' 18' ' ' PRO . 53.3 Cg_endo -69.82 -16.43 37.3 Favored 'Trans proline' 0 C--N 1.342 0.193 0 C-N-CA 122.683 2.255 . . . . 72.420000000000002 112.301 179.957 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -81.91 -19.55 40.57 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.267 -0.424 . . . . 74.420000000000002 110.872 -179.965 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -59.78 -25.77 65.18 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.144 -0.48 . . . . 73.329999999999998 110.827 -179.887 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.299 0 C-N-CA 120.75 -0.738 . . . . 62.439999999999998 112.527 -179.991 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 56.4 t . . . . . 0 C--O 1.23 0.051 0 CA-C-O 120.826 0.346 . . . . 74.349999999999994 111.154 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 10.4 ttp -102.23 33.7 3.0 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.117 -0.492 . . . . 74.129999999999995 110.883 179.931 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 5.8 t -86.49 -3.89 59.08 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.203 -0.453 . . . . 73.340000000000003 111.153 -179.912 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . 0.662 ' C ' ' HG3' ' A' ' 19' ' ' PRO . 24.0 t -93.88 4.07 8.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.186 -0.461 . . . . 71.109999999999999 111.131 179.928 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 2.8 mp -142.47 3.41 0.4 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.172 -0.467 . . . . 74.310000000000002 111.176 179.898 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 17' ' ' SER . . . . . 0.793 ' C ' ' HD2' ' A' ' 19' ' ' PRO . 0.5 OUTLIER -100.16 -68.48 0.04 OUTLIER Pre-proline 0 C--N 1.328 -0.33 0 CA-C-O 121.654 0.74 . . . . 73.209999999999994 110.877 -179.941 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 18' ' ' PRO . . . . . 0.89 ' N ' ' HD2' ' A' ' 19' ' ' PRO . 53.6 Cg_endo -69.74 -27.84 26.09 Favored 'Trans proline' 0 C--N 1.341 0.178 0 C-N-CA 122.701 2.268 . . . . 74.109999999999999 112.344 179.987 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 19' ' ' PRO . . . . . 0.89 ' HD2' ' N ' ' A' ' 18' ' ' PRO . 53.5 Cg_endo -69.77 -16.5 37.55 Favored 'Trans proline' 0 C--N 1.342 0.216 0 C-N-CA 122.685 2.257 . . . . 74.400000000000006 112.339 179.943 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -81.85 -19.85 40.16 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.222 -0.444 . . . . 74.099999999999994 110.908 179.999 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -58.65 -34.52 71.29 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.172 -0.467 . . . . 74.129999999999995 110.832 -179.9 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.352 0 C-N-CA 120.744 -0.741 . . . . 70.109999999999999 112.506 -179.946 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 21.9 t . . . . . 0 N--CA 1.457 -0.086 0 CA-C-O 120.823 0.344 . . . . 71.299999999999997 111.149 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 10.5 ttp -102.21 33.85 2.94 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.182 -0.463 . . . . 64.420000000000002 110.856 179.939 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 5.6 t -86.62 -3.98 59.11 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.23 -0.441 . . . . 73.209999999999994 111.145 -179.939 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . 0.652 ' C ' ' HG3' ' A' ' 19' ' ' PRO . 25.3 t -93.01 3.47 8.17 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.201 -0.454 . . . . 74.010000000000005 111.143 179.912 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 2.8 mp -142.39 3.68 0.41 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.139 -0.482 . . . . 74.540000000000006 111.127 179.913 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 17' ' ' SER . . . . . 0.789 ' C ' ' HD2' ' A' ' 19' ' ' PRO . 0.5 OUTLIER -99.9 -68.78 0.04 OUTLIER Pre-proline 0 C--N 1.329 -0.287 0 CA-C-O 121.678 0.751 . . . . 62.420000000000002 110.831 -179.906 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 18' ' ' PRO . . . . . 0.903 ' N ' ' HD2' ' A' ' 19' ' ' PRO . 54.0 Cg_endo -69.78 -27.88 25.86 Favored 'Trans proline' 0 C--O 1.232 0.182 0 C-N-CA 122.664 2.243 . . . . 73.439999999999998 112.361 179.982 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 19' ' ' PRO . . . . . 0.903 ' HD2' ' N ' ' A' ' 18' ' ' PRO . 53.6 Cg_endo -69.82 -16.38 37.3 Favored 'Trans proline' 0 C--N 1.341 0.155 0 C-N-CA 122.713 2.275 . . . . 72.129999999999995 112.322 179.964 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -82.01 -19.85 39.63 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.248 -0.433 . . . . 75.319999999999993 110.868 -179.977 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -58.66 -34.36 71.14 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.12 -0.491 . . . . 74.439999999999998 110.832 -179.88 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.45 -0.367 0 C-N-CA 120.696 -0.764 . . . . 73.010000000000005 112.529 -179.97 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 25.9 t . . . . . 0 C--O 1.23 0.056 0 CA-C-O 120.862 0.363 . . . . 74.430000000000007 111.127 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 10.5 ttp -102.22 33.93 2.92 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.146 -0.479 . . . . 75.540000000000006 110.878 179.959 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 5.7 t -86.7 -3.91 59.11 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.213 -0.449 . . . . 71.109999999999999 111.118 -179.897 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . 0.661 ' C ' ' HG3' ' A' ' 19' ' ' PRO . 25.1 t -93.06 3.48 8.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.233 -0.44 . . . . 71.150000000000006 111.171 179.884 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 2.8 mp -142.36 3.63 0.41 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.108 -0.497 . . . . 73.439999999999998 111.128 179.912 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 17' ' ' SER . . . . . 0.788 ' C ' ' HD2' ' A' ' 19' ' ' PRO . 0.5 OUTLIER -99.89 -68.8 0.04 OUTLIER Pre-proline 0 C--N 1.329 -0.287 0 CA-C-O 121.631 0.729 . . . . 71.349999999999994 110.874 -179.914 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 18' ' ' PRO . . . . . 0.893 ' N ' ' HD2' ' A' ' 19' ' ' PRO . 53.9 Cg_endo -69.75 -27.88 25.99 Favored 'Trans proline' 0 C--N 1.341 0.175 0 C-N-CA 122.672 2.248 . . . . 73.510000000000005 112.387 179.952 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 19' ' ' PRO . . . . . 0.893 ' HD2' ' N ' ' A' ' 18' ' ' PRO . 53.4 Cg_endo -69.79 -16.43 37.44 Favored 'Trans proline' 0 C--N 1.342 0.203 0 C-N-CA 122.686 2.258 . . . . 54.420000000000002 112.323 179.97 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -81.95 -19.83 39.85 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.228 -0.442 . . . . 72.140000000000001 110.893 -179.991 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -58.65 -32.52 69.15 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.145 -0.479 . . . . 74.219999999999999 110.904 -179.919 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.312 0 C-N-CA 120.771 -0.728 . . . . 73.25 112.494 -179.94 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 39.7 t . . . . . 0 C--O 1.231 0.08 0 CA-C-O 120.812 0.339 . . . . 73.209999999999994 111.139 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 10.4 ttp -102.0 33.98 2.86 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.174 -0.466 . . . . 62.039999999999999 110.871 179.939 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 5.8 t -86.64 -3.87 59.09 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.258 -0.428 . . . . 73.099999999999994 111.108 -179.896 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . 0.657 ' C ' ' HG3' ' A' ' 19' ' ' PRO . 24.7 t -93.77 3.97 8.23 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.23 -0.441 . . . . 75.219999999999999 111.141 179.885 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 2.8 mp -142.52 3.49 0.4 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.183 -0.462 . . . . 75.040000000000006 111.099 179.922 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 17' ' ' SER . . . . . 0.791 ' C ' ' HD2' ' A' ' 19' ' ' PRO . 0.5 OUTLIER -100.25 -68.42 0.04 OUTLIER Pre-proline 0 C--N 1.329 -0.305 0 CA-C-O 121.656 0.741 . . . . 74.030000000000001 110.85 -179.923 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 18' ' ' PRO . . . . . 0.908 ' N ' ' HD2' ' A' ' 19' ' ' PRO . 53.7 Cg_endo -69.76 -27.81 26.01 Favored 'Trans proline' 0 C--N 1.342 0.199 0 C-N-CA 122.612 2.208 . . . . 72.319999999999993 112.363 179.97 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 19' ' ' PRO . . . . . 0.908 ' HD2' ' N ' ' A' ' 18' ' ' PRO . 53.8 Cg_endo -69.74 -16.52 37.68 Favored 'Trans proline' 0 C--N 1.341 0.156 0 C-N-CA 122.699 2.266 . . . . 75.019999999999996 112.326 179.948 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 2.1 mt-10 -81.88 -19.94 39.86 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.216 -0.447 . . . . 73.319999999999993 110.907 -179.975 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -58.56 -33.13 69.59 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.145 -0.479 . . . . 73.200000000000003 110.858 -179.908 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.286 0 C-N-CA 120.725 -0.75 . . . . 63.32 112.489 -179.964 . . . . . . . . 0 0 . 1 . 021 nuclear orig core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 56.4 t . . . . . 0 C--O 1.231 0.091 0 CA-C-O 120.84 0.352 . . . . 74.310000000000002 111.146 . . . . . . . . . 0 0 . 1 . 021 nuclear orig core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 10.6 ttp -101.91 33.43 3.03 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.124 -0.489 . . . . 73.400000000000006 110.906 179.906 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 5.5 t -86.15 -4.04 59.08 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.178 -0.465 . . . . 65.25 111.099 -179.908 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . 0.639 ' C ' ' HG3' ' A' ' 19' ' ' PRO . 25.5 t -92.91 4.11 7.7 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.262 -0.426 . . . . 73.349999999999994 111.095 179.948 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 9.4 mt -143.28 3.37 0.35 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.196 -0.456 . . . . 65.120000000000005 111.172 179.913 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 17' ' ' SER . . . . . 0.786 ' C ' ' HD2' ' A' ' 19' ' ' PRO . 0.5 OUTLIER -99.98 -68.78 0.04 OUTLIER Pre-proline 0 C--N 1.33 -0.274 0 CA-C-O 121.633 0.73 . . . . 74.329999999999998 110.825 -179.843 . . . . . . . . 3 3 . 1 . 021 nuclear orig core ' A' A ' 18' ' ' PRO . . . . . 0.906 ' N ' ' HD2' ' A' ' 19' ' ' PRO . 53.6 Cg_endo -69.79 -27.83 25.87 Favored 'Trans proline' 0 C--O 1.231 0.171 0 C-N-CA 122.72 2.28 . . . . 71.549999999999997 112.339 179.96 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 19' ' ' PRO . . . . . 0.906 ' HD2' ' N ' ' A' ' 18' ' ' PRO . 53.9 Cg_endo -69.75 -16.47 37.61 Favored 'Trans proline' 0 C--N 1.341 0.137 0 C-N-CA 122.697 2.265 . . . . 75.230000000000004 112.341 179.917 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -82.0 -19.39 40.6 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.249 -0.432 . . . . 75.239999999999995 110.866 -179.952 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -59.69 -25.7 64.98 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.168 -0.469 . . . . 74.310000000000002 110.866 -179.936 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.315 0 C-N-CA 120.718 -0.753 . . . . 71.299999999999997 112.502 -179.983 . . . . . . . . 0 0 . 1 . 022 nuclear orig core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 37.7 t . . . . . 0 C--O 1.231 0.096 0 CA-C-O 120.816 0.341 . . . . 63.229999999999997 111.145 . . . . . . . . . 0 0 . 1 . 022 nuclear orig core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 10.4 ttp -102.11 33.91 2.9 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.186 -0.461 . . . . 71.120000000000005 110.868 179.944 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 5.6 t -86.65 -3.94 59.11 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.224 -0.443 . . . . 71.25 111.156 -179.922 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . 0.65 ' C ' ' HG3' ' A' ' 19' ' ' PRO . 25.2 t -93.01 3.45 8.18 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-N 116.206 -0.452 . . . . 74.430000000000007 111.147 179.912 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 2.8 mp -142.35 3.61 0.41 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.161 -0.472 . . . . 74.409999999999997 111.159 179.964 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 17' ' ' SER . . . . . 0.777 ' C ' ' HD2' ' A' ' 19' ' ' PRO . 0.5 OUTLIER -99.92 -68.74 0.04 OUTLIER Pre-proline 0 C--N 1.329 -0.302 0 CA-C-O 121.673 0.749 . . . . 73.120000000000005 110.885 -179.882 . . . . . . . . 3 3 . 1 . 022 nuclear orig core ' A' A ' 18' ' ' PRO . . . . . 0.909 ' N ' ' HD2' ' A' ' 19' ' ' PRO . 53.4 Cg_endo -69.85 -27.88 25.51 Favored 'Trans proline' 0 C--O 1.232 0.188 0 C-N-CA 122.681 2.254 . . . . 73.310000000000002 112.345 179.965 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 19' ' ' PRO . . . . . 0.909 ' HD2' ' N ' ' A' ' 18' ' ' PRO . 54.1 Cg_endo -69.68 -16.47 37.91 Favored 'Trans proline' 0 C--N 1.341 0.169 0 C-N-CA 122.693 2.262 . . . . 74.530000000000001 112.377 179.871 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -82.03 -19.45 40.36 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.215 -0.448 . . . . 64.319999999999993 110.907 -179.957 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -59.63 -25.74 64.92 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.182 -0.463 . . . . 72.230000000000004 110.892 -179.988 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.307 0 C-N-CA 120.75 -0.738 . . . . 71.310000000000002 112.486 -179.932 . . . . . . . . 0 0 . 1 . 023 nuclear orig core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 41.9 t . . . . . 0 C--O 1.231 0.117 0 CA-C-O 120.848 0.356 . . . . 75.209999999999994 111.141 . . . . . . . . . 0 0 . 1 . 023 nuclear orig core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 10.5 ttp -101.95 33.39 3.06 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.185 -0.461 . . . . 72.430000000000007 110.91 179.873 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 5.5 t -86.17 -4.02 59.08 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.214 -0.448 . . . . 65.200000000000003 111.139 -179.925 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . 0.636 ' C ' ' HG3' ' A' ' 19' ' ' PRO . 25.4 t -92.85 4.15 7.63 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.208 -0.451 . . . . 74.329999999999998 111.167 179.87 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 9.4 mt -143.33 3.32 0.35 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.18 -0.463 . . . . 74.129999999999995 111.121 179.927 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 17' ' ' SER . . . . . 0.796 ' C ' ' HD2' ' A' ' 19' ' ' PRO . 0.5 OUTLIER -99.89 -68.72 0.04 OUTLIER Pre-proline 0 C--N 1.329 -0.31 0 CA-C-O 121.624 0.726 . . . . 62.530000000000001 110.882 -179.943 . . . . . . . . 3 3 . 1 . 023 nuclear orig core ' A' A ' 18' ' ' PRO . . . . . 0.91 ' N ' ' HD2' ' A' ' 19' ' ' PRO . 53.2 Cg_endo -69.8 -27.86 25.76 Favored 'Trans proline' 0 C--O 1.232 0.178 0 C-N-CA 122.681 2.254 . . . . 75.219999999999999 112.32 -179.996 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 19' ' ' PRO . . . . . 0.91 ' HD2' ' N ' ' A' ' 18' ' ' PRO . 54.1 Cg_endo -69.73 -16.49 37.71 Favored 'Trans proline' 0 C--N 1.342 0.203 0 C-N-CA 122.732 2.288 . . . . 73.209999999999994 112.346 179.964 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -81.87 -19.92 39.94 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.195 -0.457 . . . . 71.510000000000005 110.902 -179.97 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -58.52 -33.37 69.77 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.129 -0.487 . . . . 71.0 110.871 -179.913 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.337 0 C-N-CA 120.782 -0.723 . . . . 72.219999999999999 112.49 -179.943 . . . . . . . . 0 0 . 1 . 024 nuclear orig core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 38.4 t . . . . . 0 C--O 1.231 0.106 0 CA-C-O 120.852 0.358 . . . . 75.519999999999996 111.163 . . . . . . . . . 0 0 . 1 . 024 nuclear orig core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 10.4 ttp -102.0 33.84 2.9 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.18 -0.464 . . . . 74.340000000000003 110.861 179.902 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 5.8 t -86.52 -3.89 59.09 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.225 -0.443 . . . . 73.120000000000005 111.211 -179.986 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . 0.652 ' C ' ' HG3' ' A' ' 19' ' ' PRO . 24.1 t -93.85 4.04 8.24 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.183 -0.462 . . . . 70.120000000000005 111.1 179.933 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 2.8 mp -142.52 3.43 0.4 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-N 116.168 -0.469 . . . . 75.219999999999999 111.153 179.94 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 17' ' ' SER . . . . . 0.788 ' C ' ' HD2' ' A' ' 19' ' ' PRO . 0.5 OUTLIER -100.19 -68.42 0.04 OUTLIER Pre-proline 0 C--N 1.329 -0.307 0 CA-C-O 121.615 0.721 . . . . 75.099999999999994 110.85 -179.951 . . . . . . . . 3 3 . 1 . 024 nuclear orig core ' A' A ' 18' ' ' PRO . . . . . 0.9 ' N ' ' HD2' ' A' ' 19' ' ' PRO . 53.9 Cg_endo -69.77 -27.81 25.97 Favored 'Trans proline' 0 C--O 1.232 0.19 0 C-N-CA 122.624 2.216 . . . . 45.0 112.352 179.975 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 19' ' ' PRO . . . . . 0.9 ' HD2' ' N ' ' A' ' 18' ' ' PRO . 53.8 Cg_endo -69.77 -16.49 37.54 Favored 'Trans proline' 0 C--N 1.341 0.166 0 C-N-CA 122.714 2.276 . . . . 72.409999999999997 112.334 179.975 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -81.88 -19.9 39.97 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.203 -0.453 . . . . 70.430000000000007 110.889 -179.987 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -58.67 -34.71 71.54 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.168 -0.469 . . . . 74.049999999999997 110.855 -179.875 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.302 0 C-N-CA 120.696 -0.764 . . . . 73.530000000000001 112.485 179.984 . . . . . . . . 0 0 . 1 . 025 nuclear orig core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 36.1 t . . . . . 0 C--O 1.231 0.114 0 CA-C-O 120.804 0.335 . . . . 72.329999999999998 111.128 . . . . . . . . . 0 0 . 1 . 025 nuclear orig core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 10.5 ttp -102.46 33.89 2.98 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.187 -0.461 . . . . 71.239999999999995 110.862 179.916 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 5.6 t -86.68 -3.97 59.11 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.262 -0.426 . . . . 73.340000000000003 111.145 -179.925 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . 0.659 ' C ' ' HG3' ' A' ' 19' ' ' PRO . 25.1 t -93.03 3.47 8.18 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-N 116.221 -0.445 . . . . 75.310000000000002 111.122 179.895 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 2.8 mp -142.36 3.72 0.41 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.184 -0.462 . . . . 72.319999999999993 111.132 179.865 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 17' ' ' SER . . . . . 0.799 ' C ' ' HD2' ' A' ' 19' ' ' PRO . 0.5 OUTLIER -99.93 -68.82 0.04 OUTLIER Pre-proline 0 C--N 1.329 -0.294 0 CA-C-O 121.697 0.761 . . . . 73.450000000000003 110.83 -179.897 . . . . . . . . 3 3 . 1 . 025 nuclear orig core ' A' A ' 18' ' ' PRO . . . . . 0.905 ' N ' ' HD2' ' A' ' 19' ' ' PRO . 54.2 Cg_endo -69.7 -27.94 26.14 Favored 'Trans proline' 0 C--O 1.232 0.181 0 C-N-CA 122.7 2.267 . . . . 73.299999999999997 112.358 179.954 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 19' ' ' PRO . . . . . 0.905 ' HD2' ' N ' ' A' ' 18' ' ' PRO . 53.5 Cg_endo -69.77 -16.43 37.51 Favored 'Trans proline' 0 C--N 1.342 0.213 0 C-N-CA 122.664 2.243 . . . . 73.209999999999994 112.38 179.961 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -81.93 -19.86 39.87 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.171 -0.468 . . . . 74.129999999999995 110.911 179.977 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -58.6 -33.16 69.68 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.131 -0.486 . . . . 74.340000000000003 110.876 -179.92 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.279 0 C-N-CA 120.74 -0.743 . . . . 72.120000000000005 112.46 -179.947 . . . . . . . . 0 0 . 1 . 026 nuclear orig core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 61.5 t . . . . . 0 C--O 1.231 0.113 0 CA-C-O 120.84 0.352 . . . . 73.400000000000006 111.115 . . . . . . . . . 0 0 . 1 . 026 nuclear orig core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 10.6 ttp -102.06 33.4 3.07 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.152 -0.476 . . . . 73.120000000000005 110.862 179.932 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 5.6 t -86.17 -3.99 59.08 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.23 -0.441 . . . . 71.420000000000002 111.148 -179.937 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . 0.637 ' C ' ' HG3' ' A' ' 19' ' ' PRO . 25.3 t -92.89 4.12 7.68 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-N 116.221 -0.445 . . . . 72.319999999999993 111.158 179.853 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 9.6 mt -143.29 3.34 0.35 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.206 -0.452 . . . . 74.109999999999999 111.153 179.898 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 17' ' ' SER . . . . . 0.791 ' C ' ' HD2' ' A' ' 19' ' ' PRO . 0.5 OUTLIER -99.82 -68.77 0.04 OUTLIER Pre-proline 0 C--N 1.33 -0.277 0 CA-C-O 121.694 0.759 . . . . 72.299999999999997 110.849 -179.929 . . . . . . . . 3 3 . 1 . 026 nuclear orig core ' A' A ' 18' ' ' PRO . . . . . 0.89 ' N ' ' HD2' ' A' ' 19' ' ' PRO . 53.7 Cg_endo -69.77 -27.93 25.82 Favored 'Trans proline' 0 C--N 1.342 0.185 0 C-N-CA 122.66 2.24 . . . . 65.439999999999998 112.337 -179.992 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 19' ' ' PRO . . . . . 0.89 ' HD2' ' N ' ' A' ' 18' ' ' PRO . 54.1 Cg_endo -69.75 -16.8 37.77 Favored 'Trans proline' 0 C--N 1.341 0.184 0 C-N-CA 122.643 2.229 . . . . 74.519999999999996 112.354 179.937 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 21.3 tt0 -82.5 -21.29 35.53 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.222 -0.445 . . . . 74.299999999999997 110.903 179.981 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -58.27 -33.21 69.17 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.201 -0.454 . . . . 74.549999999999997 110.854 -179.913 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.317 0 C-N-CA 120.693 -0.765 . . . . 72.219999999999999 112.527 -179.953 . . . . . . . . 0 0 . 1 . 027 nuclear orig core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 58.8 t . . . . . 0 N--CA 1.458 -0.058 0 CA-C-O 120.828 0.347 . . . . 75.319999999999993 111.139 . . . . . . . . . 0 0 . 1 . 027 nuclear orig core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 9.4 ttp -102.26 32.83 3.34 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.162 -0.472 . . . . 64.430000000000007 110.851 179.927 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 5.9 t -86.82 -3.74 59.1 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.212 -0.449 . . . . 64.329999999999998 111.149 -179.974 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . 0.659 ' C ' ' HG3' ' A' ' 19' ' ' PRO . 23.0 t -94.26 4.65 8.09 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.228 -0.442 . . . . 73.540000000000006 111.12 179.867 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 2.8 mp -142.54 3.36 0.4 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.326 0 CA-C-N 116.173 -0.467 . . . . 74.239999999999995 111.122 179.894 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 17' ' ' SER . . . . . 0.793 ' C ' ' HD2' ' A' ' 19' ' ' PRO . 0.5 OUTLIER -100.32 -68.38 0.04 OUTLIER Pre-proline 0 C--N 1.329 -0.323 0 CA-C-O 121.739 0.78 . . . . 73.219999999999999 110.836 -179.911 . . . . . . . . 3 3 . 1 . 027 nuclear orig core ' A' A ' 18' ' ' PRO . . . . . 0.9 ' N ' ' HD2' ' A' ' 19' ' ' PRO . 54.2 Cg_endo -69.69 -27.87 26.29 Favored 'Trans proline' 0 C--N 1.342 0.214 0 C-N-CA 122.686 2.258 . . . . 64.25 112.349 179.989 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 19' ' ' PRO . . . . . 0.9 ' HD2' ' N ' ' A' ' 18' ' ' PRO . 53.7 Cg_endo -69.79 -16.47 37.46 Favored 'Trans proline' 0 C--N 1.342 0.192 0 C-N-CA 122.637 2.225 . . . . 73.200000000000003 112.341 179.989 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -81.87 -19.88 40.01 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.22 -0.446 . . . . 75.540000000000006 110.903 -179.994 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -58.66 -34.05 70.79 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.185 -0.461 . . . . 74.519999999999996 110.868 -179.947 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.303 0 C-N-CA 120.724 -0.751 . . . . 74.230000000000004 112.503 -179.977 . . . . . . . . 0 0 . 1 . 028 nuclear orig core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 23.7 t . . . . . 0 C--O 1.23 0.067 0 CA-C-O 120.851 0.358 . . . . 70.040000000000006 111.16 . . . . . . . . . 0 0 . 1 . 028 nuclear orig core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 10.6 ttp -101.86 33.4 3.03 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.154 -0.475 . . . . 62.25 110.851 179.968 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 5.5 t -86.18 -4.0 59.08 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.217 -0.447 . . . . 72.209999999999994 111.106 -179.923 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . 0.644 ' C ' ' HG3' ' A' ' 19' ' ' PRO . 25.3 t -92.93 4.15 7.68 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.24 -0.436 . . . . 73.219999999999999 111.132 179.911 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 9.4 mt -143.32 3.39 0.35 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.215 -0.448 . . . . 75.310000000000002 111.141 179.888 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 17' ' ' SER . . . . . 0.795 ' C ' ' HD2' ' A' ' 19' ' ' PRO . 0.5 OUTLIER -99.86 -68.8 0.04 OUTLIER Pre-proline 0 C--N 1.329 -0.301 0 CA-C-O 121.686 0.755 . . . . 65.219999999999999 110.863 -179.941 . . . . . . . . 3 3 . 1 . 028 nuclear orig core ' A' A ' 18' ' ' PRO . . . . . 0.896 ' N ' ' HD2' ' A' ' 19' ' ' PRO . 54.2 Cg_endo -69.73 -27.89 26.05 Favored 'Trans proline' 0 C--N 1.342 0.203 0 C-N-CA 122.702 2.268 . . . . 74.010000000000005 112.361 179.953 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 19' ' ' PRO . . . . . 0.896 ' HD2' ' N ' ' A' ' 18' ' ' PRO . 53.7 Cg_endo -69.8 -16.75 37.52 Favored 'Trans proline' 0 C--N 1.341 0.171 0 C-N-CA 122.64 2.227 . . . . 75.150000000000006 112.312 179.956 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 15.1 tp10 -82.51 -21.35 35.49 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.264 -0.425 . . . . 74.439999999999998 110.883 -179.986 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -58.14 -34.48 70.31 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.139 -0.482 . . . . 71.219999999999999 110.876 -179.903 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.348 0 C-N-CA 120.722 -0.751 . . . . 73.430000000000007 112.529 -179.932 . . . . . . . . 0 0 . 1 . 029 nuclear orig core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 21.8 t . . . . . 0 C--O 1.231 0.097 0 CA-C-O 120.85 0.357 . . . . 75.299999999999997 111.131 . . . . . . . . . 0 0 . 1 . 029 nuclear orig core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 10.4 ttp -101.29 33.82 2.77 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.141 -0.481 . . . . 71.239999999999995 110.907 179.927 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 5.6 t -86.67 -3.91 59.1 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.21 -0.45 . . . . 74.549999999999997 111.167 -179.897 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . 0.66 ' C ' ' HG3' ' A' ' 19' ' ' PRO . 25.0 t -93.07 3.49 8.19 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-N 116.149 -0.478 . . . . 70.319999999999993 111.114 179.932 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 2.8 mp -142.34 3.63 0.41 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.212 -0.449 . . . . 71.230000000000004 111.155 179.924 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 17' ' ' SER . . . . . 0.784 ' C ' ' HD2' ' A' ' 19' ' ' PRO . 0.5 OUTLIER -99.89 -68.77 0.04 OUTLIER Pre-proline 0 C--N 1.329 -0.319 0 CA-C-O 121.674 0.75 . . . . 74.239999999999995 110.844 -179.879 . . . . . . . . 3 3 . 1 . 029 nuclear orig core ' A' A ' 18' ' ' PRO . . . . . 0.89 ' N ' ' HD2' ' A' ' 19' ' ' PRO . 53.5 Cg_endo -69.83 -27.9 25.58 Favored 'Trans proline' 0 C--N 1.342 0.191 0 C-N-CA 122.645 2.23 . . . . 71.140000000000001 112.325 -179.982 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 19' ' ' PRO . . . . . 0.89 ' HD2' ' N ' ' A' ' 18' ' ' PRO . 54.2 Cg_endo -69.74 -16.81 37.81 Favored 'Trans proline' 0 C--N 1.342 0.195 0 C-N-CA 122.72 2.28 . . . . 72.430000000000007 112.346 179.903 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 25.6 tt0 -82.59 -21.24 35.28 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.205 -0.452 . . . . 74.129999999999995 110.867 -179.94 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -58.1 -32.86 68.49 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.154 -0.476 . . . . 74.120000000000005 110.872 -179.913 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.303 0 C-N-CA 120.72 -0.752 . . . . 73.349999999999994 112.462 179.978 . . . . . . . . 0 0 . 1 . 030 nuclear orig core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 57.7 t . . . . . 0 C--O 1.231 0.092 0 CA-C-O 120.8 0.333 . . . . 71.200000000000003 111.115 . . . . . . . . . 0 0 . 1 . 030 nuclear orig core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 10.6 ttp -101.97 33.38 3.06 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.182 -0.463 . . . . 72.319999999999993 110.83 179.962 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 5.5 t -86.18 -4.0 59.08 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.261 -0.427 . . . . 72.219999999999999 111.139 -179.941 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . 0.652 ' C ' ' HG3' ' A' ' 19' ' ' PRO . 25.4 t -92.95 4.18 7.67 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.22 -0.446 . . . . 75.329999999999998 111.134 179.904 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 9.5 mt -143.3 3.31 0.35 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.186 -0.461 . . . . 74.519999999999996 111.164 179.926 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 17' ' ' SER . . . . . 0.803 ' C ' ' HD2' ' A' ' 19' ' ' PRO . 0.5 OUTLIER -99.9 -68.73 0.04 OUTLIER Pre-proline 0 C--N 1.33 -0.278 0 CA-C-O 121.612 0.72 . . . . 64.420000000000002 110.866 -179.919 . . . . . . . . 3 3 . 1 . 030 nuclear orig core ' A' A ' 18' ' ' PRO . . . . . 0.898 ' N ' ' HD2' ' A' ' 19' ' ' PRO . 53.5 Cg_endo -69.75 -27.97 25.88 Favored 'Trans proline' 0 C--N 1.341 0.157 0 C-N-CA 122.721 2.281 . . . . 71.420000000000002 112.32 179.988 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 19' ' ' PRO . . . . . 0.898 ' HD2' ' N ' ' A' ' 18' ' ' PRO . 53.8 Cg_endo -69.72 -16.75 37.87 Favored 'Trans proline' 0 C--N 1.342 0.201 0 C-N-CA 122.684 2.256 . . . . 74.049999999999997 112.389 179.935 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 57.6 tt0 -82.53 -21.34 35.43 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.197 -0.456 . . . . 74.299999999999997 110.936 179.988 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -58.17 -34.42 70.29 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.103 -0.499 . . . . 73.319999999999993 110.926 -179.934 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.342 0 C-N-CA 120.727 -0.749 . . . . 73.200000000000003 112.478 179.988 . . . . . . . . 0 0 . 1 . 031 nuclear orig core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 60.6 t . . . . . 0 C--O 1.231 0.102 0 CA-C-O 120.866 0.365 . . . . 75.129999999999995 111.118 . . . . . . . . . 0 0 . 1 . 031 nuclear orig core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 10.6 ttp -101.97 33.38 3.06 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.182 -0.463 . . . . 74.409999999999997 110.876 179.929 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 5.5 t -86.11 -4.03 59.08 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.215 -0.448 . . . . 73.420000000000002 111.137 -179.921 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . 0.647 ' C ' ' HG3' ' A' ' 19' ' ' PRO . 25.4 t -92.91 4.14 7.68 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.183 -0.462 . . . . 74.019999999999996 111.122 179.937 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 9.5 mt -143.28 3.34 0.35 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.178 -0.465 . . . . 74.310000000000002 111.169 179.911 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 17' ' ' SER . . . . . 0.788 ' C ' ' HD2' ' A' ' 19' ' ' PRO . 0.5 OUTLIER -99.86 -68.81 0.04 OUTLIER Pre-proline 0 C--N 1.329 -0.297 0 CA-C-O 121.696 0.76 . . . . 70.209999999999994 110.895 -179.92 . . . . . . . . 3 3 . 1 . 031 nuclear orig core ' A' A ' 18' ' ' PRO . . . . . 0.894 ' N ' ' HD2' ' A' ' 19' ' ' PRO . 54.0 Cg_endo -69.75 -27.88 25.99 Favored 'Trans proline' 0 C--N 1.342 0.213 0 C-N-CA 122.684 2.256 . . . . 75.099999999999994 112.329 179.971 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' A' A ' 19' ' ' PRO . . . . . 0.894 ' HD2' ' N ' ' A' ' 18' ' ' PRO . 53.9 Cg_endo -69.72 -16.49 37.73 Favored 'Trans proline' 0 C--N 1.341 0.153 0 C-N-CA 122.69 2.26 . . . . 73.439999999999998 112.315 179.966 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -81.92 -19.44 40.77 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.261 -0.427 . . . . 72.109999999999999 110.909 -179.966 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -59.7 -25.74 65.02 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.13 -0.486 . . . . 74.310000000000002 110.852 -179.902 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.325 0 C-N-CA 120.699 -0.762 . . . . 61.32 112.51 -179.993 . . . . . . . . 0 0 . 1 . 032 nuclear orig core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 58.3 t . . . . . 0 C--O 1.231 0.083 0 CA-C-O 120.822 0.344 . . . . 75.019999999999996 111.109 . . . . . . . . . 0 0 . 1 . 032 nuclear orig core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 10.4 ttp -102.49 33.9 2.98 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.181 -0.463 . . . . 73.150000000000006 110.895 179.954 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 5.6 t -86.65 -3.96 59.11 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.199 -0.455 . . . . 73.140000000000001 111.182 -179.973 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . 0.661 ' C ' ' HG3' ' A' ' 19' ' ' PRO . 24.9 t -93.0 3.49 8.15 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.203 -0.453 . . . . 72.299999999999997 111.129 179.879 . . . . . . . . 2 2 . 1 . 032 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 2.8 mp -142.38 3.61 0.41 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.19 -0.459 . . . . 73.450000000000003 111.146 179.918 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 17' ' ' SER . . . . . 0.79 ' C ' ' HD2' ' A' ' 19' ' ' PRO . 0.5 OUTLIER -99.85 -68.79 0.04 OUTLIER Pre-proline 0 C--N 1.329 -0.284 0 CA-C-O 121.674 0.75 . . . . 74.530000000000001 110.868 -179.94 . . . . . . . . 3 3 . 1 . 032 nuclear orig core ' A' A ' 18' ' ' PRO . . . . . 0.903 ' N ' ' HD2' ' A' ' 19' ' ' PRO . 53.7 Cg_endo -69.73 -27.99 25.94 Favored 'Trans proline' 0 C--O 1.231 0.171 0 C-N-CA 122.718 2.278 . . . . 74.340000000000003 112.313 179.994 . . . . . . . . 2 2 . 1 . 032 nuclear orig core ' A' A ' 19' ' ' PRO . . . . . 0.903 ' HD2' ' N ' ' A' ' 18' ' ' PRO . 53.9 Cg_endo -69.74 -16.71 37.77 Favored 'Trans proline' 0 C--N 1.341 0.179 0 C-N-CA 122.669 2.246 . . . . 75.420000000000002 112.359 179.939 . . . . . . . . 2 2 . 1 . 032 nuclear orig core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 17.6 tp10 -82.61 -21.36 35.16 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.252 -0.431 . . . . 75.409999999999997 110.875 -179.978 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -58.14 -34.11 69.91 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.167 -0.469 . . . . 75.120000000000005 110.864 -179.894 . . . . . . . . 2 2 . 1 . 032 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.291 0 C-N-CA 120.719 -0.753 . . . . 63.409999999999997 112.485 -179.993 . . . . . . . . 0 0 . 1 . 033 nuclear orig core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 93.6 t . . . . . 0 N--CA 1.458 -0.069 0 CA-C-O 120.868 0.366 . . . . 63.210000000000001 111.146 . . . . . . . . . 0 0 . 1 . 033 nuclear orig core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 2.8 ttp -113.61 -2.45 13.8 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.159 -0.473 . . . . 53.409999999999997 110.886 179.922 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 25.7 m -76.55 -4.92 45.32 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.211 -0.449 . . . . 74.129999999999995 111.135 -179.967 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . 0.663 ' C ' ' HG3' ' A' ' 19' ' ' PRO . 23.5 t -97.88 10.97 5.93 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.269 -0.423 . . . . 74.299999999999997 111.176 179.861 . . . . . . . . 2 2 . 1 . 033 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 3.0 mp -142.37 2.56 0.41 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.189 -0.46 . . . . 70.409999999999997 111.14 179.924 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 17' ' ' SER . . . . . 0.798 ' C ' ' HD2' ' A' ' 19' ' ' PRO . 0.6 OUTLIER -101.74 -66.2 0.05 OUTLIER Pre-proline 0 C--N 1.33 -0.273 0 CA-C-O 121.622 0.725 . . . . 72.219999999999999 110.88 -179.935 . . . . . . . . 3 3 . 1 . 033 nuclear orig core ' A' A ' 18' ' ' PRO . . . . . 0.901 ' N ' ' HD2' ' A' ' 19' ' ' PRO . 53.7 Cg_endo -69.8 -27.66 26.02 Favored 'Trans proline' 0 C--N 1.342 0.189 0 C-N-CA 122.664 2.243 . . . . 75.109999999999999 112.374 179.953 . . . . . . . . 2 2 . 1 . 033 nuclear orig core ' A' A ' 19' ' ' PRO . . . . . 0.901 ' HD2' ' N ' ' A' ' 18' ' ' PRO . 53.2 Cg_endo -69.81 -16.2 37.25 Favored 'Trans proline' 0 C--N 1.341 0.145 0 C-N-CA 122.664 2.243 . . . . 74.109999999999999 112.329 179.946 . . . . . . . . 2 2 . 1 . 033 nuclear orig core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 5.8 tm-20 -83.02 -21.25 33.9 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.2 -0.455 . . . . 74.510000000000005 110.855 -179.968 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -57.55 -32.78 67.44 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.166 -0.47 . . . . 75.019999999999996 110.896 -179.932 . . . . . . . . 2 2 . 1 . 033 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.366 0 C-N-CA 120.754 -0.736 . . . . 42.149999999999999 112.508 -179.95 . . . . . . . . 0 0 . 1 . 034 nuclear orig core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 55.7 t . . . . . 0 N--CA 1.458 -0.051 0 CA-C-O 120.835 0.35 . . . . 73.430000000000007 111.091 . . . . . . . . . 0 0 . 1 . 034 nuclear orig core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 10.1 ttp -105.76 6.26 31.63 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.144 -0.48 . . . . 72.349999999999994 110.913 179.92 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 6.0 t -70.18 -6.34 33.68 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.221 -0.445 . . . . 73.430000000000007 111.104 -179.922 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . 0.604 ' C ' ' HG3' ' A' ' 19' ' ' PRO . 40.3 t -96.27 9.83 5.85 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.242 -0.436 . . . . 64.519999999999996 111.177 179.922 . . . . . . . . 2 2 . 1 . 034 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 10.6 mt -143.96 2.11 0.3 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.092 -0.504 . . . . 74.540000000000006 111.102 179.963 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 17' ' ' SER . . . . . 0.804 ' C ' ' HD2' ' A' ' 19' ' ' PRO . 0.0 OUTLIER -99.74 -65.89 0.06 OUTLIER Pre-proline 0 C--N 1.329 -0.288 0 CA-C-O 121.65 0.738 . . . . 74.099999999999994 110.818 -179.898 . . . . . . . . 3 3 . 1 . 034 nuclear orig core ' A' A ' 18' ' ' PRO . . . . . 0.898 ' N ' ' HD2' ' A' ' 19' ' ' PRO . 53.7 Cg_endo -69.77 -27.38 26.5 Favored 'Trans proline' 0 C--O 1.231 0.156 0 C-N-CA 122.649 2.232 . . . . 74.209999999999994 112.331 -179.976 . . . . . . . . 2 2 . 1 . 034 nuclear orig core ' A' A ' 19' ' ' PRO . . . . . 0.898 ' HD2' ' N ' ' A' ' 18' ' ' PRO . 53.6 Cg_endo -69.74 -16.98 37.91 Favored 'Trans proline' 0 C--N 1.341 0.177 0 C-N-CA 122.651 2.234 . . . . 74.230000000000004 112.336 179.952 . . . . . . . . 2 2 . 1 . 034 nuclear orig core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 1.9 mt-10 -82.79 -19.99 36.66 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.228 -0.442 . . . . 73.299999999999997 110.879 -179.967 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -58.59 -33.35 69.88 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.21 -0.45 . . . . 73.510000000000005 110.894 -179.945 . . . . . . . . 2 2 . 1 . 034 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.302 0 C-N-CA 120.7 -0.762 . . . . 73.430000000000007 112.461 179.998 . . . . . . . . 0 0 . 1 . 035 nuclear orig core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 50.8 t . . . . . 0 C--O 1.231 0.097 0 CA-C-O 120.864 0.364 . . . . 73.040000000000006 111.159 . . . . . . . . . 0 0 . 1 . 035 nuclear orig core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 10.4 ttp -102.3 33.93 2.93 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.191 -0.459 . . . . 73.140000000000001 110.884 179.884 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 5.6 t -86.74 -3.92 59.11 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.212 -0.449 . . . . 71.230000000000004 111.138 -179.92 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . 0.66 ' C ' ' HG3' ' A' ' 19' ' ' PRO . 25.1 t -93.04 3.45 8.2 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.222 -0.445 . . . . 71.319999999999993 111.125 179.895 . . . . . . . . 2 2 . 1 . 035 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 2.8 mp -142.33 3.6 0.41 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.144 -0.48 . . . . 75.439999999999998 111.156 179.949 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 17' ' ' SER . . . . . 0.78 ' C ' ' HD2' ' A' ' 19' ' ' PRO . 0.5 OUTLIER -99.86 -68.78 0.04 OUTLIER Pre-proline 0 C--N 1.33 -0.271 0 CA-C-O 121.671 0.748 . . . . 75.040000000000006 110.855 -179.879 . . . . . . . . 3 3 . 1 . 035 nuclear orig core ' A' A ' 18' ' ' PRO . . . . . 0.895 ' N ' ' HD2' ' A' ' 19' ' ' PRO . 53.6 Cg_endo -69.77 -27.99 25.74 Favored 'Trans proline' 0 C--N 1.341 0.172 0 C-N-CA 122.651 2.234 . . . . 55.520000000000003 112.323 179.981 . . . . . . . . 2 2 . 1 . 035 nuclear orig core ' A' A ' 19' ' ' PRO . . . . . 0.895 ' HD2' ' N ' ' A' ' 18' ' ' PRO . 54.1 Cg_endo -69.7 -16.76 37.97 Favored 'Trans proline' 0 C--N 1.341 0.149 0 C-N-CA 122.702 2.268 . . . . 72.340000000000003 112.366 179.942 . . . . . . . . 2 2 . 1 . 035 nuclear orig core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 28.4 tt0 -82.64 -21.24 35.13 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.191 -0.459 . . . . 74.420000000000002 110.888 -179.975 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -59.13 -25.39 63.82 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.113 -0.494 . . . . 71.219999999999999 110.875 -179.878 . . . . . . . . 2 2 . 1 . 035 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.339 0 C-N-CA 120.746 -0.74 . . . . 75.230000000000004 112.516 -179.987 . . . . . . . . 0 0 . 1 . 036 nuclear orig core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 47.8 t . . . . . 0 N--CA 1.457 -0.083 0 CA-C-O 120.857 0.36 . . . . 74.439999999999998 111.147 . . . . . . . . . 0 0 . 1 . 036 nuclear orig core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 9.0 ttp -105.58 2.98 28.77 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.134 -0.485 . . . . 74.129999999999995 110.852 179.918 . . . . . . . . 1 1 . 1 . 036 nuclear orig core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 5.6 t -70.28 -5.93 31.3 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.272 -0.422 . . . . 75.340000000000003 111.162 -179.98 . . . . . . . . 1 1 . 1 . 036 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . 0.613 ' C ' ' HG3' ' A' ' 19' ' ' PRO . 40.0 t -96.18 9.84 5.79 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.229 -0.442 . . . . 75.239999999999995 111.171 179.872 . . . . . . . . 2 2 . 1 . 036 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 10.4 mt -143.86 2.05 0.31 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.176 -0.466 . . . . 75.530000000000001 111.16 179.945 . . . . . . . . 1 1 . 1 . 036 nuclear orig core ' A' A ' 17' ' ' SER . . . . . 0.812 ' C ' ' HD2' ' A' ' 19' ' ' PRO . 0.0 OUTLIER -99.73 -65.79 0.06 OUTLIER Pre-proline 0 C--N 1.33 -0.252 0 CA-C-O 121.673 0.749 . . . . 72.219999999999999 110.864 -179.922 . . . . . . . . 3 3 . 1 . 036 nuclear orig core ' A' A ' 18' ' ' PRO . . . . . 0.894 ' N ' ' HD2' ' A' ' 19' ' ' PRO . 53.6 Cg_endo -69.74 -27.4 26.61 Favored 'Trans proline' 0 C--N 1.341 0.175 0 C-N-CA 122.713 2.276 . . . . 65.209999999999994 112.36 179.978 . . . . . . . . 2 2 . 1 . 036 nuclear orig core ' A' A ' 19' ' ' PRO . . . . . 0.894 ' HD2' ' N ' ' A' ' 18' ' ' PRO . 53.5 Cg_endo -69.82 -16.95 37.55 Favored 'Trans proline' 0 C--N 1.342 0.217 0 C-N-CA 122.673 2.249 . . . . 71.340000000000003 112.318 179.981 . . . . . . . . 2 2 . 1 . 036 nuclear orig core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 1.2 mt-10 -82.81 -20.23 36.15 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.232 -0.44 . . . . 74.319999999999993 110.836 -179.969 . . . . . . . . 1 1 . 1 . 036 nuclear orig core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -58.41 -32.8 68.98 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.188 -0.46 . . . . 75.420000000000002 110.903 -179.91 . . . . . . . . 2 2 . 1 . 036 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.288 0 C-N-CA 120.735 -0.745 . . . . 63.229999999999997 112.475 -179.999 . . . . . . . . 0 0 . 1 . 037 nuclear orig core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 39.7 t . . . . . 0 N--CA 1.457 -0.089 0 CA-C-O 120.831 0.348 . . . . 73.120000000000005 111.159 . . . . . . . . . 0 0 . 1 . 037 nuclear orig core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 9.7 ttp -104.36 6.37 35.11 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.138 -0.483 . . . . 70.310000000000002 110.872 179.9 . . . . . . . . 1 1 . 1 . 037 nuclear orig core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 5.8 t -70.04 -6.34 32.92 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.257 -0.429 . . . . 65.310000000000002 111.183 -179.955 . . . . . . . . 1 1 . 1 . 037 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . 0.611 ' C ' ' HG3' ' A' ' 19' ' ' PRO . 40.7 t -96.28 9.87 5.83 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.207 -0.451 . . . . 74.400000000000006 111.137 179.907 . . . . . . . . 2 2 . 1 . 037 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 10.8 mt -143.96 1.98 0.3 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.193 -0.458 . . . . 75.409999999999997 111.132 179.942 . . . . . . . . 1 1 . 1 . 037 nuclear orig core ' A' A ' 17' ' ' SER . . . . . 0.809 ' C ' ' HD2' ' A' ' 19' ' ' PRO . 0.0 OUTLIER -99.66 -65.88 0.06 OUTLIER Pre-proline 0 C--N 1.329 -0.307 0 CA-C-O 121.707 0.765 . . . . 65.109999999999999 110.863 -179.895 . . . . . . . . 3 3 . 1 . 037 nuclear orig core ' A' A ' 18' ' ' PRO . . . . . 0.892 ' N ' ' HD2' ' A' ' 19' ' ' PRO . 53.8 Cg_endo -69.77 -27.42 26.43 Favored 'Trans proline' 0 C--N 1.342 0.205 0 C-N-CA 122.739 2.292 . . . . 75.519999999999996 112.321 179.999 . . . . . . . . 2 2 . 1 . 037 nuclear orig core ' A' A ' 19' ' ' PRO . . . . . 0.892 ' HD2' ' N ' ' A' ' 18' ' ' PRO . 54.1 Cg_endo -69.74 -17.02 37.9 Favored 'Trans proline' 0 C--N 1.341 0.176 0 C-N-CA 122.657 2.238 . . . . 75.340000000000003 112.392 179.922 . . . . . . . . 2 2 . 1 . 037 nuclear orig core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 1.3 mt-10 -82.73 -19.88 37.07 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.208 -0.451 . . . . 74.239999999999995 110.92 179.989 . . . . . . . . 1 1 . 1 . 037 nuclear orig core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -58.62 -33.72 70.35 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.111 -0.495 . . . . 74.450000000000003 110.903 -179.943 . . . . . . . . 2 2 . 1 . 037 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.309 0 C-N-CA 120.715 -0.755 . . . . 64.319999999999993 112.469 -179.953 . . . . . . . . 0 0 . 1 . 038 nuclear orig core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 46.3 t . . . . . 0 C--O 1.232 0.132 0 CA-C-O 120.83 0.347 . . . . 75.420000000000002 111.109 . . . . . . . . . 0 0 . 1 . 038 nuclear orig core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 9.7 ttp -105.4 6.37 32.5 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.229 -0.442 . . . . 75.109999999999999 110.876 179.939 . . . . . . . . 1 1 . 1 . 038 nuclear orig core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 6.0 t -70.02 -6.32 32.68 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.186 -0.461 . . . . 75.25 111.177 -179.981 . . . . . . . . 1 1 . 1 . 038 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . 0.611 ' C ' ' HG3' ' A' ' 19' ' ' PRO . 40.5 t -96.33 9.94 5.81 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.195 -0.457 . . . . 75.230000000000004 111.127 179.93 . . . . . . . . 2 2 . 1 . 038 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 10.6 mt -143.96 1.96 0.3 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.159 -0.473 . . . . 73.219999999999999 111.117 179.952 . . . . . . . . 1 1 . 1 . 038 nuclear orig core ' A' A ' 17' ' ' SER . . . . . 0.814 ' C ' ' HD2' ' A' ' 19' ' ' PRO . 0.0 OUTLIER -99.64 -65.88 0.06 OUTLIER Pre-proline 0 C--N 1.329 -0.301 0 CA-C-O 121.688 0.756 . . . . 63.420000000000002 110.859 -179.934 . . . . . . . . 3 3 . 1 . 038 nuclear orig core ' A' A ' 18' ' ' PRO . . . . . 0.898 ' N ' ' HD2' ' A' ' 19' ' ' PRO . 53.7 Cg_endo -69.73 -27.41 26.67 Favored 'Trans proline' 0 C--N 1.342 0.199 0 C-N-CA 122.691 2.261 . . . . 75.239999999999995 112.324 -179.999 . . . . . . . . 2 2 . 1 . 038 nuclear orig core ' A' A ' 19' ' ' PRO . . . . . 0.898 ' HD2' ' N ' ' A' ' 18' ' ' PRO . 53.4 Cg_endo -69.82 -17.34 37.36 Favored 'Trans proline' 0 C--N 1.342 0.191 0 C-N-CA 122.691 2.26 . . . . 71.310000000000002 112.348 179.979 . . . . . . . . 2 2 . 1 . 038 nuclear orig core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 6.2 tm-20 -83.06 -20.74 34.39 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.204 -0.453 . . . . 72.519999999999996 110.898 179.993 . . . . . . . . 1 1 . 1 . 038 nuclear orig core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -58.64 -32.63 69.23 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.151 -0.477 . . . . 74.120000000000005 110.888 -179.916 . . . . . . . . 2 2 . 1 . 038 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.321 0 C-N-CA 120.761 -0.733 . . . . 73.219999999999999 112.506 -179.99 . . . . . . . . 0 0 . 1 . 039 nuclear orig core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 59.0 t . . . . . 0 C--O 1.23 0.055 0 CA-C-O 120.829 0.347 . . . . 74.049999999999997 111.12 . . . . . . . . . 0 0 . 1 . 039 nuclear orig core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 9.7 ttp -105.47 6.38 32.37 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.185 -0.461 . . . . 65.319999999999993 110.901 179.86 . . . . . . . . 1 1 . 1 . 039 nuclear orig core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 6.1 t -70.11 -6.37 33.56 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.235 -0.439 . . . . 74.239999999999995 111.193 -179.991 . . . . . . . . 1 1 . 1 . 039 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . 0.6 ' C ' ' HG3' ' A' ' 19' ' ' PRO . 40.5 t -96.26 9.91 5.79 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.164 -0.471 . . . . 75.409999999999997 111.119 179.891 . . . . . . . . 2 2 . 1 . 039 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 10.8 mt -143.93 2.04 0.31 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.192 -0.458 . . . . 75.209999999999994 111.121 179.899 . . . . . . . . 1 1 . 1 . 039 nuclear orig core ' A' A ' 17' ' ' SER . . . . . 0.796 ' C ' ' HD2' ' A' ' 19' ' ' PRO . 0.0 OUTLIER -99.67 -65.89 0.06 OUTLIER Pre-proline 0 C--N 1.329 -0.303 0 CA-C-O 121.678 0.752 . . . . 62.130000000000003 110.861 -179.916 . . . . . . . . 3 3 . 1 . 039 nuclear orig core ' A' A ' 18' ' ' PRO . . . . . 0.893 ' N ' ' HD2' ' A' ' 19' ' ' PRO . 53.7 Cg_endo -69.74 -27.44 26.55 Favored 'Trans proline' 0 C--N 1.341 0.168 0 C-N-CA 122.716 2.277 . . . . 75.120000000000005 112.341 179.995 . . . . . . . . 2 2 . 1 . 039 nuclear orig core ' A' A ' 19' ' ' PRO . . . . . 0.893 ' HD2' ' N ' ' A' ' 18' ' ' PRO . 53.7 Cg_endo -69.81 -16.87 37.55 Favored 'Trans proline' 0 C--N 1.342 0.203 0 C-N-CA 122.65 2.234 . . . . 75.400000000000006 112.336 179.991 . . . . . . . . 2 2 . 1 . 039 nuclear orig core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 1.1 mt-10 -82.83 -19.49 37.51 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.221 -0.445 . . . . 61.109999999999999 110.933 179.975 . . . . . . . . 1 1 . 1 . 039 nuclear orig core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -59.68 -25.82 65.05 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.122 -0.49 . . . . 75.230000000000004 110.881 -179.965 . . . . . . . . 2 2 . 1 . 039 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.313 0 C-N-CA 120.73 -0.747 . . . . 72.329999999999998 112.483 -179.955 . . . . . . . . 0 0 . 1 . 040 nuclear orig core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 48.5 t . . . . . 0 C--O 1.23 0.067 0 CA-C-O 120.85 0.357 . . . . 65.400000000000006 111.154 . . . . . . . . . 0 0 . 1 . 040 nuclear orig core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 8.5 ttp -106.05 3.25 27.99 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.135 -0.484 . . . . 64.140000000000001 110.86 179.921 . . . . . . . . 1 1 . 1 . 040 nuclear orig core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 5.6 t -70.8 -5.72 32.36 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.217 -0.447 . . . . 75.319999999999993 111.142 -179.927 . . . . . . . . 1 1 . 1 . 040 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . 0.622 ' C ' ' HG3' ' A' ' 19' ' ' PRO . 40.3 t -96.33 9.09 6.37 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.18 -0.464 . . . . 73.400000000000006 111.163 179.88 . . . . . . . . 2 2 . 1 . 040 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 2.9 mp -142.78 2.26 0.38 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.136 -0.484 . . . . 75.430000000000007 111.128 179.934 . . . . . . . . 1 1 . 1 . 040 nuclear orig core ' A' A ' 17' ' ' SER . . . . . 0.821 ' C ' ' HD2' ' A' ' 19' ' ' PRO . 0.0 OUTLIER -99.65 -65.79 0.06 OUTLIER Pre-proline 0 C--N 1.33 -0.281 0 CA-C-O 121.657 0.741 . . . . 61.450000000000003 110.844 -179.924 . . . . . . . . 3 3 . 1 . 040 nuclear orig core ' A' A ' 18' ' ' PRO . . . . . 0.908 ' N ' ' HD2' ' A' ' 19' ' ' PRO . 53.4 Cg_endo -69.76 -27.33 26.62 Favored 'Trans proline' 0 C--N 1.342 0.195 0 C-N-CA 122.651 2.234 . . . . 75.219999999999999 112.315 -179.979 . . . . . . . . 2 2 . 1 . 040 nuclear orig core ' A' A ' 19' ' ' PRO . . . . . 0.908 ' HD2' ' N ' ' A' ' 18' ' ' PRO . 53.3 Cg_endo -69.75 -17.09 37.82 Favored 'Trans proline' 0 C--N 1.341 0.18 0 C-N-CA 122.705 2.27 . . . . 75.540000000000006 112.321 179.986 . . . . . . . . 2 2 . 1 . 040 nuclear orig core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -82.65 -19.72 37.68 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.184 -0.462 . . . . 72.5 110.857 -179.946 . . . . . . . . 2 2 . 1 . 040 nuclear orig core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -59.57 -25.83 64.9 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.153 -0.476 . . . . 72.430000000000007 110.89 -179.913 . . . . . . . . 2 2 . 1 . 040 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.304 0 C-N-CA 120.739 -0.743 . . . . 72.209999999999994 112.476 -179.953 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' TRP . . . . . . . . . . . . . 38.8 m0 . . . . . 0 C--O 1.231 0.126 0 CA-C-O 120.777 0.323 . . . . 72.299999999999997 110.943 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -56.48 160.59 5.11 Favored Pre-proline 0 C--N 1.329 -0.323 0 CA-C-O 121.621 0.724 . . . . 74.510000000000005 110.857 -179.941 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.78 79.11 0.97 Allowed 'Trans proline' 0 C--N 1.341 0.181 0 C-N-CA 122.652 2.235 . . . . 71.129999999999995 112.349 -179.98 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 2.1 t80 -135.37 -65.03 0.62 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.21 -0.45 . . . . 74.549999999999997 110.935 -179.916 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -80.8 -24.4 38.56 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.116 -0.493 . . . . 75.310000000000002 110.914 179.976 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 27.6 mt-30 -51.97 -49.09 63.9 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.185 -0.461 . . . . 75.430000000000007 110.896 179.927 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 11.6 t -68.86 -31.41 70.34 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.246 -0.434 . . . . 63.329999999999998 111.157 -179.93 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -55.08 -29.28 57.24 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.209 -0.45 . . . . 74.109999999999999 110.912 179.951 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 0.7 OUTLIER -80.67 -45.45 17.18 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.182 -0.463 . . . . 74.450000000000003 110.973 -179.912 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 14.7 m-85 -63.15 -31.75 72.97 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.074 -0.512 . . . . 73.230000000000004 110.873 -179.904 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -55.17 -33.38 62.92 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.179 -0.464 . . . . 74.510000000000005 110.817 179.951 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 58.0 t -93.19 -29.18 4.38 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.228 -0.442 . . . . 73.239999999999995 111.163 179.999 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 10.5 ttp -101.73 33.23 3.06 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.172 -0.467 . . . . 72.340000000000003 110.879 179.899 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 5.7 t -85.96 -3.95 59.05 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.245 -0.434 . . . . 75.319999999999993 111.182 -179.985 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . 0.645 ' C ' ' HG3' ' A' ' 19' ' ' PRO . 24.5 t -93.78 4.75 7.77 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.228 -0.442 . . . . 75.150000000000006 111.119 179.927 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 9.5 mt -143.47 3.19 0.34 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.184 -0.462 . . . . 64.510000000000005 111.16 179.922 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' SER . . . . . 0.788 ' C ' ' HD2' ' A' ' 19' ' ' PRO . 0.5 OUTLIER -100.26 -68.44 0.04 OUTLIER Pre-proline 0 C--N 1.329 -0.294 0 CA-C-O 121.643 0.735 . . . . 74.019999999999996 110.836 -179.895 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . 0.893 ' N ' ' HD2' ' A' ' 19' ' ' PRO . 54.2 Cg_endo -69.71 -27.89 26.14 Favored 'Trans proline' 0 C--O 1.231 0.154 0 C-N-CA 122.664 2.243 . . . . 70.439999999999998 112.391 179.953 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' PRO . . . . . 0.893 ' HD2' ' N ' ' A' ' 18' ' ' PRO . 54.0 Cg_endo -69.68 -16.52 37.93 Favored 'Trans proline' 0 C--N 1.342 0.189 0 C-N-CA 122.704 2.269 . . . . 74.519999999999996 112.352 179.934 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 2.8 mt-10 -81.93 -19.4 40.83 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.248 -0.433 . . . . 73.010000000000005 110.906 -179.982 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -59.62 -25.74 64.9 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.175 -0.466 . . . . 75.549999999999997 110.864 -179.954 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.302 0 C-N-CA 120.688 -0.768 . . . . 60.119999999999997 112.484 -179.934 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' TRP . . . . . . . . . . . . . 46.2 m0 . . . . . 0 C--O 1.231 0.083 0 CA-C-O 120.773 0.321 . . . . 75.439999999999998 110.901 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 11.1 ptt180 -119.4 68.93 10.79 Favored Pre-proline 0 C--N 1.329 -0.291 0 CA-C-O 121.611 0.719 . . . . 73.219999999999999 110.883 -179.966 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.76 78.74 0.99 Allowed 'Trans proline' 0 C--N 1.341 0.165 0 C-N-CA 122.688 2.259 . . . . 71.040000000000006 112.382 -179.998 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 42.1 m-85 -134.95 -64.02 0.67 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.171 -0.468 . . . . 74.420000000000002 110.868 -179.872 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -81.88 -24.45 35.72 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.162 -0.472 . . . . 74.109999999999999 110.902 179.989 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -55.2 -52.51 63.1 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.196 -0.456 . . . . 74.219999999999999 110.928 179.938 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 8.9 t -61.66 -32.74 72.92 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.195 -0.457 . . . . 71.420000000000002 111.137 -179.915 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -53.54 -28.57 32.26 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.247 -0.433 . . . . 72.140000000000001 110.901 -179.998 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 2.8 m-85 -94.21 -44.97 7.72 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.126 -0.488 . . . . 74.340000000000003 110.93 -179.872 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 23.3 m-85 -56.28 -30.07 61.99 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.111 -0.495 . . . . 75.25 110.915 -179.909 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 13.9 t70 -57.96 -30.63 66.16 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.137 -0.483 . . . . 74.439999999999998 110.883 179.896 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 48.1 t -91.99 -29.84 4.64 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.17 -0.468 . . . . 72.549999999999997 111.174 179.952 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 10.5 ttp -101.97 33.34 3.08 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.153 -0.476 . . . . 75.129999999999995 110.847 179.926 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 5.5 t -86.09 -4.03 59.08 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.242 -0.435 . . . . 65.200000000000003 111.171 -179.957 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . 0.638 ' C ' ' HG3' ' A' ' 19' ' ' PRO . 25.4 t -92.9 4.12 7.69 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.212 -0.449 . . . . 71.530000000000001 111.087 179.965 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 9.5 mt -143.34 3.37 0.35 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.164 -0.471 . . . . 74.120000000000005 111.089 179.928 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' SER . . . . . 0.801 ' C ' ' HD2' ' A' ' 19' ' ' PRO . 0.5 OUTLIER -99.91 -68.73 0.04 OUTLIER Pre-proline 0 C--N 1.33 -0.28 0 CA-C-O 121.688 0.756 . . . . 71.019999999999996 110.876 -179.92 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . 0.89 ' N ' ' HD2' ' A' ' 19' ' ' PRO . 53.9 Cg_endo -69.77 -27.89 25.86 Favored 'Trans proline' 0 C--N 1.342 0.211 0 C-N-CA 122.683 2.256 . . . . 72.310000000000002 112.324 179.977 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' PRO . . . . . 0.89 ' HD2' ' N ' ' A' ' 18' ' ' PRO . 54.2 Cg_endo -69.7 -16.47 37.83 Favored 'Trans proline' 0 C--N 1.342 0.202 0 C-N-CA 122.702 2.268 . . . . 73.439999999999998 112.358 179.949 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 2.8 mt-10 -81.94 -19.89 39.76 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.207 -0.451 . . . . 74.430000000000007 110.89 -179.964 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -58.64 -34.73 71.52 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.129 -0.487 . . . . 75.140000000000001 110.842 -179.911 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.303 0 C-N-CA 120.697 -0.763 . . . . 60.420000000000002 112.491 -179.975 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' TRP . . . . . . . . . . . . . 54.8 m0 . . . . . 0 C--O 1.231 0.104 0 CA-C-O 120.787 0.327 . . . . 73.230000000000004 110.887 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 4.8 mtt-85 -114.09 73.0 2.36 Favored Pre-proline 0 C--N 1.329 -0.294 0 CA-C-O 121.594 0.711 . . . . 65.400000000000006 110.84 -179.953 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.77 78.8 0.99 Allowed 'Trans proline' 0 C--N 1.341 0.175 0 C-N-CA 122.678 2.252 . . . . 74.230000000000004 112.342 179.99 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 25.9 m-85 -135.94 -63.7 0.64 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.22 -0.445 . . . . 74.510000000000005 110.919 -179.921 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -82.18 -24.47 34.95 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.092 -0.503 . . . . 72.409999999999997 110.904 179.963 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 6.8 mt-30 -55.88 -52.91 62.42 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.202 -0.454 . . . . 71.519999999999996 110.891 179.962 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 9.3 t -60.95 -33.11 72.67 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.25 -0.432 . . . . 74.030000000000001 111.103 -179.884 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -53.74 -28.21 33.03 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.237 -0.438 . . . . 74.5 110.876 179.986 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 0.7 OUTLIER -91.39 -45.24 8.68 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.176 -0.466 . . . . 74.340000000000003 110.936 -179.848 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 22.0 m-85 -58.11 -32.23 67.91 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.123 -0.489 . . . . 73.439999999999998 110.942 -179.981 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -53.48 -37.01 62.3 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.128 -0.487 . . . . 75.099999999999994 110.858 179.945 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 48.1 t -84.69 -28.21 6.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.229 -0.441 . . . . 73.510000000000005 111.168 179.963 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 10.5 ttp -102.06 33.36 3.09 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.182 -0.463 . . . . 73.299999999999997 110.899 179.908 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 5.5 t -86.16 -3.94 59.06 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.183 -0.462 . . . . 62.119999999999997 111.153 -179.935 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . 0.642 ' C ' ' HG3' ' A' ' 19' ' ' PRO . 25.4 t -92.94 4.13 7.7 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.219 -0.446 . . . . 74.209999999999994 111.124 179.898 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 9.5 mt -143.27 3.3 0.35 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 116.152 -0.476 . . . . 72.510000000000005 111.123 179.914 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' SER . . . . . 0.804 ' C ' ' HD2' ' A' ' 19' ' ' PRO . 0.5 OUTLIER -99.84 -68.78 0.04 OUTLIER Pre-proline 0 C--N 1.329 -0.313 0 CA-C-O 121.676 0.75 . . . . 70.140000000000001 110.893 -179.917 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . 0.904 ' N ' ' HD2' ' A' ' 19' ' ' PRO . 53.7 Cg_endo -69.77 -27.86 25.92 Favored 'Trans proline' 0 C--N 1.341 0.165 0 C-N-CA 122.673 2.249 . . . . 64.299999999999997 112.36 179.952 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' PRO . . . . . 0.904 ' HD2' ' N ' ' A' ' 18' ' ' PRO . 53.2 Cg_endo -69.77 -16.42 37.51 Favored 'Trans proline' 0 C--N 1.341 0.176 0 C-N-CA 122.668 2.246 . . . . 75.319999999999993 112.329 179.96 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 1.5 mt-10 -81.91 -19.52 40.65 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.207 -0.451 . . . . 71.310000000000002 110.871 -179.995 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -59.56 -25.71 64.79 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.178 -0.465 . . . . 71.019999999999996 110.911 -179.918 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.342 0 C-N-CA 120.752 -0.737 . . . . 53.329999999999998 112.469 -179.963 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' TRP . . . . . . . . . . . . . 55.0 m0 . . . . . 0 C--O 1.231 0.127 0 CA-C-O 120.742 0.306 . . . . 72.439999999999998 110.917 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER 52.07 68.52 3.1 Favored Pre-proline 0 C--N 1.329 -0.314 0 CA-C-O 121.615 0.722 . . . . 73.319999999999993 110.902 -179.933 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.76 -171.04 0.43 Allowed 'Trans proline' 0 C--N 1.341 0.183 0 C-N-CA 122.665 2.243 . . . . 74.040000000000006 112.335 -179.968 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 46.0 m-85 -132.21 -64.49 0.77 Allowed 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.192 -0.458 . . . . 71.540000000000006 110.891 -179.909 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -81.11 -24.44 37.68 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.116 -0.493 . . . . 71.140000000000001 110.971 179.952 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 1.1 tp60 -55.68 -53.93 50.55 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.16 -0.473 . . . . 74.430000000000007 110.917 179.928 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 9.0 t -59.33 -32.32 69.97 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.202 -0.454 . . . . 72.310000000000002 111.128 -179.944 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -55.39 -26.26 40.42 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.258 -0.428 . . . . 74.319999999999993 110.88 -179.997 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 1.0 OUTLIER -94.71 -41.88 9.04 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.157 -0.474 . . . . 72.319999999999993 110.872 -179.836 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 22.7 m-85 -61.03 -26.3 67.52 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.137 -0.483 . . . . 73.239999999999995 110.934 -179.881 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -57.14 -41.35 78.96 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.119 -0.491 . . . . 53.439999999999998 110.881 179.896 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 50.4 t -84.66 -26.87 6.86 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.195 -0.457 . . . . 73.299999999999997 111.141 -179.999 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 10.4 ttp -102.26 33.7 3.01 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.13 -0.486 . . . . 71.430000000000007 110.884 179.926 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 5.8 t -86.47 -3.94 59.09 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.264 -0.425 . . . . 73.349999999999994 111.143 -179.912 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . 0.651 ' C ' ' HG3' ' A' ' 19' ' ' PRO . 24.3 t -93.87 4.1 8.21 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.208 -0.451 . . . . 75.209999999999994 111.155 179.911 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 2.8 mp -142.5 3.46 0.4 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.194 -0.457 . . . . 63.409999999999997 111.144 179.893 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' SER . . . . . 0.792 ' C ' ' HD2' ' A' ' 19' ' ' PRO . 0.5 OUTLIER -100.19 -68.43 0.04 OUTLIER Pre-proline 0 C--N 1.329 -0.296 0 CA-C-O 121.675 0.75 . . . . 74.340000000000003 110.895 -179.962 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . 0.896 ' N ' ' HD2' ' A' ' 19' ' ' PRO . 53.1 Cg_endo -69.73 -27.94 26.02 Favored 'Trans proline' 0 C--N 1.341 0.144 0 C-N-CA 122.73 2.286 . . . . 73.120000000000005 112.319 179.973 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' PRO . . . . . 0.896 ' HD2' ' N ' ' A' ' 18' ' ' PRO . 53.9 Cg_endo -69.71 -16.42 37.74 Favored 'Trans proline' 0 C--N 1.342 0.213 0 C-N-CA 122.651 2.234 . . . . 75.150000000000006 112.366 179.952 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -81.93 -19.76 40.08 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.207 -0.451 . . . . 75.409999999999997 110.863 -179.979 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -58.63 -32.93 69.5 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.151 -0.477 . . . . 62.439999999999998 110.896 -179.891 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.45 -0.372 0 C-N-CA 120.764 -0.732 . . . . 75.219999999999999 112.502 179.979 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' TRP . . . . . . . . . . . . . 41.3 m0 . . . . . 0 C--O 1.231 0.11 0 CA-C-O 120.749 0.309 . . . . 73.319999999999993 110.899 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 4.3 mtt180 -74.24 160.64 81.01 Favored Pre-proline 0 C--N 1.329 -0.316 0 CA-C-O 121.64 0.733 . . . . 75.129999999999995 110.846 -179.951 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.84 79.41 0.97 Allowed 'Trans proline' 0 C--N 1.341 0.181 0 C-N-CA 122.645 2.23 . . . . 72.310000000000002 112.319 -179.983 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 1.7 t80 -134.71 -65.02 0.65 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.205 -0.452 . . . . 75.430000000000007 110.905 -179.888 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -80.88 -24.4 38.36 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.075 -0.511 . . . . 72.329999999999998 110.941 179.954 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -51.91 -49.03 63.86 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.223 -0.444 . . . . 72.200000000000003 110.875 179.926 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 11.7 t -68.97 -31.37 70.18 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.209 -0.451 . . . . 74.400000000000006 111.144 -179.93 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 2.6 mt-10 -54.83 -27.75 44.41 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.246 -0.433 . . . . 73.329999999999998 110.889 -179.973 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -83.38 -45.6 13.52 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.152 -0.477 . . . . 74.200000000000003 110.903 -179.892 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 13.3 m-85 -63.34 -30.94 71.99 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.124 -0.489 . . . . 70.5 110.952 -179.9 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 2.3 t70 -56.17 -34.1 65.86 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.126 -0.488 . . . . 71.329999999999998 110.833 179.901 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 61.5 t -92.72 -28.13 4.56 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.222 -0.444 . . . . 73.129999999999995 111.132 -179.988 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 10.4 ttp -102.05 33.84 2.91 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.159 -0.473 . . . . 65.219999999999999 110.882 179.955 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 5.8 t -86.59 -3.84 59.09 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.212 -0.449 . . . . 64.140000000000001 111.193 -179.949 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . 0.657 ' C ' ' HG3' ' A' ' 19' ' ' PRO . 24.2 t -93.94 4.07 8.27 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.191 -0.459 . . . . 72.450000000000003 111.132 179.904 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 2.8 mp -142.45 3.45 0.4 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.138 -0.483 . . . . 70.109999999999999 111.127 179.872 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' SER . . . . . 0.787 ' C ' ' HD2' ' A' ' 19' ' ' PRO . 0.5 OUTLIER -100.18 -68.41 0.04 OUTLIER Pre-proline 0 C--N 1.329 -0.291 0 CA-C-O 121.661 0.743 . . . . 72.230000000000004 110.884 -179.952 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . 0.895 ' N ' ' HD2' ' A' ' 19' ' ' PRO . 53.6 Cg_endo -69.75 -27.84 26.03 Favored 'Trans proline' 0 N--CA 1.465 -0.159 0 C-N-CA 122.716 2.277 . . . . 74.209999999999994 112.37 179.961 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' PRO . . . . . 0.895 ' HD2' ' N ' ' A' ' 18' ' ' PRO . 54.1 Cg_endo -69.77 -16.41 37.5 Favored 'Trans proline' 0 C--N 1.342 0.203 0 C-N-CA 122.624 2.216 . . . . 72.329999999999998 112.361 179.932 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -81.95 -19.85 39.84 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.206 -0.452 . . . . 74.209999999999994 110.879 -179.949 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -58.65 -34.54 71.31 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.125 -0.488 . . . . 71.519999999999996 110.864 -179.907 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.279 0 C-N-CA 120.748 -0.739 . . . . 52.329999999999998 112.427 -179.979 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' TRP . . . . . . . . . . . . . 40.9 m0 . . . . . 0 C--O 1.231 0.103 0 CA-C-O 120.798 0.332 . . . . 72.439999999999998 110.903 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 5.0 mpt_? -76.81 160.61 76.32 Favored Pre-proline 0 C--N 1.329 -0.283 0 CA-C-O 121.651 0.739 . . . . 75.409999999999997 110.898 -179.996 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.74 170.39 16.68 Favored 'Trans proline' 0 C--N 1.342 0.185 0 C-N-CA 122.708 2.272 . . . . 63.329999999999998 112.337 -179.984 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 40.6 m-85 -134.47 -64.03 0.69 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.183 -0.462 . . . . 64.010000000000005 110.877 -179.88 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -82.0 -24.4 35.46 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.119 -0.491 . . . . 74.010000000000005 110.956 179.944 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 4.6 tp60 -54.4 -51.38 65.06 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.223 -0.444 . . . . 71.540000000000006 110.915 179.881 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 10.3 t -63.41 -32.16 73.51 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.234 -0.439 . . . . 74.219999999999999 111.141 -179.928 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 1.3 tt0 -52.92 -29.14 26.78 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.207 -0.452 . . . . 71.310000000000002 110.899 -179.984 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -84.78 -45.31 12.49 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.102 -0.499 . . . . 71.530000000000001 110.919 -179.837 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 13.3 m-85 -63.61 -26.46 68.69 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.112 -0.495 . . . . 75.329999999999998 110.929 -179.932 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 2.0 t70 -58.62 -31.68 68.31 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.128 -0.487 . . . . 71.040000000000006 110.87 179.942 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 42.4 t -94.26 -28.77 4.21 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.148 -0.478 . . . . 75.030000000000001 111.124 179.99 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 10.3 ttp -102.02 33.77 2.93 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.183 -0.462 . . . . 74.109999999999999 110.884 179.928 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 5.8 t -86.5 -3.91 59.09 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.214 -0.448 . . . . 70.430000000000007 111.172 -179.978 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . 0.657 ' C ' ' HG3' ' A' ' 19' ' ' PRO . 24.1 t -93.86 4.07 8.22 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.243 -0.435 . . . . 73.209999999999994 111.107 179.933 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 2.8 mp -142.48 3.45 0.4 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.197 -0.456 . . . . 64.519999999999996 111.124 179.916 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' SER . . . . . 0.803 ' C ' ' HD2' ' A' ' 19' ' ' PRO . 0.5 OUTLIER -100.23 -68.42 0.04 OUTLIER Pre-proline 0 C--N 1.329 -0.293 0 CA-C-O 121.629 0.728 . . . . 72.219999999999999 110.838 -179.936 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . 0.891 ' N ' ' HD2' ' A' ' 19' ' ' PRO . 54.0 Cg_endo -69.72 -27.93 26.07 Favored 'Trans proline' 0 C--N 1.341 0.153 0 C-N-CA 122.726 2.284 . . . . 71.120000000000005 112.338 179.995 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' PRO . . . . . 0.891 ' HD2' ' N ' ' A' ' 18' ' ' PRO . 54.1 Cg_endo -69.69 -16.44 37.84 Favored 'Trans proline' 0 C--N 1.341 0.172 0 C-N-CA 122.704 2.27 . . . . 63.020000000000003 112.365 179.958 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -81.99 -19.51 40.39 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.184 -0.462 . . . . 74.420000000000002 110.852 -179.953 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -59.54 -25.72 64.75 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.139 -0.482 . . . . 72.510000000000005 110.912 -179.954 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.347 0 C-N-CA 120.795 -0.717 . . . . 71.239999999999995 112.496 -179.968 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' TRP . . . . . . . . . . . . . 43.0 m0 . . . . . 0 C--O 1.231 0.102 0 CA-C-O 120.785 0.326 . . . . 75.439999999999998 110.932 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER 52.49 72.1 1.27 Allowed Pre-proline 0 C--N 1.329 -0.309 0 CA-C-O 121.57 0.7 . . . . 72.420000000000002 110.873 -179.956 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -69.74 78.79 0.98 Allowed 'Trans proline' 0 C--O 1.231 0.164 0 C-N-CA 122.699 2.266 . . . . 74.439999999999998 112.36 179.991 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -135.2 -64.83 0.64 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.197 -0.456 . . . . 75.400000000000006 110.922 -179.937 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -81.02 -24.48 37.9 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.154 -0.475 . . . . 74.349999999999994 110.895 179.955 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 18.0 mt-30 -51.91 -48.81 64.01 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.202 -0.454 . . . . 73.140000000000001 110.882 179.967 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 11.8 t -69.21 -31.31 69.81 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.198 -0.456 . . . . 73.409999999999997 111.203 -179.957 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -54.89 -28.67 52.2 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.174 -0.466 . . . . 73.109999999999999 110.896 -179.989 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -82.59 -45.07 15.06 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.123 -0.49 . . . . 75.109999999999999 110.906 -179.848 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 13.9 m-85 -63.76 -28.63 70.01 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.085 -0.507 . . . . 64.239999999999995 110.9 -179.907 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 27.8 t70 -61.45 -45.43 94.32 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.127 -0.488 . . . . 72.219999999999999 110.898 179.927 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 41.4 t -81.06 -26.88 10.75 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.196 -0.456 . . . . 73.030000000000001 111.121 179.976 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 9.4 ttp -102.24 32.78 3.36 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.212 -0.449 . . . . 74.5 110.872 179.928 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 5.9 t -86.78 -3.76 59.09 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.209 -0.45 . . . . 74.420000000000002 111.143 -179.899 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . 0.666 ' C ' ' HG3' ' A' ' 19' ' ' PRO . 23.2 t -94.25 4.58 8.13 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.187 -0.461 . . . . 70.310000000000002 111.122 179.904 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 2.8 mp -142.46 3.28 0.4 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.157 -0.474 . . . . 75.340000000000003 111.149 179.892 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' SER . . . . . 0.785 ' C ' ' HD2' ' A' ' 19' ' ' PRO . 0.5 OUTLIER -100.27 -68.24 0.05 OUTLIER Pre-proline 0 C--N 1.33 -0.272 0 CA-C-O 121.688 0.756 . . . . 75.299999999999997 110.926 -179.965 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . 0.908 ' N ' ' HD2' ' A' ' 19' ' ' PRO . 53.8 Cg_endo -69.79 -27.8 25.88 Favored 'Trans proline' 0 C--N 1.342 0.206 0 C-N-CA 122.681 2.254 . . . . 73.129999999999995 112.362 179.946 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' PRO . . . . . 0.908 ' HD2' ' N ' ' A' ' 18' ' ' PRO . 53.5 Cg_endo -69.77 -16.46 37.54 Favored 'Trans proline' 0 C--N 1.342 0.205 0 C-N-CA 122.717 2.278 . . . . 74.430000000000007 112.32 179.949 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -81.94 -19.91 39.72 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.249 -0.432 . . . . 73.019999999999996 110.909 -179.954 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -58.57 -34.34 70.96 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.136 -0.484 . . . . 72.450000000000003 110.866 -179.934 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.296 0 C-N-CA 120.775 -0.726 . . . . 64.109999999999999 112.488 -179.906 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' TRP . . . . . . . . . . . . . 43.0 m0 . . . . . 0 C--O 1.231 0.095 0 CA-C-O 120.787 0.327 . . . . 70.230000000000004 110.892 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 2.6 mpp_? -56.3 160.58 4.85 Favored Pre-proline 0 C--N 1.329 -0.302 0 CA-C-O 121.596 0.712 . . . . 71.010000000000005 110.879 -179.961 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.75 109.62 2.35 Favored 'Trans proline' 0 C--N 1.341 0.184 0 C-N-CA 122.658 2.239 . . . . 75.010000000000005 112.354 180.0 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 5.7 t80 -134.91 -65.46 0.62 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.266 -0.425 . . . . 75.5 110.931 -179.911 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -79.96 -24.49 40.91 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.119 -0.492 . . . . 74.439999999999998 110.952 179.946 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -51.98 -50.83 60.5 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.152 -0.477 . . . . 75.099999999999994 110.911 179.948 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 11.1 t -66.62 -31.68 72.53 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.202 -0.454 . . . . 51.420000000000002 111.156 -179.949 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -55.51 -26.11 41.07 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.2 -0.455 . . . . 70.519999999999996 110.921 180.0 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 2.4 m-85 -94.82 -45.06 7.47 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.138 -0.483 . . . . 75.25 110.891 -179.858 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 22.7 m-85 -56.99 -28.53 62.5 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.128 -0.487 . . . . 63.450000000000003 110.908 -179.89 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 2.3 t70 -56.72 -27.22 58.77 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.101 -0.5 . . . . 71.439999999999998 110.828 179.964 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 64.1 t -95.93 -28.71 3.93 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.222 -0.444 . . . . 75.120000000000005 111.152 179.978 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 10.4 ttp -101.74 33.28 3.05 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.188 -0.46 . . . . 72.329999999999998 110.863 179.897 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 5.7 t -86.02 -3.97 59.06 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.219 -0.446 . . . . 72.219999999999999 111.162 -179.956 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . 0.647 ' C ' ' HG3' ' A' ' 19' ' ' PRO . 24.4 t -93.84 4.85 7.74 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.191 -0.459 . . . . 62.340000000000003 111.11 179.95 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 9.6 mt -143.47 3.04 0.34 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 116.177 -0.465 . . . . 72.299999999999997 111.121 179.943 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' SER . . . . . 0.8 ' C ' ' HD2' ' A' ' 19' ' ' PRO . 0.5 OUTLIER -100.18 -68.39 0.04 OUTLIER Pre-proline 0 C--N 1.329 -0.295 0 CA-C-O 121.613 0.72 . . . . 75.400000000000006 110.837 -179.911 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . 0.893 ' N ' ' HD2' ' A' ' 19' ' ' PRO . 54.0 Cg_endo -69.74 -27.89 26.01 Favored 'Trans proline' 0 C--O 1.232 0.203 0 C-N-CA 122.657 2.238 . . . . 72.310000000000002 112.339 179.983 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' PRO . . . . . 0.893 ' HD2' ' N ' ' A' ' 18' ' ' PRO . 54.1 Cg_endo -69.71 -16.78 37.91 Favored 'Trans proline' 0 C--N 1.341 0.155 0 C-N-CA 122.725 2.284 . . . . 74.409999999999997 112.383 179.921 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 24.4 tt0 -82.55 -21.26 35.41 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.177 -0.465 . . . . 73.129999999999995 110.906 179.991 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -58.22 -34.16 70.11 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.173 -0.467 . . . . 74.120000000000005 110.864 -179.92 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.292 0 C-N-CA 120.755 -0.736 . . . . 73.319999999999993 112.475 -179.957 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' TRP . . . . . . . . . . . . . 41.9 m0 . . . . . 0 C--O 1.231 0.097 0 CA-C-O 120.764 0.316 . . . . 74.319999999999993 110.891 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 53.9 73.27 0.94 Allowed Pre-proline 0 C--N 1.329 -0.297 0 CA-C-O 121.609 0.719 . . . . 75.230000000000004 110.862 -179.977 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.78 78.74 0.99 Allowed 'Trans proline' 0 C--N 1.341 0.145 0 C-N-CA 122.696 2.264 . . . . 74.040000000000006 112.326 179.99 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 5.5 t80 -135.27 -65.24 0.62 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.245 -0.434 . . . . 74.510000000000005 110.894 -179.897 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -80.55 -24.45 39.24 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.142 -0.481 . . . . 73.450000000000003 110.881 -179.993 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -51.89 -49.38 63.1 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.216 -0.447 . . . . 74.219999999999999 110.942 179.939 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 11.4 t -68.58 -31.43 70.62 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.215 -0.448 . . . . 74.409999999999997 111.13 -179.912 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -55.38 -28.39 53.68 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.212 -0.449 . . . . 73.430000000000007 110.905 179.98 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 1.3 m-85 -85.7 -45.26 11.84 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.153 -0.476 . . . . 75.430000000000007 110.885 -179.853 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 13.6 m-85 -62.75 -31.34 72.27 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.165 -0.47 . . . . 74.329999999999998 110.931 -179.903 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 16.6 t0 -54.21 -34.38 60.47 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.073 -0.512 . . . . 72.420000000000002 110.903 179.924 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 58.5 t -92.92 -28.12 4.52 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.21 -0.45 . . . . 73.230000000000004 111.142 179.982 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 10.5 ttp -102.08 33.88 2.9 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.167 -0.469 . . . . 73.129999999999995 110.906 179.878 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 5.6 t -86.67 -3.92 59.1 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.198 -0.455 . . . . 75.450000000000003 111.186 -179.944 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . 0.661 ' C ' ' HG3' ' A' ' 19' ' ' PRO . 25.0 t -93.07 3.49 8.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.17 -0.468 . . . . 64.450000000000003 111.094 179.937 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 2.8 mp -142.45 3.71 0.4 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.171 -0.468 . . . . 71.409999999999997 111.121 179.929 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' SER . . . . . 0.801 ' C ' ' HD2' ' A' ' 19' ' ' PRO . 0.5 OUTLIER -99.92 -68.77 0.04 OUTLIER Pre-proline 0 C--N 1.329 -0.303 0 CA-C-O 121.681 0.753 . . . . 63.130000000000003 110.904 -179.951 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . 0.895 ' N ' ' HD2' ' A' ' 19' ' ' PRO . 53.7 Cg_endo -69.82 -27.86 25.69 Favored 'Trans proline' 0 C--O 1.231 0.174 0 C-N-CA 122.675 2.25 . . . . 71.510000000000005 112.334 179.963 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' PRO . . . . . 0.895 ' HD2' ' N ' ' A' ' 18' ' ' PRO . 53.7 Cg_endo -69.78 -16.48 37.51 Favored 'Trans proline' 0 C--N 1.341 0.145 0 C-N-CA 122.701 2.267 . . . . 74.040000000000006 112.372 179.938 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 1.5 mt-10 -81.94 -19.89 39.75 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.193 -0.458 . . . . 74.340000000000003 110.911 -179.984 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -58.59 -34.43 71.08 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.119 -0.491 . . . . 75.540000000000006 110.848 -179.91 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.289 0 C-N-CA 120.715 -0.755 . . . . 73.349999999999994 112.529 -179.929 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' TRP . . . . . . . . . . . . . 33.8 m0 . . . . . 0 C--O 1.231 0.131 0 CA-C-O 120.779 0.323 . . . . 72.219999999999999 110.909 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -151.05 69.42 8.33 Favored Pre-proline 0 C--N 1.329 -0.298 0 CA-C-O 121.601 0.715 . . . . 73.109999999999999 110.876 -179.976 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.79 83.45 0.7 Allowed 'Trans proline' 0 C--N 1.341 0.141 0 C-N-CA 122.676 2.25 . . . . 75.219999999999999 112.307 -179.986 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 43.4 m-85 -134.17 -68.0 0.57 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.197 -0.456 . . . . 73.230000000000004 110.949 -179.94 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -76.74 -24.2 53.01 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.077 -0.51 . . . . 75.329999999999998 110.894 179.973 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 52.7 mm-40 -55.24 -57.63 11.0 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.167 -0.47 . . . . 74.430000000000007 110.945 179.9 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 15.1 t -53.52 -27.87 28.11 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.208 -0.451 . . . . 73.319999999999993 111.147 -179.922 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 4.1 tt0 -59.53 -20.92 59.02 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.201 -0.454 . . . . 75.209999999999994 110.915 179.959 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 0.9 OUTLIER -105.35 -18.75 14.02 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.136 -0.484 . . . . 75.030000000000001 110.954 -179.834 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 3.2 m-85 -51.47 -39.49 57.61 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.124 -0.489 . . . . 75.25 110.936 -179.913 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -51.94 -30.9 26.57 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.088 -0.505 . . . . 73.120000000000005 110.892 179.865 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 23.5 t -101.03 -26.83 3.49 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.214 -0.448 . . . . 63.520000000000003 111.152 179.988 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 10.5 ttp -102.12 33.97 2.88 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.112 -0.494 . . . . 75.219999999999999 110.878 179.937 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 5.7 t -86.68 -4.0 59.12 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.247 -0.433 . . . . 73.310000000000002 111.158 -179.927 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . 0.658 ' C ' ' HG3' ' A' ' 19' ' ' PRO . 25.0 t -92.98 3.43 8.18 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 116.198 -0.455 . . . . 65.109999999999999 111.129 179.932 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 2.8 mp -142.37 3.68 0.41 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.175 -0.466 . . . . 74.439999999999998 111.178 179.95 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' SER . . . . . 0.803 ' C ' ' HD2' ' A' ' 19' ' ' PRO . 0.5 OUTLIER -99.95 -68.81 0.04 OUTLIER Pre-proline 0 C--N 1.33 -0.268 0 CA-C-O 121.615 0.721 . . . . 73.439999999999998 110.846 -179.942 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . 0.908 ' N ' ' HD2' ' A' ' 19' ' ' PRO . 54.5 Cg_endo -69.68 -27.88 26.3 Favored 'Trans proline' 0 C--N 1.341 0.166 0 C-N-CA 122.681 2.254 . . . . 74.439999999999998 112.379 179.939 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' PRO . . . . . 0.908 ' HD2' ' N ' ' A' ' 18' ' ' PRO . 53.9 Cg_endo -69.75 -16.57 37.65 Favored 'Trans proline' 0 C--N 1.341 0.151 0 C-N-CA 122.689 2.259 . . . . 62.32 112.378 179.922 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -81.85 -19.91 40.04 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.186 -0.461 . . . . 74.019999999999996 110.906 -179.982 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -58.54 -33.4 69.85 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.14 -0.482 . . . . 74.120000000000005 110.883 -179.933 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.314 0 C-N-CA 120.715 -0.755 . . . . 72.439999999999998 112.516 -179.929 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 1' ' ' TRP . . . . . . . . . . . . . 37.9 m0 . . . . . 0 C--O 1.231 0.085 0 CA-C-O 120.795 0.331 . . . . 73.340000000000003 110.9 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -120.78 157.65 54.06 Favored Pre-proline 0 C--N 1.329 -0.285 0 CA-C-O 121.594 0.711 . . . . 74.329999999999998 110.892 -179.988 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.84 159.82 51.94 Favored 'Trans proline' 0 C--N 1.341 0.177 0 C-N-CA 122.708 2.272 . . . . 74.209999999999994 112.326 -179.99 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 37.5 m-85 -133.96 -63.95 0.72 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.22 -0.446 . . . . 75.150000000000006 110.94 -179.895 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -82.09 -24.39 35.23 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.105 -0.498 . . . . 73.549999999999997 110.907 179.948 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 7.8 mm-40 -55.06 -52.11 64.23 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.224 -0.443 . . . . 73.129999999999995 110.886 179.916 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 9.0 t -62.2 -32.53 73.19 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.213 -0.449 . . . . 75.040000000000006 111.141 -179.913 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -52.89 -29.27 27.33 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.223 -0.444 . . . . 71.400000000000006 110.906 179.974 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -82.55 -46.06 13.86 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.12 -0.491 . . . . 74.430000000000007 110.964 -179.858 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 14.6 m-85 -62.55 -30.31 71.22 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.081 -0.508 . . . . 74.439999999999998 110.945 -179.943 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 4.4 t70 -57.93 -44.7 87.06 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.093 -0.503 . . . . 73.450000000000003 110.888 179.913 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 61.9 t -83.62 -27.04 7.52 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-N 116.203 -0.453 . . . . 75.030000000000001 111.102 -179.973 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 10.3 ttp -101.94 33.76 2.92 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.191 -0.459 . . . . 73.450000000000003 110.906 179.908 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 5.8 t -86.48 -3.93 59.09 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.236 -0.438 . . . . 74.310000000000002 111.177 -179.972 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . 0.645 ' C ' ' HG3' ' A' ' 19' ' ' PRO . 24.1 t -93.85 4.07 8.22 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.207 -0.451 . . . . 75.400000000000006 111.111 179.924 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 2.8 mp -142.49 3.43 0.4 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.225 -0.443 . . . . 74.430000000000007 111.128 179.954 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 17' ' ' SER . . . . . 0.804 ' C ' ' HD2' ' A' ' 19' ' ' PRO . 0.5 OUTLIER -100.24 -68.39 0.04 OUTLIER Pre-proline 0 C--N 1.33 -0.239 0 CA-C-O 121.639 0.733 . . . . 55.229999999999997 110.832 -179.91 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . 0.891 ' N ' ' HD2' ' A' ' 19' ' ' PRO . 53.6 Cg_endo -69.73 -27.89 26.07 Favored 'Trans proline' 0 C--N 1.341 0.179 0 C-N-CA 122.746 2.297 . . . . 73.25 112.298 179.994 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 19' ' ' PRO . . . . . 0.891 ' HD2' ' N ' ' A' ' 18' ' ' PRO . 53.4 Cg_endo -69.76 -16.45 37.58 Favored 'Trans proline' 0 C--N 1.342 0.187 0 C-N-CA 122.687 2.258 . . . . 72.25 112.355 179.972 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -81.9 -19.88 39.92 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.235 -0.439 . . . . 71.239999999999995 110.924 179.987 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -58.68 -33.95 70.72 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.123 -0.49 . . . . 73.120000000000005 110.874 -179.928 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.326 0 C-N-CA 120.782 -0.723 . . . . 74.340000000000003 112.469 -179.962 . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 1' ' ' TRP . . . . . . . . . . . . . 2.3 t90 . . . . . 0 C--O 1.231 0.123 0 CA-C-O 120.787 0.327 . . . . 75.420000000000002 110.915 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 2.4 ptt180 -123.18 73.47 48.49 Favored Pre-proline 0 C--N 1.329 -0.297 0 CA-C-O 121.596 0.712 . . . . 74.230000000000004 110.846 -179.953 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.75 79.69 0.93 Allowed 'Trans proline' 0 C--O 1.232 0.184 0 C-N-CA 122.682 2.255 . . . . 74.439999999999998 112.358 179.959 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 5.2 t80 -135.92 -65.18 0.59 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.245 -0.434 . . . . 72.540000000000006 110.915 -179.882 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -80.29 -24.36 40.07 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.122 -0.49 . . . . 72.030000000000001 110.922 179.976 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 45.1 mt-30 -51.86 -50.41 60.99 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.2 -0.455 . . . . 64.519999999999996 110.949 179.875 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 11.3 t -67.29 -31.63 72.08 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.19 -0.459 . . . . 71.329999999999998 111.158 -179.953 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -56.6 -30.28 63.07 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.192 -0.458 . . . . 75.230000000000004 110.88 -179.958 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 1.2 m-85 -85.82 -44.29 12.59 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.157 -0.474 . . . . 75.209999999999994 110.974 -179.911 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 16.4 m-85 -62.39 -28.56 69.86 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.113 -0.494 . . . . 73.239999999999995 110.916 -179.919 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -54.7 -42.87 71.98 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.121 -0.49 . . . . 61.439999999999998 110.855 179.901 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 57.6 t -88.73 -25.84 5.7 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.192 -0.458 . . . . 74.099999999999994 111.122 -179.974 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 10.3 ttp -102.0 33.75 2.94 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.184 -0.462 . . . . 74.239999999999995 110.86 179.898 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 5.8 t -86.52 -3.89 59.09 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.234 -0.439 . . . . 65.329999999999998 111.136 -179.948 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . 0.662 ' C ' ' HG3' ' A' ' 19' ' ' PRO . 24.3 t -93.88 4.07 8.23 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.232 -0.44 . . . . 72.310000000000002 111.116 179.926 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 2.8 mp -142.44 3.4 0.4 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.188 -0.46 . . . . 75.540000000000006 111.143 179.911 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 17' ' ' SER . . . . . 0.801 ' C ' ' HD2' ' A' ' 19' ' ' PRO . 0.5 OUTLIER -100.2 -68.36 0.04 OUTLIER Pre-proline 0 C--N 1.329 -0.325 0 CA-C-O 121.642 0.734 . . . . 71.310000000000002 110.865 -179.88 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . 0.89 ' N ' ' HD2' ' A' ' 19' ' ' PRO . 53.5 Cg_endo -69.82 -27.88 25.62 Favored 'Trans proline' 0 C--N 1.341 0.158 0 C-N-CA 122.678 2.252 . . . . 74.209999999999994 112.323 179.985 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 19' ' ' PRO . . . . . 0.89 ' HD2' ' N ' ' A' ' 18' ' ' PRO . 53.9 Cg_endo -69.74 -16.82 37.81 Favored 'Trans proline' 0 C--N 1.341 0.168 0 C-N-CA 122.73 2.287 . . . . 73.409999999999997 112.323 179.929 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 29.4 tt0 -82.52 -21.29 35.46 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.243 -0.435 . . . . 74.120000000000005 110.887 -179.969 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -58.28 -31.34 67.37 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.144 -0.48 . . . . 74.430000000000007 110.842 -179.884 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.325 0 C-N-CA 120.716 -0.754 . . . . 64.5 112.52 -179.945 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 1' ' ' TRP . . . . . . . . . . . . . 3.3 t90 . . . . . 0 C--O 1.231 0.121 0 CA-C-O 120.78 0.324 . . . . 74.25 110.885 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -97.0 160.61 28.7 Favored Pre-proline 0 C--N 1.329 -0.305 0 CA-C-O 121.609 0.719 . . . . 73.150000000000006 110.89 -179.976 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.73 88.02 0.54 Allowed 'Trans proline' 0 C--O 1.232 0.194 0 C-N-CA 122.726 2.284 . . . . 62.299999999999997 112.395 179.967 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -138.43 -66.6 0.48 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.206 -0.452 . . . . 71.430000000000007 110.876 -179.878 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -77.86 -24.63 48.51 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.115 -0.493 . . . . 73.310000000000002 110.886 -179.966 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 6.8 mt-30 -53.68 -56.53 16.48 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.171 -0.468 . . . . 71.450000000000003 110.867 179.983 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 14.9 t -56.67 -27.21 58.3 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.184 -0.462 . . . . 73.510000000000005 111.162 -179.878 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -66.16 -16.41 63.95 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.207 -0.451 . . . . 74.239999999999995 110.871 179.999 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -101.08 -20.06 15.52 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.169 -0.469 . . . . 72.200000000000003 110.916 -179.853 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 3.6 m-85 -51.39 -36.7 44.65 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.14 -0.482 . . . . 74.420000000000002 110.905 -179.949 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 11.1 t0 -52.29 -31.41 32.72 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.127 -0.488 . . . . 73.510000000000005 110.878 179.932 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 60.8 t -102.42 -25.58 3.72 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.189 -0.46 . . . . 74.150000000000006 111.077 -179.946 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 10.4 ttp -102.2 34.27 2.79 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.193 -0.458 . . . . 64.430000000000007 110.895 179.923 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 5.6 t -86.85 -4.05 59.13 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.243 -0.435 . . . . 72.140000000000001 111.162 -179.964 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . 0.66 ' C ' ' HG3' ' A' ' 19' ' ' PRO . 24.6 t -93.0 3.45 8.18 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.217 -0.447 . . . . 61.229999999999997 111.09 179.93 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 2.8 mp -142.3 3.63 0.41 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 116.19 -0.459 . . . . 75.299999999999997 111.132 179.942 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 17' ' ' SER . . . . . 0.78 ' C ' ' HD2' ' A' ' 19' ' ' PRO . 0.5 OUTLIER -99.91 -68.8 0.04 OUTLIER Pre-proline 0 C--N 1.329 -0.326 0 CA-C-O 121.618 0.723 . . . . 73.439999999999998 110.869 -179.89 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . 0.897 ' N ' ' HD2' ' A' ' 19' ' ' PRO . 53.3 Cg_endo -69.77 -27.91 25.86 Favored 'Trans proline' 0 C--O 1.231 0.168 0 C-N-CA 122.738 2.292 . . . . 72.409999999999997 112.326 179.975 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 19' ' ' PRO . . . . . 0.897 ' HD2' ' N ' ' A' ' 18' ' ' PRO . 54.1 Cg_endo -69.76 -16.24 37.48 Favored 'Trans proline' 0 C--N 1.341 0.181 0 C-N-CA 122.715 2.276 . . . . 72.329999999999998 112.335 179.956 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 1.8 mt-10 -82.12 -19.74 39.45 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.221 -0.445 . . . . 74.299999999999997 110.891 -179.973 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -59.39 -25.6 64.41 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.167 -0.469 . . . . 75.200000000000003 110.88 -179.891 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.45 -0.368 0 C-N-CA 120.771 -0.728 . . . . 74.120000000000005 112.513 -179.985 . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 1' ' ' TRP . . . . . . . . . . . . . 49.3 m0 . . . . . 0 C--O 1.231 0.097 0 CA-C-O 120.779 0.323 . . . . 74.310000000000002 110.859 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 53.35 68.34 3.01 Favored Pre-proline 0 C--N 1.329 -0.305 0 CA-C-O 121.63 0.729 . . . . 73.540000000000006 110.897 -179.962 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.71 -172.23 0.55 Allowed 'Trans proline' 0 C--N 1.342 0.189 0 C-N-CA 122.692 2.261 . . . . 74.519999999999996 112.355 179.975 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 39.9 m-85 -135.28 -63.47 0.68 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.224 -0.444 . . . . 73.319999999999993 110.951 -179.906 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -82.61 -24.43 33.87 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.094 -0.503 . . . . 74.519999999999996 110.935 179.943 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -56.58 -53.12 61.25 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.187 -0.461 . . . . 73.540000000000006 110.884 179.953 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 9.7 t -60.13 -33.51 72.24 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.198 -0.456 . . . . 71.409999999999997 111.163 -179.928 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -52.89 -29.26 27.31 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.18 -0.464 . . . . 71.409999999999997 110.877 -179.98 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 1.2 m-85 -94.85 -45.02 7.48 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.165 -0.471 . . . . 74.040000000000006 110.958 -179.879 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 24.4 m-85 -54.09 -33.74 58.4 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.101 -0.5 . . . . 74.040000000000006 110.924 -179.923 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -53.49 -34.61 58.69 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.114 -0.494 . . . . 72.129999999999995 110.862 179.951 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 47.5 t -85.06 -30.48 6.71 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.218 -0.446 . . . . 73.129999999999995 111.092 -179.965 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 10.4 ttp -102.01 33.9 2.89 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.163 -0.471 . . . . 73.140000000000001 110.92 179.903 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 5.6 t -86.71 -3.91 59.11 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.206 -0.452 . . . . 73.349999999999994 111.175 -179.913 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . 0.651 ' C ' ' HG3' ' A' ' 19' ' ' PRO . 24.7 t -93.04 3.44 8.21 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.194 -0.457 . . . . 74.099999999999994 111.155 179.866 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 2.8 mp -142.31 3.67 0.41 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.17 -0.468 . . . . 71.140000000000001 111.138 179.89 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 17' ' ' SER . . . . . 0.784 ' C ' ' HD2' ' A' ' 19' ' ' PRO . 0.5 OUTLIER -99.91 -68.78 0.04 OUTLIER Pre-proline 0 C--N 1.33 -0.274 0 CA-C-O 121.664 0.745 . . . . 74.219999999999999 110.848 -179.889 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . 0.892 ' N ' ' HD2' ' A' ' 19' ' ' PRO . 53.6 Cg_endo -69.75 -27.95 25.91 Favored 'Trans proline' 0 C--N 1.341 0.167 0 C-N-CA 122.752 2.301 . . . . 73.439999999999998 112.335 179.974 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 19' ' ' PRO . . . . . 0.892 ' HD2' ' N ' ' A' ' 18' ' ' PRO . 53.7 Cg_endo -69.81 -16.71 37.48 Favored 'Trans proline' 0 C--N 1.342 0.188 0 C-N-CA 122.66 2.24 . . . . 75.439999999999998 112.361 179.939 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 60.2 tt0 -82.63 -21.28 35.13 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.216 -0.447 . . . . 74.109999999999999 110.854 179.994 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -58.19 -34.24 70.15 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.223 -0.444 . . . . 74.450000000000003 110.83 -179.876 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.271 0 C-N-CA 120.754 -0.736 . . . . 72.049999999999997 112.465 -179.953 . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 1' ' ' TRP . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.231 0.109 0 CA-C-O 120.745 0.307 . . . . 72.319999999999993 110.936 . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 5.4 tpt180 -166.19 73.15 1.22 Allowed Pre-proline 0 C--N 1.329 -0.303 0 CA-C-O 121.611 0.719 . . . . 73.439999999999998 110.916 -179.929 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.76 93.31 0.52 Allowed 'Trans proline' 0 C--O 1.232 0.202 0 C-N-CA 122.703 2.269 . . . . 75.319999999999993 112.324 -179.965 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 1.0 OUTLIER -83.33 -32.53 26.23 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.254 -0.43 . . . . 74.319999999999993 110.897 -179.923 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -105.02 -32.66 8.62 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.174 -0.466 . . . . 74.140000000000001 110.916 179.978 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -51.85 -43.19 63.1 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.207 -0.451 . . . . 73.340000000000003 110.919 179.932 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 12.5 t -85.44 -27.75 25.52 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.203 -0.453 . . . . 71.409999999999997 111.136 -179.929 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 2.5 tt0 -68.76 -33.3 73.66 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.238 -0.437 . . . . 75.420000000000002 110.885 -179.998 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 2.5 t80 -70.05 -36.33 74.91 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.159 -0.473 . . . . 74.519999999999996 110.898 -179.839 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 23.4 m-85 -63.17 -32.27 73.62 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.116 -0.493 . . . . 73.200000000000003 110.914 -179.916 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -56.17 -29.22 60.54 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.136 -0.484 . . . . 64.420000000000002 110.854 179.938 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 53.4 t -94.39 -29.52 4.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.223 -0.444 . . . . 73.329999999999998 111.135 180.0 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 10.5 ttp -101.68 33.22 3.06 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.171 -0.468 . . . . 73.099999999999994 110.9 179.887 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 5.7 t -85.92 -4.01 59.06 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.223 -0.444 . . . . 75.439999999999998 111.14 -179.94 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . 0.655 ' C ' ' HG3' ' A' ' 19' ' ' PRO . 24.5 t -93.78 4.77 7.76 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.229 -0.441 . . . . 73.120000000000005 111.13 179.966 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 9.7 mt -143.49 3.2 0.34 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.156 -0.474 . . . . 71.329999999999998 111.097 179.927 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 17' ' ' SER . . . . . 0.784 ' C ' ' HD2' ' A' ' 19' ' ' PRO . 0.5 OUTLIER -100.27 -68.42 0.04 OUTLIER Pre-proline 0 C--N 1.329 -0.291 0 CA-C-O 121.674 0.749 . . . . 73.349999999999994 110.839 -179.911 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . 0.89 ' N ' ' HD2' ' A' ' 19' ' ' PRO . 54.4 Cg_endo -69.71 -27.88 26.17 Favored 'Trans proline' 0 C--O 1.232 0.184 0 C-N-CA 122.683 2.255 . . . . 73.439999999999998 112.373 179.933 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 19' ' ' PRO . . . . . 0.89 ' HD2' ' N ' ' A' ' 18' ' ' PRO . 54.4 Cg_endo -69.72 -16.43 37.74 Favored 'Trans proline' 0 C--N 1.341 0.149 0 C-N-CA 122.693 2.262 . . . . 72.099999999999994 112.38 179.906 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 2.9 mt-10 -81.91 -19.92 39.83 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.194 -0.457 . . . . 75.019999999999996 110.901 -179.998 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -58.61 -34.4 71.09 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.127 -0.488 . . . . 73.230000000000004 110.914 -179.916 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.266 0 C-N-CA 120.766 -0.731 . . . . 45.149999999999999 112.472 -179.981 . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 1' ' ' TRP . . . . . . . . . . . . . 53.8 m0 . . . . . 0 C--O 1.231 0.096 0 CA-C-O 120.752 0.311 . . . . 75.439999999999998 110.934 . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 4.3 mpt_? 57.81 72.26 0.93 Allowed Pre-proline 0 C--N 1.33 -0.282 0 CA-C-O 121.559 0.695 . . . . 74.140000000000001 110.882 -179.927 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_endo -69.81 -171.0 0.43 Allowed 'Trans proline' 0 C--N 1.341 0.182 0 C-N-CA 122.655 2.237 . . . . 74.5 112.326 -179.996 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 6.3 m-85 66.21 121.64 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.178 -0.465 . . . . 75.120000000000005 110.931 -179.876 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -152.34 -41.15 0.11 Allowed 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.138 -0.483 . . . . 64.409999999999997 110.929 179.97 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -49.94 -43.59 50.03 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.184 -0.462 . . . . 74.319999999999993 110.908 179.988 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 10.2 t -90.59 -30.88 16.94 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.214 -0.448 . . . . 74.109999999999999 111.13 -179.946 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 1.1 mt-10 -68.19 -20.6 64.87 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.196 -0.456 . . . . 54.240000000000002 110.875 -179.967 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 1.6 t80 -84.1 -38.28 20.96 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.139 -0.482 . . . . 65.409999999999997 110.923 -179.88 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 20.7 m-85 -56.6 -29.17 61.83 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.118 -0.492 . . . . 71.540000000000006 110.889 -179.901 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 2.6 m-20 -66.05 -43.69 86.73 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.14 -0.482 . . . . 74.340000000000003 110.865 179.919 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 26.0 t -78.62 -28.71 14.42 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.218 -0.446 . . . . 73.129999999999995 111.086 -179.97 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 10.6 ttp -101.93 33.43 3.04 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.215 -0.448 . . . . 75.120000000000005 110.894 179.901 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 5.5 t -86.12 -4.04 59.08 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.194 -0.457 . . . . 74.530000000000001 111.139 -179.94 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . 0.635 ' C ' ' HG3' ' A' ' 19' ' ' PRO . 25.8 t -92.89 4.15 7.66 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-N 116.228 -0.442 . . . . 64.329999999999998 111.113 179.901 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 9.3 mt -143.34 3.4 0.35 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.195 -0.457 . . . . 73.239999999999995 111.102 179.901 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 17' ' ' SER . . . . . 0.79 ' C ' ' HD2' ' A' ' 19' ' ' PRO . 0.5 OUTLIER -99.9 -68.75 0.04 OUTLIER Pre-proline 0 C--N 1.329 -0.295 0 CA-C-O 121.683 0.754 . . . . 74.439999999999998 110.882 -179.94 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . 0.909 ' N ' ' HD2' ' A' ' 19' ' ' PRO . 53.3 Cg_endo -69.83 -27.79 25.72 Favored 'Trans proline' 0 C--N 1.341 0.168 0 C-N-CA 122.673 2.248 . . . . 74.230000000000004 112.333 179.994 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 19' ' ' PRO . . . . . 0.909 ' HD2' ' N ' ' A' ' 18' ' ' PRO . 53.3 Cg_endo -69.82 -16.43 37.3 Favored 'Trans proline' 0 C--N 1.342 0.193 0 C-N-CA 122.683 2.255 . . . . 72.420000000000002 112.301 179.957 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -81.91 -19.55 40.57 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.267 -0.424 . . . . 74.420000000000002 110.872 -179.965 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -59.78 -25.77 65.18 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.144 -0.48 . . . . 73.329999999999998 110.827 -179.887 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.299 0 C-N-CA 120.75 -0.738 . . . . 62.439999999999998 112.527 -179.991 . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 1' ' ' TRP . . . . . . . . . . . . . 42.8 m0 . . . . . 0 C--O 1.232 0.137 0 CA-C-O 120.763 0.316 . . . . 74.409999999999997 110.925 . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 1.2 mpt_? -117.87 71.32 7.84 Favored Pre-proline 0 C--N 1.328 -0.339 0 CA-C-O 121.621 0.724 . . . . 75.219999999999999 110.884 -179.937 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_endo -69.77 136.69 33.6 Favored 'Trans proline' 0 C--O 1.232 0.191 0 C-N-CA 122.672 2.248 . . . . 74.030000000000001 112.326 -179.975 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 0.8 OUTLIER -116.78 -32.33 5.17 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.238 -0.437 . . . . 74.349999999999994 110.923 -179.911 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -103.93 -31.29 9.82 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.15 -0.477 . . . . 74.450000000000003 110.941 179.949 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -51.21 -43.99 61.53 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.167 -0.469 . . . . 71.140000000000001 110.934 179.914 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 14.2 t -81.45 -26.01 35.66 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.238 -0.437 . . . . 61.420000000000002 111.142 -179.959 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 29.5 tp10 -68.88 -43.5 75.21 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.217 -0.447 . . . . 74.439999999999998 110.918 179.993 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 2.3 t80 -59.36 -34.93 72.99 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.139 -0.482 . . . . 74.430000000000007 110.927 -179.884 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 22.0 m-85 -66.98 -26.77 66.97 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.141 -0.481 . . . . 71.120000000000005 110.933 -179.955 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 17.3 t0 -58.78 -34.09 71.06 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.138 -0.483 . . . . 74.239999999999995 110.86 179.911 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 56.4 t -90.5 -27.51 5.05 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.21 -0.45 . . . . 74.349999999999994 111.154 -179.998 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 10.4 ttp -102.23 33.7 3.0 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.117 -0.492 . . . . 74.129999999999995 110.883 179.931 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 5.8 t -86.49 -3.89 59.08 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.203 -0.453 . . . . 73.340000000000003 111.153 -179.912 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . 0.662 ' C ' ' HG3' ' A' ' 19' ' ' PRO . 24.0 t -93.88 4.07 8.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.186 -0.461 . . . . 71.109999999999999 111.131 179.928 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 2.8 mp -142.47 3.41 0.4 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.172 -0.467 . . . . 74.310000000000002 111.176 179.898 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 17' ' ' SER . . . . . 0.793 ' C ' ' HD2' ' A' ' 19' ' ' PRO . 0.5 OUTLIER -100.16 -68.48 0.04 OUTLIER Pre-proline 0 C--N 1.328 -0.33 0 CA-C-O 121.654 0.74 . . . . 73.209999999999994 110.877 -179.941 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . 0.89 ' N ' ' HD2' ' A' ' 19' ' ' PRO . 53.6 Cg_endo -69.74 -27.84 26.09 Favored 'Trans proline' 0 C--N 1.341 0.178 0 C-N-CA 122.701 2.268 . . . . 74.109999999999999 112.344 179.987 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 19' ' ' PRO . . . . . 0.89 ' HD2' ' N ' ' A' ' 18' ' ' PRO . 53.5 Cg_endo -69.77 -16.5 37.55 Favored 'Trans proline' 0 C--N 1.342 0.216 0 C-N-CA 122.685 2.257 . . . . 74.400000000000006 112.339 179.943 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -81.85 -19.85 40.16 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.222 -0.444 . . . . 74.099999999999994 110.908 179.999 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -58.65 -34.52 71.29 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.172 -0.467 . . . . 74.129999999999995 110.832 -179.9 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.352 0 C-N-CA 120.744 -0.741 . . . . 70.109999999999999 112.506 -179.946 . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 1' ' ' TRP . . . . . . . . . . . . . 44.4 m0 . . . . . 0 C--O 1.231 0.13 0 CA-C-O 120.799 0.333 . . . . 70.219999999999999 110.926 . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -55.1 160.55 3.1 Favored Pre-proline 0 C--N 1.329 -0.315 0 CA-C-O 121.59 0.709 . . . . 75.299999999999997 110.856 -179.919 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.71 95.48 0.55 Allowed 'Trans proline' 0 C--O 1.231 0.162 0 C-N-CA 122.729 2.286 . . . . 73.140000000000001 112.359 179.964 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 1.2 t80 -93.91 -32.6 13.83 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.245 -0.434 . . . . 75.420000000000002 110.927 -179.923 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -105.05 -32.7 8.59 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.117 -0.492 . . . . 74.340000000000003 110.871 179.999 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -51.88 -43.17 63.18 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.224 -0.443 . . . . 72.319999999999993 110.893 179.975 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 12.4 t -85.37 -27.84 25.58 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.196 -0.456 . . . . 72.329999999999998 111.137 -179.906 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 1.3 tt0 -68.73 -33.17 73.48 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.176 -0.465 . . . . 75.25 110.874 -179.966 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 2.5 t80 -70.26 -36.25 74.31 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.129 -0.487 . . . . 73.010000000000005 110.935 -179.841 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 23.4 m-85 -63.15 -28.18 69.88 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.121 -0.49 . . . . 74.439999999999998 110.873 -179.912 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 12.0 t0 -61.88 -47.42 85.08 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.128 -0.487 . . . . 75.329999999999998 110.906 179.917 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 21.9 t -76.25 -27.31 17.64 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-N 116.181 -0.463 . . . . 71.299999999999997 111.149 179.981 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 10.5 ttp -102.21 33.85 2.94 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.182 -0.463 . . . . 64.420000000000002 110.856 179.939 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 5.6 t -86.62 -3.98 59.11 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.23 -0.441 . . . . 73.209999999999994 111.145 -179.939 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . 0.652 ' C ' ' HG3' ' A' ' 19' ' ' PRO . 25.3 t -93.01 3.47 8.17 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.201 -0.454 . . . . 74.010000000000005 111.143 179.912 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 2.8 mp -142.39 3.68 0.41 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.139 -0.482 . . . . 74.540000000000006 111.127 179.913 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 17' ' ' SER . . . . . 0.789 ' C ' ' HD2' ' A' ' 19' ' ' PRO . 0.5 OUTLIER -99.9 -68.78 0.04 OUTLIER Pre-proline 0 C--N 1.329 -0.287 0 CA-C-O 121.678 0.751 . . . . 62.420000000000002 110.831 -179.906 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . 0.903 ' N ' ' HD2' ' A' ' 19' ' ' PRO . 54.0 Cg_endo -69.78 -27.88 25.86 Favored 'Trans proline' 0 C--O 1.232 0.182 0 C-N-CA 122.664 2.243 . . . . 73.439999999999998 112.361 179.982 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 19' ' ' PRO . . . . . 0.903 ' HD2' ' N ' ' A' ' 18' ' ' PRO . 53.6 Cg_endo -69.82 -16.38 37.3 Favored 'Trans proline' 0 C--N 1.341 0.155 0 C-N-CA 122.713 2.275 . . . . 72.129999999999995 112.322 179.964 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -82.01 -19.85 39.63 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.248 -0.433 . . . . 75.319999999999993 110.868 -179.977 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -58.66 -34.36 71.14 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.12 -0.491 . . . . 74.439999999999998 110.832 -179.88 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.45 -0.367 0 C-N-CA 120.696 -0.764 . . . . 73.010000000000005 112.529 -179.97 . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 1' ' ' TRP . . . . . . . . . . . . . 54.4 m0 . . . . . 0 C--O 1.231 0.122 0 CA-C-O 120.73 0.3 . . . . 74.230000000000004 110.959 . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -87.45 160.55 47.81 Favored Pre-proline 0 C--N 1.329 -0.307 0 CA-C-O 121.655 0.741 . . . . 73.340000000000003 110.856 -179.964 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.73 120.2 7.03 Favored 'Trans proline' 0 C--N 1.342 0.214 0 C-N-CA 122.677 2.251 . . . . 74.140000000000001 112.328 -179.985 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -101.98 -32.57 10.12 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.157 -0.474 . . . . 74.0 110.914 -179.909 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -104.98 -32.72 8.61 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.143 -0.48 . . . . 72.310000000000002 110.921 179.953 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -51.86 -43.16 63.12 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.182 -0.463 . . . . 72.400000000000006 110.925 179.946 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 12.5 t -85.39 -27.94 25.48 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.196 -0.456 . . . . 65.349999999999994 111.142 -179.921 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -68.5 -33.86 74.88 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.197 -0.456 . . . . 74.219999999999999 110.923 179.974 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 2.5 t80 -69.41 -36.37 76.65 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.144 -0.48 . . . . 74.510000000000005 110.968 -179.918 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 23.3 m-85 -63.27 -30.33 71.49 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.129 -0.487 . . . . 74.310000000000002 110.969 -179.952 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 4.7 t70 -56.47 -40.2 74.47 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.124 -0.489 . . . . 74.349999999999994 110.88 179.909 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 25.9 t -84.04 -27.9 7.25 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.186 -0.461 . . . . 74.430000000000007 111.127 179.996 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 10.5 ttp -102.22 33.93 2.92 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.146 -0.479 . . . . 75.540000000000006 110.878 179.959 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 5.7 t -86.7 -3.91 59.11 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.213 -0.449 . . . . 71.109999999999999 111.118 -179.897 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . 0.661 ' C ' ' HG3' ' A' ' 19' ' ' PRO . 25.1 t -93.06 3.48 8.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.233 -0.44 . . . . 71.150000000000006 111.171 179.884 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 2.8 mp -142.36 3.63 0.41 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.108 -0.497 . . . . 73.439999999999998 111.128 179.912 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 17' ' ' SER . . . . . 0.788 ' C ' ' HD2' ' A' ' 19' ' ' PRO . 0.5 OUTLIER -99.89 -68.8 0.04 OUTLIER Pre-proline 0 C--N 1.329 -0.287 0 CA-C-O 121.631 0.729 . . . . 71.349999999999994 110.874 -179.914 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . 0.893 ' N ' ' HD2' ' A' ' 19' ' ' PRO . 53.9 Cg_endo -69.75 -27.88 25.99 Favored 'Trans proline' 0 C--N 1.341 0.175 0 C-N-CA 122.672 2.248 . . . . 73.510000000000005 112.387 179.952 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 19' ' ' PRO . . . . . 0.893 ' HD2' ' N ' ' A' ' 18' ' ' PRO . 53.4 Cg_endo -69.79 -16.43 37.44 Favored 'Trans proline' 0 C--N 1.342 0.203 0 C-N-CA 122.686 2.258 . . . . 54.420000000000002 112.323 179.97 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -81.95 -19.83 39.85 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.228 -0.442 . . . . 72.140000000000001 110.893 -179.991 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -58.65 -32.52 69.15 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.145 -0.479 . . . . 74.219999999999999 110.904 -179.919 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.312 0 C-N-CA 120.771 -0.728 . . . . 73.25 112.494 -179.94 . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 1' ' ' TRP . . . . . . . . . . . . . 2.5 t90 . . . . . 0 C--O 1.231 0.121 0 CA-C-O 120.752 0.31 . . . . 74.129999999999995 110.948 . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 2.0 mpp_? -113.75 73.85 2.3 Favored Pre-proline 0 C--N 1.329 -0.326 0 CA-C-O 121.611 0.72 . . . . 74.329999999999998 110.865 -179.924 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.74 -172.18 0.55 Allowed 'Trans proline' 0 C--N 1.341 0.184 0 C-N-CA 122.681 2.254 . . . . 73.109999999999999 112.344 179.99 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 9.9 m-85 66.16 121.23 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.173 -0.467 . . . . 74.109999999999999 110.946 -179.901 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -152.69 -41.19 0.1 Allowed 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.141 -0.482 . . . . 75.030000000000001 110.923 179.975 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -49.84 -43.79 49.11 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.192 -0.458 . . . . 73.010000000000005 110.929 179.935 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 10.2 t -90.39 -30.81 17.16 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.222 -0.445 . . . . 74.129999999999995 111.152 -179.958 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 1.6 mm-40 -68.13 -20.53 64.91 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.251 -0.431 . . . . 74.219999999999999 110.875 -179.996 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 1.6 t80 -84.29 -38.21 20.72 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.153 -0.476 . . . . 71.299999999999997 110.89 -179.823 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 20.9 m-85 -56.82 -34.77 68.05 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.148 -0.478 . . . . 72.310000000000002 110.89 -179.879 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 41.0 m-20 -59.84 -47.93 83.74 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.122 -0.49 . . . . 73.019999999999996 110.843 179.958 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 39.7 t -77.05 -28.19 16.64 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 116.184 -0.462 . . . . 73.209999999999994 111.139 179.972 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 10.4 ttp -102.0 33.98 2.86 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.174 -0.466 . . . . 62.039999999999999 110.871 179.939 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 5.8 t -86.64 -3.87 59.09 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.258 -0.428 . . . . 73.099999999999994 111.108 -179.896 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . 0.657 ' C ' ' HG3' ' A' ' 19' ' ' PRO . 24.7 t -93.77 3.97 8.23 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.23 -0.441 . . . . 75.219999999999999 111.141 179.885 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 2.8 mp -142.52 3.49 0.4 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.183 -0.462 . . . . 75.040000000000006 111.099 179.922 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 17' ' ' SER . . . . . 0.791 ' C ' ' HD2' ' A' ' 19' ' ' PRO . 0.5 OUTLIER -100.25 -68.42 0.04 OUTLIER Pre-proline 0 C--N 1.329 -0.305 0 CA-C-O 121.656 0.741 . . . . 74.030000000000001 110.85 -179.923 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . 0.908 ' N ' ' HD2' ' A' ' 19' ' ' PRO . 53.7 Cg_endo -69.76 -27.81 26.01 Favored 'Trans proline' 0 C--N 1.342 0.199 0 C-N-CA 122.612 2.208 . . . . 72.319999999999993 112.363 179.97 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 19' ' ' PRO . . . . . 0.908 ' HD2' ' N ' ' A' ' 18' ' ' PRO . 53.8 Cg_endo -69.74 -16.52 37.68 Favored 'Trans proline' 0 C--N 1.341 0.156 0 C-N-CA 122.699 2.266 . . . . 75.019999999999996 112.326 179.948 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 2.1 mt-10 -81.88 -19.94 39.86 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.216 -0.447 . . . . 73.319999999999993 110.907 -179.975 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -58.56 -33.13 69.59 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.145 -0.479 . . . . 73.200000000000003 110.858 -179.908 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.286 0 C-N-CA 120.725 -0.75 . . . . 63.32 112.489 -179.964 . . . . . . . . 0 0 . 1 . 021 nuclear orig full ' A' A ' 1' ' ' TRP . . . . . . . . . . . . . 54.5 m0 . . . . . 0 C--O 1.23 0.071 0 CA-C-O 120.736 0.303 . . . . 70.510000000000005 110.925 . . . . . . . . . 0 0 . 1 . 021 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 13.1 mmm180 -121.64 70.89 26.86 Favored Pre-proline 0 C--N 1.329 -0.298 0 CA-C-O 121.658 0.742 . . . . 73.340000000000003 110.865 -179.941 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_endo -69.74 172.03 13.37 Favored 'Trans proline' 0 C--N 1.342 0.196 0 C-N-CA 122.704 2.27 . . . . 72.439999999999998 112.393 179.969 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 13.0 p90 -166.74 123.27 1.23 Allowed 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.229 -0.441 . . . . 65.310000000000002 110.932 -179.883 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -158.0 -40.84 0.06 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.112 -0.495 . . . . 74.329999999999998 110.897 179.967 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -50.37 -47.87 56.02 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.189 -0.459 . . . . 75.140000000000001 110.904 179.966 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 14.4 t -76.41 -23.37 54.02 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.189 -0.459 . . . . 73.239999999999995 111.176 -179.95 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 11.5 tt0 -79.97 -20.11 46.3 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.192 -0.458 . . . . 74.510000000000005 110.884 179.983 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 1.4 t80 -87.13 -30.43 21.08 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.161 -0.472 . . . . 75.310000000000002 110.929 -179.88 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 22.5 m-85 -65.35 -32.89 74.76 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.136 -0.484 . . . . 74.340000000000003 110.94 -179.941 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -57.94 -36.92 73.21 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.113 -0.494 . . . . 72.420000000000002 110.885 179.914 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 56.4 t -77.77 -33.02 18.37 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.146 -0.479 . . . . 74.310000000000002 111.146 -179.983 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 10.6 ttp -101.91 33.43 3.03 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.124 -0.489 . . . . 73.400000000000006 110.906 179.906 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 5.5 t -86.15 -4.04 59.08 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.178 -0.465 . . . . 65.25 111.099 -179.908 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . 0.639 ' C ' ' HG3' ' A' ' 19' ' ' PRO . 25.5 t -92.91 4.11 7.7 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.262 -0.426 . . . . 73.349999999999994 111.095 179.948 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 9.4 mt -143.28 3.37 0.35 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.196 -0.456 . . . . 65.120000000000005 111.172 179.913 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 17' ' ' SER . . . . . 0.786 ' C ' ' HD2' ' A' ' 19' ' ' PRO . 0.5 OUTLIER -99.98 -68.78 0.04 OUTLIER Pre-proline 0 C--N 1.33 -0.274 0 CA-C-O 121.633 0.73 . . . . 74.329999999999998 110.825 -179.843 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . 0.906 ' N ' ' HD2' ' A' ' 19' ' ' PRO . 53.6 Cg_endo -69.79 -27.83 25.87 Favored 'Trans proline' 0 C--O 1.231 0.171 0 C-N-CA 122.72 2.28 . . . . 71.549999999999997 112.339 179.96 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 19' ' ' PRO . . . . . 0.906 ' HD2' ' N ' ' A' ' 18' ' ' PRO . 53.9 Cg_endo -69.75 -16.47 37.61 Favored 'Trans proline' 0 C--N 1.341 0.137 0 C-N-CA 122.697 2.265 . . . . 75.230000000000004 112.341 179.917 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -82.0 -19.39 40.6 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.249 -0.432 . . . . 75.239999999999995 110.866 -179.952 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -59.69 -25.7 64.98 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.168 -0.469 . . . . 74.310000000000002 110.866 -179.936 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.315 0 C-N-CA 120.718 -0.753 . . . . 71.299999999999997 112.502 -179.983 . . . . . . . . 0 0 . 1 . 022 nuclear orig full ' A' A ' 1' ' ' TRP . . . . . . . . . . . . . 37.1 m0 . . . . . 0 C--O 1.231 0.124 0 CA-C-O 120.772 0.32 . . . . 72.420000000000002 110.936 . . . . . . . . . 0 0 . 1 . 022 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 6.1 mtt85 54.31 73.3 0.92 Allowed Pre-proline 0 C--N 1.329 -0.283 0 CA-C-O 121.606 0.717 . . . . 72.329999999999998 110.919 -179.924 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_endo -69.74 -172.59 0.59 Allowed 'Trans proline' 0 C--N 1.341 0.167 0 C-N-CA 122.712 2.274 . . . . 72.319999999999993 112.322 -179.948 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 84.7 m-85 -151.78 119.77 6.23 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.207 -0.451 . . . . 74.120000000000005 110.939 -179.917 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -151.53 -40.88 0.12 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.155 -0.475 . . . . 73.129999999999995 110.932 179.964 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -49.52 -43.91 45.98 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.174 -0.466 . . . . 71.099999999999994 110.954 179.895 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 9.9 t -90.49 -31.0 16.96 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.19 -0.459 . . . . 71.450000000000003 111.178 -179.984 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -68.08 -19.55 64.87 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.22 -0.445 . . . . 73.540000000000006 110.888 179.977 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 1.7 t80 -85.46 -38.21 18.88 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.148 -0.478 . . . . 73.109999999999999 110.899 -179.843 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 20.8 m-85 -56.65 -30.82 63.76 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.138 -0.483 . . . . 65.540000000000006 110.927 -179.925 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 37.4 m-20 -63.58 -46.15 87.17 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.163 -0.472 . . . . 73.530000000000001 110.854 179.913 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 37.7 t -79.61 -26.92 12.59 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-N 116.193 -0.458 . . . . 63.229999999999997 111.145 179.999 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 10.4 ttp -102.11 33.91 2.9 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.186 -0.461 . . . . 71.120000000000005 110.868 179.944 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 5.6 t -86.65 -3.94 59.11 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.224 -0.443 . . . . 71.25 111.156 -179.922 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . 0.65 ' C ' ' HG3' ' A' ' 19' ' ' PRO . 25.2 t -93.01 3.45 8.18 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-N 116.206 -0.452 . . . . 74.430000000000007 111.147 179.912 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 2.8 mp -142.35 3.61 0.41 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.161 -0.472 . . . . 74.409999999999997 111.159 179.964 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 17' ' ' SER . . . . . 0.777 ' C ' ' HD2' ' A' ' 19' ' ' PRO . 0.5 OUTLIER -99.92 -68.74 0.04 OUTLIER Pre-proline 0 C--N 1.329 -0.302 0 CA-C-O 121.673 0.749 . . . . 73.120000000000005 110.885 -179.882 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . 0.909 ' N ' ' HD2' ' A' ' 19' ' ' PRO . 53.4 Cg_endo -69.85 -27.88 25.51 Favored 'Trans proline' 0 C--O 1.232 0.188 0 C-N-CA 122.681 2.254 . . . . 73.310000000000002 112.345 179.965 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 19' ' ' PRO . . . . . 0.909 ' HD2' ' N ' ' A' ' 18' ' ' PRO . 54.1 Cg_endo -69.68 -16.47 37.91 Favored 'Trans proline' 0 C--N 1.341 0.169 0 C-N-CA 122.693 2.262 . . . . 74.530000000000001 112.377 179.871 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -82.03 -19.45 40.36 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.215 -0.448 . . . . 64.319999999999993 110.907 -179.957 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -59.63 -25.74 64.92 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.182 -0.463 . . . . 72.230000000000004 110.892 -179.988 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.307 0 C-N-CA 120.75 -0.738 . . . . 71.310000000000002 112.486 -179.932 . . . . . . . . 0 0 . 1 . 023 nuclear orig full ' A' A ' 1' ' ' TRP . . . . . . . . . . . . . 2.2 t90 . . . . . 0 C--O 1.231 0.118 0 CA-C-O 120.775 0.321 . . . . 74.230000000000004 110.945 . . . . . . . . . 0 0 . 1 . 023 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 12.4 tpt180 53.22 73.6 0.91 Allowed Pre-proline 0 C--N 1.329 -0.291 0 CA-C-O 121.558 0.694 . . . . 74.200000000000003 110.866 -179.925 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.82 -17.01 37.54 Favored 'Trans proline' 0 C--N 1.341 0.158 0 C-N-CA 122.654 2.236 . . . . 71.140000000000001 112.356 179.983 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 20.7 m-85 66.52 125.52 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.217 -0.447 . . . . 75.319999999999993 110.94 -179.953 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -151.37 -41.98 0.12 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.118 -0.492 . . . . 75.439999999999998 110.908 179.972 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 4.0 tt0 -51.27 -48.06 62.32 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.182 -0.463 . . . . 75.230000000000004 110.907 179.912 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 14.4 t -76.94 -23.98 52.4 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.202 -0.453 . . . . 74.519999999999996 111.089 -179.881 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 14.4 tt0 -79.15 -19.92 49.81 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.255 -0.43 . . . . 72.510000000000005 110.9 179.989 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 1.2 t80 -87.27 -31.09 20.42 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.181 -0.463 . . . . 72.510000000000005 110.92 -179.844 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 22.7 m-85 -64.61 -29.33 70.35 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.141 -0.481 . . . . 72.510000000000005 110.899 -179.904 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 16.1 m-20 -61.12 -38.49 86.54 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.091 -0.504 . . . . 62.520000000000003 110.889 179.901 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 41.9 t -77.08 -31.39 18.48 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.181 -0.463 . . . . 75.209999999999994 111.141 179.986 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 10.5 ttp -101.95 33.39 3.06 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.185 -0.461 . . . . 72.430000000000007 110.91 179.873 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 5.5 t -86.17 -4.02 59.08 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.214 -0.448 . . . . 65.200000000000003 111.139 -179.925 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . 0.636 ' C ' ' HG3' ' A' ' 19' ' ' PRO . 25.4 t -92.85 4.15 7.63 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.208 -0.451 . . . . 74.329999999999998 111.167 179.87 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 9.4 mt -143.33 3.32 0.35 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.18 -0.463 . . . . 74.129999999999995 111.121 179.927 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 17' ' ' SER . . . . . 0.796 ' C ' ' HD2' ' A' ' 19' ' ' PRO . 0.5 OUTLIER -99.89 -68.72 0.04 OUTLIER Pre-proline 0 C--N 1.329 -0.31 0 CA-C-O 121.624 0.726 . . . . 62.530000000000001 110.882 -179.943 . . . . . . . . 3 3 . 1 . 023 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . 0.91 ' N ' ' HD2' ' A' ' 19' ' ' PRO . 53.2 Cg_endo -69.8 -27.86 25.76 Favored 'Trans proline' 0 C--O 1.232 0.178 0 C-N-CA 122.681 2.254 . . . . 75.219999999999999 112.32 -179.996 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 19' ' ' PRO . . . . . 0.91 ' HD2' ' N ' ' A' ' 18' ' ' PRO . 54.1 Cg_endo -69.73 -16.49 37.71 Favored 'Trans proline' 0 C--N 1.342 0.203 0 C-N-CA 122.732 2.288 . . . . 73.209999999999994 112.346 179.964 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -81.87 -19.92 39.94 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.195 -0.457 . . . . 71.510000000000005 110.902 -179.97 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -58.52 -33.37 69.77 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.129 -0.487 . . . . 71.0 110.871 -179.913 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.337 0 C-N-CA 120.782 -0.723 . . . . 72.219999999999999 112.49 -179.943 . . . . . . . . 0 0 . 1 . 024 nuclear orig full ' A' A ' 1' ' ' TRP . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.231 0.124 0 CA-C-O 120.734 0.302 . . . . 75.310000000000002 110.93 . . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -159.22 68.04 3.17 Favored Pre-proline 0 C--N 1.328 -0.349 0 CA-C-O 121.652 0.739 . . . . 73.430000000000007 110.926 -179.967 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.8 -32.7 17.88 Favored 'Trans proline' 0 C--N 1.342 0.196 0 C-N-CA 122.706 2.271 . . . . 75.549999999999997 112.353 -179.972 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 15.3 p90 -162.64 124.1 2.58 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.183 -0.462 . . . . 73.25 110.941 -179.93 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -157.2 -40.66 0.07 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.102 -0.499 . . . . 70.439999999999998 110.893 179.969 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -50.21 -43.01 52.47 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.162 -0.472 . . . . 72.310000000000002 110.957 179.911 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 9.8 t -91.36 -30.57 16.47 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.19 -0.459 . . . . 72.530000000000001 111.116 -179.89 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 4.4 mm-40 -68.47 -21.2 64.64 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.208 -0.451 . . . . 71.319999999999993 110.921 179.981 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 1.6 t80 -83.22 -38.48 22.2 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.146 -0.479 . . . . 75.120000000000005 110.909 -179.869 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 20.4 m-85 -56.09 -30.72 62.44 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.168 -0.469 . . . . 72.420000000000002 110.955 -179.952 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -65.07 -40.16 94.28 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.146 -0.479 . . . . 74.430000000000007 110.864 179.904 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 38.4 t -82.47 -28.24 8.8 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.24 -0.436 . . . . 75.519999999999996 111.163 179.99 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 10.4 ttp -102.0 33.84 2.9 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.18 -0.464 . . . . 74.340000000000003 110.861 179.902 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 5.8 t -86.52 -3.89 59.09 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.225 -0.443 . . . . 73.120000000000005 111.211 -179.986 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . 0.652 ' C ' ' HG3' ' A' ' 19' ' ' PRO . 24.1 t -93.85 4.04 8.24 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.183 -0.462 . . . . 70.120000000000005 111.1 179.933 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 2.8 mp -142.52 3.43 0.4 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-N 116.168 -0.469 . . . . 75.219999999999999 111.153 179.94 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 17' ' ' SER . . . . . 0.788 ' C ' ' HD2' ' A' ' 19' ' ' PRO . 0.5 OUTLIER -100.19 -68.42 0.04 OUTLIER Pre-proline 0 C--N 1.329 -0.307 0 CA-C-O 121.615 0.721 . . . . 75.099999999999994 110.85 -179.951 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . 0.9 ' N ' ' HD2' ' A' ' 19' ' ' PRO . 53.9 Cg_endo -69.77 -27.81 25.97 Favored 'Trans proline' 0 C--O 1.232 0.19 0 C-N-CA 122.624 2.216 . . . . 45.0 112.352 179.975 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 19' ' ' PRO . . . . . 0.9 ' HD2' ' N ' ' A' ' 18' ' ' PRO . 53.8 Cg_endo -69.77 -16.49 37.54 Favored 'Trans proline' 0 C--N 1.341 0.166 0 C-N-CA 122.714 2.276 . . . . 72.409999999999997 112.334 179.975 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -81.88 -19.9 39.97 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.203 -0.453 . . . . 70.430000000000007 110.889 -179.987 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -58.67 -34.71 71.54 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.168 -0.469 . . . . 74.049999999999997 110.855 -179.875 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.302 0 C-N-CA 120.696 -0.764 . . . . 73.530000000000001 112.485 179.984 . . . . . . . . 0 0 . 1 . 025 nuclear orig full ' A' A ' 1' ' ' TRP . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.231 0.113 0 CA-C-O 120.744 0.307 . . . . 64.150000000000006 110.944 . . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -53.58 160.56 1.9 Allowed Pre-proline 0 C--N 1.328 -0.337 0 CA-C-O 121.612 0.72 . . . . 75.319999999999993 110.877 -179.942 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.74 106.71 1.71 Allowed 'Trans proline' 0 C--N 1.341 0.163 0 C-N-CA 122.676 2.251 . . . . 61.43 112.332 -179.983 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -179.45 -34.76 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.227 -0.442 . . . . 75.25 110.943 -179.884 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -103.56 -33.53 8.98 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.111 -0.495 . . . . 70.420000000000002 110.89 179.958 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -51.83 -43.43 63.16 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.208 -0.451 . . . . 73.140000000000001 110.893 179.941 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 13.5 t -84.51 -27.4 27.43 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.253 -0.43 . . . . 74.530000000000001 111.119 -179.916 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -69.27 -33.89 73.91 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.191 -0.459 . . . . 74.5 110.916 -179.978 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 2.4 t80 -69.56 -35.84 75.78 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.138 -0.483 . . . . 74.129999999999995 110.946 -179.887 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 23.1 m-85 -63.72 -30.71 71.78 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.142 -0.481 . . . . 71.510000000000005 110.899 -179.926 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -67.04 -35.07 79.06 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.097 -0.501 . . . . 64.120000000000005 110.86 179.948 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 36.1 t -85.78 -29.56 6.27 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.2 -0.455 . . . . 72.329999999999998 111.128 179.985 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 10.5 ttp -102.46 33.89 2.98 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.187 -0.461 . . . . 71.239999999999995 110.862 179.916 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 5.6 t -86.68 -3.97 59.11 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.262 -0.426 . . . . 73.340000000000003 111.145 -179.925 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . 0.659 ' C ' ' HG3' ' A' ' 19' ' ' PRO . 25.1 t -93.03 3.47 8.18 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-N 116.221 -0.445 . . . . 75.310000000000002 111.122 179.895 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 2.8 mp -142.36 3.72 0.41 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.184 -0.462 . . . . 72.319999999999993 111.132 179.865 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 17' ' ' SER . . . . . 0.799 ' C ' ' HD2' ' A' ' 19' ' ' PRO . 0.5 OUTLIER -99.93 -68.82 0.04 OUTLIER Pre-proline 0 C--N 1.329 -0.294 0 CA-C-O 121.697 0.761 . . . . 73.450000000000003 110.83 -179.897 . . . . . . . . 3 3 . 1 . 025 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . 0.905 ' N ' ' HD2' ' A' ' 19' ' ' PRO . 54.2 Cg_endo -69.7 -27.94 26.14 Favored 'Trans proline' 0 C--O 1.232 0.181 0 C-N-CA 122.7 2.267 . . . . 73.299999999999997 112.358 179.954 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 19' ' ' PRO . . . . . 0.905 ' HD2' ' N ' ' A' ' 18' ' ' PRO . 53.5 Cg_endo -69.77 -16.43 37.51 Favored 'Trans proline' 0 C--N 1.342 0.213 0 C-N-CA 122.664 2.243 . . . . 73.209999999999994 112.38 179.961 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -81.93 -19.86 39.87 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.171 -0.468 . . . . 74.129999999999995 110.911 179.977 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -58.6 -33.16 69.68 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.131 -0.486 . . . . 74.340000000000003 110.876 -179.92 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.279 0 C-N-CA 120.74 -0.743 . . . . 72.120000000000005 112.46 -179.947 . . . . . . . . 0 0 . 1 . 026 nuclear orig full ' A' A ' 1' ' ' TRP . . . . . . . . . . . . . 37.9 m0 . . . . . 0 C--O 1.231 0.131 0 CA-C-O 120.712 0.292 . . . . 72.120000000000005 110.931 . . . . . . . . . 0 0 . 1 . 026 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 1.2 mmt-85 52.71 70.04 2.06 Favored Pre-proline 0 C--N 1.328 -0.334 0 CA-C-O 121.615 0.721 . . . . 75.049999999999997 110.858 -179.977 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_endo -69.82 89.25 0.53 Allowed 'Trans proline' 0 C--O 1.232 0.189 0 C-N-CA 122.656 2.237 . . . . 74.549999999999997 112.32 -179.935 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 84.5 m-85 -151.8 119.78 6.23 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.236 -0.438 . . . . 75.340000000000003 110.916 -179.911 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -151.24 -40.83 0.12 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.118 -0.492 . . . . 73.209999999999994 110.882 179.926 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 33.0 tp60 -49.53 -43.9 46.06 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.234 -0.439 . . . . 74.409999999999997 110.925 179.949 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 9.9 t -90.56 -31.02 16.88 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.167 -0.469 . . . . 71.310000000000002 111.104 -179.905 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -68.03 -19.65 64.92 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.264 -0.425 . . . . 75.200000000000003 110.896 179.998 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 1.7 t80 -85.43 -38.22 18.91 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.149 -0.478 . . . . 74.129999999999995 110.911 -179.821 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 20.8 m-85 -56.49 -31.47 64.09 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.167 -0.47 . . . . 74.519999999999996 110.878 -179.935 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -56.61 -31.69 64.55 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.114 -0.494 . . . . 72.019999999999996 110.899 179.976 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 61.5 t -90.88 -28.54 4.85 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.158 -0.474 . . . . 73.400000000000006 111.115 -179.985 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 10.6 ttp -102.06 33.4 3.07 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.152 -0.476 . . . . 73.120000000000005 110.862 179.932 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 5.6 t -86.17 -3.99 59.08 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.23 -0.441 . . . . 71.420000000000002 111.148 -179.937 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . 0.637 ' C ' ' HG3' ' A' ' 19' ' ' PRO . 25.3 t -92.89 4.12 7.68 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-N 116.221 -0.445 . . . . 72.319999999999993 111.158 179.853 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 9.6 mt -143.29 3.34 0.35 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.206 -0.452 . . . . 74.109999999999999 111.153 179.898 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 17' ' ' SER . . . . . 0.791 ' C ' ' HD2' ' A' ' 19' ' ' PRO . 0.5 OUTLIER -99.82 -68.77 0.04 OUTLIER Pre-proline 0 C--N 1.33 -0.277 0 CA-C-O 121.694 0.759 . . . . 72.299999999999997 110.849 -179.929 . . . . . . . . 3 3 . 1 . 026 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . 0.89 ' N ' ' HD2' ' A' ' 19' ' ' PRO . 53.7 Cg_endo -69.77 -27.93 25.82 Favored 'Trans proline' 0 C--N 1.342 0.185 0 C-N-CA 122.66 2.24 . . . . 65.439999999999998 112.337 -179.992 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 19' ' ' PRO . . . . . 0.89 ' HD2' ' N ' ' A' ' 18' ' ' PRO . 54.1 Cg_endo -69.75 -16.8 37.77 Favored 'Trans proline' 0 C--N 1.341 0.184 0 C-N-CA 122.643 2.229 . . . . 74.519999999999996 112.354 179.937 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 21.3 tt0 -82.5 -21.29 35.53 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.222 -0.445 . . . . 74.299999999999997 110.903 179.981 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -58.27 -33.21 69.17 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.201 -0.454 . . . . 74.549999999999997 110.854 -179.913 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.317 0 C-N-CA 120.693 -0.765 . . . . 72.219999999999999 112.527 -179.953 . . . . . . . . 0 0 . 1 . 027 nuclear orig full ' A' A ' 1' ' ' TRP . . . . . . . . . . . . . 45.8 m0 . . . . . 0 C--O 1.231 0.09 0 CA-C-O 120.742 0.306 . . . . 74.109999999999999 110.915 . . . . . . . . . 0 0 . 1 . 027 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 3.0 mmt85 -119.13 73.35 13.25 Favored Pre-proline 0 C--N 1.329 -0.321 0 CA-C-O 121.583 0.706 . . . . 75.319999999999993 110.909 -179.955 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.75 114.27 3.65 Favored 'Trans proline' 0 C--N 1.342 0.216 0 C-N-CA 122.665 2.244 . . . . 54.32 112.346 -179.97 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 38.2 m-85 -135.92 -70.37 0.48 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.218 -0.446 . . . . 74.25 110.862 -179.881 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -77.2 -16.65 58.99 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.129 -0.487 . . . . 72.019999999999996 110.898 -179.977 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 3.0 pp0? -56.17 -48.8 75.61 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.188 -0.46 . . . . 75.120000000000005 110.917 179.924 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 3.5 t -65.31 -31.22 72.25 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.244 -0.435 . . . . 74.319999999999993 111.131 -179.923 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 2.0 tt0 -52.94 -41.26 64.32 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.216 -0.447 . . . . 65.439999999999998 110.854 -179.962 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -69.37 -42.13 75.61 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.181 -0.463 . . . . 75.140000000000001 110.891 -179.814 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 15.4 m-85 -68.56 -25.27 64.82 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.181 -0.463 . . . . 75.230000000000004 110.88 -179.878 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -60.64 -32.2 71.37 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.126 -0.488 . . . . 71.209999999999994 110.875 179.895 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 58.8 t -90.28 -27.65 5.07 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.19 -0.459 . . . . 75.319999999999993 111.139 -179.984 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 9.4 ttp -102.26 32.83 3.34 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.162 -0.472 . . . . 64.430000000000007 110.851 179.927 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 5.9 t -86.82 -3.74 59.1 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.212 -0.449 . . . . 64.329999999999998 111.149 -179.974 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . 0.659 ' C ' ' HG3' ' A' ' 19' ' ' PRO . 23.0 t -94.26 4.65 8.09 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.228 -0.442 . . . . 73.540000000000006 111.12 179.867 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 2.8 mp -142.54 3.36 0.4 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.326 0 CA-C-N 116.173 -0.467 . . . . 74.239999999999995 111.122 179.894 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 17' ' ' SER . . . . . 0.793 ' C ' ' HD2' ' A' ' 19' ' ' PRO . 0.5 OUTLIER -100.32 -68.38 0.04 OUTLIER Pre-proline 0 C--N 1.329 -0.323 0 CA-C-O 121.739 0.78 . . . . 73.219999999999999 110.836 -179.911 . . . . . . . . 3 3 . 1 . 027 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . 0.9 ' N ' ' HD2' ' A' ' 19' ' ' PRO . 54.2 Cg_endo -69.69 -27.87 26.29 Favored 'Trans proline' 0 C--N 1.342 0.214 0 C-N-CA 122.686 2.258 . . . . 64.25 112.349 179.989 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 19' ' ' PRO . . . . . 0.9 ' HD2' ' N ' ' A' ' 18' ' ' PRO . 53.7 Cg_endo -69.79 -16.47 37.46 Favored 'Trans proline' 0 C--N 1.342 0.192 0 C-N-CA 122.637 2.225 . . . . 73.200000000000003 112.341 179.989 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -81.87 -19.88 40.01 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.22 -0.446 . . . . 75.540000000000006 110.903 -179.994 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -58.66 -34.05 70.79 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.185 -0.461 . . . . 74.519999999999996 110.868 -179.947 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.303 0 C-N-CA 120.724 -0.751 . . . . 74.230000000000004 112.503 -179.977 . . . . . . . . 0 0 . 1 . 028 nuclear orig full ' A' A ' 1' ' ' TRP . . . . . . . . . . . . . 52.5 m0 . . . . . 0 C--O 1.232 0.132 0 CA-C-O 120.777 0.322 . . . . 74.519999999999996 110.908 . . . . . . . . . 0 0 . 1 . 028 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -119.86 70.52 14.21 Favored Pre-proline 0 C--N 1.329 -0.29 0 CA-C-O 121.628 0.728 . . . . 74.450000000000003 110.862 -179.944 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.76 -48.46 0.71 Allowed 'Trans proline' 0 C--N 1.342 0.186 0 C-N-CA 122.688 2.259 . . . . 75.200000000000003 112.331 -179.995 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 34.3 m-85 -154.76 121.76 5.54 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.203 -0.453 . . . . 72.120000000000005 110.954 -179.913 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -148.81 -40.94 0.15 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.143 -0.48 . . . . 75.310000000000002 110.947 179.987 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 37.7 tt0 -49.76 -43.54 48.09 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.153 -0.476 . . . . 75.099999999999994 110.913 179.93 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 10.2 t -90.88 -30.97 16.62 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.185 -0.461 . . . . 74.150000000000006 111.102 -179.899 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 3.2 mt-10 -68.05 -20.35 64.96 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.24 -0.436 . . . . 72.400000000000006 110.906 -179.991 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 1.6 t80 -84.42 -38.47 20.17 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.119 -0.491 . . . . 75.239999999999995 110.87 -179.831 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 20.6 m-85 -56.24 -38.63 71.36 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.141 -0.481 . . . . 72.030000000000001 110.954 -179.9 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 71.9 m-20 -56.52 -35.76 68.44 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.113 -0.494 . . . . 70.319999999999993 110.869 179.916 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 23.7 t -89.15 -27.49 5.3 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.169 -0.469 . . . . 70.040000000000006 111.16 179.949 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 10.6 ttp -101.86 33.4 3.03 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.154 -0.475 . . . . 62.25 110.851 179.968 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 5.5 t -86.18 -4.0 59.08 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.217 -0.447 . . . . 72.209999999999994 111.106 -179.923 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . 0.644 ' C ' ' HG3' ' A' ' 19' ' ' PRO . 25.3 t -92.93 4.15 7.68 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.24 -0.436 . . . . 73.219999999999999 111.132 179.911 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 9.4 mt -143.32 3.39 0.35 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.215 -0.448 . . . . 75.310000000000002 111.141 179.888 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 17' ' ' SER . . . . . 0.795 ' C ' ' HD2' ' A' ' 19' ' ' PRO . 0.5 OUTLIER -99.86 -68.8 0.04 OUTLIER Pre-proline 0 C--N 1.329 -0.301 0 CA-C-O 121.686 0.755 . . . . 65.219999999999999 110.863 -179.941 . . . . . . . . 3 3 . 1 . 028 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . 0.896 ' N ' ' HD2' ' A' ' 19' ' ' PRO . 54.2 Cg_endo -69.73 -27.89 26.05 Favored 'Trans proline' 0 C--N 1.342 0.203 0 C-N-CA 122.702 2.268 . . . . 74.010000000000005 112.361 179.953 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 19' ' ' PRO . . . . . 0.896 ' HD2' ' N ' ' A' ' 18' ' ' PRO . 53.7 Cg_endo -69.8 -16.75 37.52 Favored 'Trans proline' 0 C--N 1.341 0.171 0 C-N-CA 122.64 2.227 . . . . 75.150000000000006 112.312 179.956 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 15.1 tp10 -82.51 -21.35 35.49 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.264 -0.425 . . . . 74.439999999999998 110.883 -179.986 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -58.14 -34.48 70.31 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.139 -0.482 . . . . 71.219999999999999 110.876 -179.903 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.348 0 C-N-CA 120.722 -0.751 . . . . 73.430000000000007 112.529 -179.932 . . . . . . . . 0 0 . 1 . 029 nuclear orig full ' A' A ' 1' ' ' TRP . . . . . . . . . . . . . 48.8 m0 . . . . . 0 C--O 1.23 0.059 0 CA-C-O 120.774 0.321 . . . . 75.310000000000002 110.914 . . . . . . . . . 0 0 . 1 . 029 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER 55.47 70.51 1.54 Allowed Pre-proline 0 C--N 1.33 -0.275 0 CA-C-O 121.61 0.719 . . . . 74.25 110.897 -179.951 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_endo -69.83 106.97 1.77 Allowed 'Trans proline' 0 C--N 1.341 0.176 0 C-N-CA 122.63 2.22 . . . . 74.049999999999997 112.35 -179.96 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -92.39 -32.42 14.95 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.207 -0.451 . . . . 74.349999999999994 110.892 -179.886 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -105.09 -32.6 8.62 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.173 -0.467 . . . . 74.340000000000003 110.94 179.98 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -51.87 -43.18 63.16 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.16 -0.473 . . . . 72.310000000000002 110.934 179.915 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 12.3 t -85.42 -27.86 25.48 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.211 -0.45 . . . . 71.319999999999993 111.122 -179.922 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 2.5 mt-10 -68.83 -32.52 72.28 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.197 -0.456 . . . . 72.030000000000001 110.885 -179.979 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 2.5 t80 -71.05 -36.11 72.19 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.165 -0.47 . . . . 75.400000000000006 110.948 -179.861 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 23.4 m-85 -63.15 -28.34 70.0 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.124 -0.489 . . . . 75.230000000000004 110.884 -179.939 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -56.78 -44.1 81.5 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.136 -0.484 . . . . 71.299999999999997 110.87 179.934 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 21.8 t -82.78 -29.08 8.41 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.203 -0.453 . . . . 75.299999999999997 111.131 179.997 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 10.4 ttp -101.29 33.82 2.77 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.141 -0.481 . . . . 71.239999999999995 110.907 179.927 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 5.6 t -86.67 -3.91 59.1 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.21 -0.45 . . . . 74.549999999999997 111.167 -179.897 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . 0.66 ' C ' ' HG3' ' A' ' 19' ' ' PRO . 25.0 t -93.07 3.49 8.19 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-N 116.149 -0.478 . . . . 70.319999999999993 111.114 179.932 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 2.8 mp -142.34 3.63 0.41 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.212 -0.449 . . . . 71.230000000000004 111.155 179.924 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 17' ' ' SER . . . . . 0.784 ' C ' ' HD2' ' A' ' 19' ' ' PRO . 0.5 OUTLIER -99.89 -68.77 0.04 OUTLIER Pre-proline 0 C--N 1.329 -0.319 0 CA-C-O 121.674 0.75 . . . . 74.239999999999995 110.844 -179.879 . . . . . . . . 3 3 . 1 . 029 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . 0.89 ' N ' ' HD2' ' A' ' 19' ' ' PRO . 53.5 Cg_endo -69.83 -27.9 25.58 Favored 'Trans proline' 0 C--N 1.342 0.191 0 C-N-CA 122.645 2.23 . . . . 71.140000000000001 112.325 -179.982 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 19' ' ' PRO . . . . . 0.89 ' HD2' ' N ' ' A' ' 18' ' ' PRO . 54.2 Cg_endo -69.74 -16.81 37.81 Favored 'Trans proline' 0 C--N 1.342 0.195 0 C-N-CA 122.72 2.28 . . . . 72.430000000000007 112.346 179.903 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 25.6 tt0 -82.59 -21.24 35.28 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.205 -0.452 . . . . 74.129999999999995 110.867 -179.94 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -58.1 -32.86 68.49 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.154 -0.476 . . . . 74.120000000000005 110.872 -179.913 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.303 0 C-N-CA 120.72 -0.752 . . . . 73.349999999999994 112.462 179.978 . . . . . . . . 0 0 . 1 . 030 nuclear orig full ' A' A ' 1' ' ' TRP . . . . . . . . . . . . . 36.2 m0 . . . . . 0 C--O 1.231 0.114 0 CA-C-O 120.777 0.322 . . . . 74.409999999999997 110.911 . . . . . . . . . 0 0 . 1 . 030 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 25.5 mmt180 56.2 73.66 0.8 Allowed Pre-proline 0 C--N 1.329 -0.29 0 CA-C-O 121.624 0.726 . . . . 75.409999999999997 110.891 -179.952 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.77 -8.37 23.43 Favored 'Trans proline' 0 C--N 1.341 0.175 0 C-N-CA 122.663 2.242 . . . . 70.319999999999993 112.32 -179.962 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 12.7 m-85 -158.27 125.29 4.93 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.21 -0.45 . . . . 71.530000000000001 110.925 -179.884 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -143.8 -41.08 0.28 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.095 -0.502 . . . . 75.299999999999997 110.929 179.953 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -50.31 -42.53 52.76 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.203 -0.453 . . . . 74.530000000000001 110.943 179.884 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 8.9 t -91.97 -30.6 16.0 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.188 -0.46 . . . . 72.219999999999999 111.1 -179.92 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -68.46 -21.94 64.6 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.239 -0.437 . . . . 74.299999999999997 110.92 -179.995 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 1.6 t80 -82.11 -39.21 23.67 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.106 -0.497 . . . . 74.400000000000006 110.939 -179.858 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 20.0 m-85 -55.17 -32.55 62.24 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.082 -0.508 . . . . 64.310000000000002 110.926 -179.959 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -53.13 -36.6 60.97 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.145 -0.48 . . . . 72.040000000000006 110.892 179.91 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 57.7 t -82.4 -30.84 9.54 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.18 -0.464 . . . . 71.200000000000003 111.115 179.971 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 10.6 ttp -101.97 33.38 3.06 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.182 -0.463 . . . . 72.319999999999993 110.83 179.962 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 5.5 t -86.18 -4.0 59.08 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.261 -0.427 . . . . 72.219999999999999 111.139 -179.941 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . 0.652 ' C ' ' HG3' ' A' ' 19' ' ' PRO . 25.4 t -92.95 4.18 7.67 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.22 -0.446 . . . . 75.329999999999998 111.134 179.904 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 9.5 mt -143.3 3.31 0.35 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.186 -0.461 . . . . 74.519999999999996 111.164 179.926 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 17' ' ' SER . . . . . 0.803 ' C ' ' HD2' ' A' ' 19' ' ' PRO . 0.5 OUTLIER -99.9 -68.73 0.04 OUTLIER Pre-proline 0 C--N 1.33 -0.278 0 CA-C-O 121.612 0.72 . . . . 64.420000000000002 110.866 -179.919 . . . . . . . . 3 3 . 1 . 030 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . 0.898 ' N ' ' HD2' ' A' ' 19' ' ' PRO . 53.5 Cg_endo -69.75 -27.97 25.88 Favored 'Trans proline' 0 C--N 1.341 0.157 0 C-N-CA 122.721 2.281 . . . . 71.420000000000002 112.32 179.988 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 19' ' ' PRO . . . . . 0.898 ' HD2' ' N ' ' A' ' 18' ' ' PRO . 53.8 Cg_endo -69.72 -16.75 37.87 Favored 'Trans proline' 0 C--N 1.342 0.201 0 C-N-CA 122.684 2.256 . . . . 74.049999999999997 112.389 179.935 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 57.6 tt0 -82.53 -21.34 35.43 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.197 -0.456 . . . . 74.299999999999997 110.936 179.988 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -58.17 -34.42 70.29 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.103 -0.499 . . . . 73.319999999999993 110.926 -179.934 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.342 0 C-N-CA 120.727 -0.749 . . . . 73.200000000000003 112.478 179.988 . . . . . . . . 0 0 . 1 . 031 nuclear orig full ' A' A ' 1' ' ' TRP . . . . . . . . . . . . . 54.9 m0 . . . . . 0 C--O 1.231 0.113 0 CA-C-O 120.747 0.308 . . . . 71.540000000000006 110.901 . . . . . . . . . 0 0 . 1 . 031 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 6.7 ptt180 -140.15 157.59 68.69 Favored Pre-proline 0 C--N 1.329 -0.299 0 CA-C-O 121.598 0.713 . . . . 72.420000000000002 110.856 -179.977 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.72 -171.82 0.51 Allowed 'Trans proline' 0 C--N 1.341 0.171 0 C-N-CA 122.693 2.262 . . . . 75.340000000000003 112.3 -179.963 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 35.2 m-85 -120.48 8.19 10.72 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.195 -0.457 . . . . 72.540000000000006 110.903 -179.889 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -101.45 -7.88 22.48 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.144 -0.48 . . . . 75.239999999999995 110.929 179.961 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -50.44 -42.4 54.01 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.204 -0.453 . . . . 74.329999999999998 110.88 179.944 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 7.9 t -77.92 -29.4 50.01 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.235 -0.439 . . . . 75.349999999999994 111.143 -179.913 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -61.2 -38.67 87.38 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.223 -0.444 . . . . 75.319999999999993 110.875 -180.0 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 1.1 t80 -66.88 -37.85 85.19 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.179 -0.464 . . . . 72.129999999999995 110.91 -179.87 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 18.1 m-85 -71.13 -28.67 64.46 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.129 -0.487 . . . . 74.150000000000006 110.917 -179.907 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -67.02 -45.55 77.16 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.13 -0.487 . . . . 74.439999999999998 110.844 179.937 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 60.6 t -81.72 -25.7 9.77 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.211 -0.449 . . . . 75.129999999999995 111.118 -179.958 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 10.6 ttp -101.97 33.38 3.06 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.182 -0.463 . . . . 74.409999999999997 110.876 179.929 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 5.5 t -86.11 -4.03 59.08 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.215 -0.448 . . . . 73.420000000000002 111.137 -179.921 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . 0.647 ' C ' ' HG3' ' A' ' 19' ' ' PRO . 25.4 t -92.91 4.14 7.68 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.183 -0.462 . . . . 74.019999999999996 111.122 179.937 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 9.5 mt -143.28 3.34 0.35 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.178 -0.465 . . . . 74.310000000000002 111.169 179.911 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 17' ' ' SER . . . . . 0.788 ' C ' ' HD2' ' A' ' 19' ' ' PRO . 0.5 OUTLIER -99.86 -68.81 0.04 OUTLIER Pre-proline 0 C--N 1.329 -0.297 0 CA-C-O 121.696 0.76 . . . . 70.209999999999994 110.895 -179.92 . . . . . . . . 3 3 . 1 . 031 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . 0.894 ' N ' ' HD2' ' A' ' 19' ' ' PRO . 54.0 Cg_endo -69.75 -27.88 25.99 Favored 'Trans proline' 0 C--N 1.342 0.213 0 C-N-CA 122.684 2.256 . . . . 75.099999999999994 112.329 179.971 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 19' ' ' PRO . . . . . 0.894 ' HD2' ' N ' ' A' ' 18' ' ' PRO . 53.9 Cg_endo -69.72 -16.49 37.73 Favored 'Trans proline' 0 C--N 1.341 0.153 0 C-N-CA 122.69 2.26 . . . . 73.439999999999998 112.315 179.966 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -81.92 -19.44 40.77 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.261 -0.427 . . . . 72.109999999999999 110.909 -179.966 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -59.7 -25.74 65.02 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.13 -0.486 . . . . 74.310000000000002 110.852 -179.902 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.325 0 C-N-CA 120.699 -0.762 . . . . 61.32 112.51 -179.993 . . . . . . . . 0 0 . 1 . 032 nuclear orig full ' A' A ' 1' ' ' TRP . . . . . . . . . . . . . 3.6 t90 . . . . . 0 C--O 1.231 0.112 0 CA-C-O 120.741 0.305 . . . . 73.439999999999998 110.947 . . . . . . . . . 0 0 . 1 . 032 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -57.18 160.65 6.24 Favored Pre-proline 0 C--N 1.329 -0.31 0 CA-C-O 121.571 0.7 . . . . 74.010000000000005 110.898 -179.975 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.74 -19.44 36.23 Favored 'Trans proline' 0 C--O 1.231 0.164 0 C-N-CA 122.704 2.269 . . . . 75.510000000000005 112.346 179.977 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 17.0 m-85 -159.54 125.24 4.24 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.18 -0.464 . . . . 75.239999999999995 110.892 -179.885 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -146.55 -41.28 0.2 Allowed 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.112 -0.495 . . . . 74.150000000000006 110.927 179.937 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 6.3 tt0 -50.25 -42.76 52.55 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.226 -0.443 . . . . 53.399999999999999 110.938 179.898 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 8.8 t -91.61 -30.53 16.3 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.17 -0.468 . . . . 70.209999999999994 111.131 -179.941 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 3.8 mt-10 -68.51 -21.6 64.58 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.22 -0.445 . . . . 71.019999999999996 110.918 179.994 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 1.6 t80 -82.56 -38.84 23.14 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.146 -0.479 . . . . 72.310000000000002 110.926 -179.86 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 20.1 m-85 -55.83 -32.09 63.28 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.076 -0.511 . . . . 74.200000000000003 110.922 -179.89 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 14.9 t70 -65.74 -44.93 84.47 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.155 -0.475 . . . . 64.340000000000003 110.906 179.86 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 58.3 t -76.66 -29.34 18.11 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.178 -0.464 . . . . 75.019999999999996 111.109 179.982 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 10.4 ttp -102.49 33.9 2.98 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.181 -0.463 . . . . 73.150000000000006 110.895 179.954 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 5.6 t -86.65 -3.96 59.11 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.199 -0.455 . . . . 73.140000000000001 111.182 -179.973 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . 0.661 ' C ' ' HG3' ' A' ' 19' ' ' PRO . 24.9 t -93.0 3.49 8.15 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.203 -0.453 . . . . 72.299999999999997 111.129 179.879 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 2.8 mp -142.38 3.61 0.41 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.19 -0.459 . . . . 73.450000000000003 111.146 179.918 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 17' ' ' SER . . . . . 0.79 ' C ' ' HD2' ' A' ' 19' ' ' PRO . 0.5 OUTLIER -99.85 -68.79 0.04 OUTLIER Pre-proline 0 C--N 1.329 -0.284 0 CA-C-O 121.674 0.75 . . . . 74.530000000000001 110.868 -179.94 . . . . . . . . 3 3 . 1 . 032 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . 0.903 ' N ' ' HD2' ' A' ' 19' ' ' PRO . 53.7 Cg_endo -69.73 -27.99 25.94 Favored 'Trans proline' 0 C--O 1.231 0.171 0 C-N-CA 122.718 2.278 . . . . 74.340000000000003 112.313 179.994 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 19' ' ' PRO . . . . . 0.903 ' HD2' ' N ' ' A' ' 18' ' ' PRO . 53.9 Cg_endo -69.74 -16.71 37.77 Favored 'Trans proline' 0 C--N 1.341 0.179 0 C-N-CA 122.669 2.246 . . . . 75.420000000000002 112.359 179.939 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 17.6 tp10 -82.61 -21.36 35.16 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.252 -0.431 . . . . 75.409999999999997 110.875 -179.978 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -58.14 -34.11 69.91 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.167 -0.469 . . . . 75.120000000000005 110.864 -179.894 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.291 0 C-N-CA 120.719 -0.753 . . . . 63.409999999999997 112.485 -179.993 . . . . . . . . 0 0 . 1 . 033 nuclear orig full ' A' A ' 1' ' ' TRP . . . . . . . . . . . . . 4.1 t90 . . . . . 0 C--O 1.231 0.101 0 CA-C-O 120.765 0.316 . . . . 75.409999999999997 110.915 . . . . . . . . . 0 0 . 1 . 033 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 5.4 mpt_? -84.97 160.67 54.83 Favored Pre-proline 0 C--N 1.329 -0.316 0 CA-C-O 121.635 0.731 . . . . 75.0 110.871 -179.948 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.71 156.3 63.85 Favored 'Trans proline' 0 C--O 1.231 0.165 0 C-N-CA 122.702 2.268 . . . . 73.540000000000006 112.358 -179.982 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 42.2 m-85 -132.25 -65.83 0.72 Allowed 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.246 -0.434 . . . . 75.140000000000001 110.963 -179.939 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -79.27 -24.29 43.06 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.118 -0.492 . . . . 71.409999999999997 110.91 179.934 . . . . . . . . 2 2 . 1 . 033 nuclear orig full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 12.7 mt-30 -53.7 -54.45 37.83 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.209 -0.451 . . . . 74.409999999999997 110.917 179.942 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 9.8 t -60.94 -31.67 71.21 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.171 -0.468 . . . . 75.209999999999994 111.155 -179.927 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 1.1 mt-10 -59.18 -24.48 63.11 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.213 -0.449 . . . . 71.310000000000002 110.921 179.98 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 1.2 m-85 -94.93 -39.7 10.07 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.125 -0.489 . . . . 73.430000000000007 110.939 -179.86 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 23.3 m-85 -61.76 -49.34 76.77 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.103 -0.499 . . . . 65.530000000000001 110.894 -179.905 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 22.4 t0 -54.55 -32.49 58.44 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.19 -0.459 . . . . 71.099999999999994 110.85 179.93 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 93.6 t -64.77 -22.75 31.97 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.231 -0.441 . . . . 63.210000000000001 111.146 179.981 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 2.8 ttp -113.61 -2.45 13.8 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.159 -0.473 . . . . 53.409999999999997 110.886 179.922 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 25.7 m -76.55 -4.92 45.32 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.211 -0.449 . . . . 74.129999999999995 111.135 -179.967 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . 0.663 ' C ' ' HG3' ' A' ' 19' ' ' PRO . 23.5 t -97.88 10.97 5.93 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.269 -0.423 . . . . 74.299999999999997 111.176 179.861 . . . . . . . . 2 2 . 1 . 033 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 3.0 mp -142.37 2.56 0.41 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.189 -0.46 . . . . 70.409999999999997 111.14 179.924 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 17' ' ' SER . . . . . 0.798 ' C ' ' HD2' ' A' ' 19' ' ' PRO . 0.6 OUTLIER -101.74 -66.2 0.05 OUTLIER Pre-proline 0 C--N 1.33 -0.273 0 CA-C-O 121.622 0.725 . . . . 72.219999999999999 110.88 -179.935 . . . . . . . . 3 3 . 1 . 033 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . 0.901 ' N ' ' HD2' ' A' ' 19' ' ' PRO . 53.7 Cg_endo -69.8 -27.66 26.02 Favored 'Trans proline' 0 C--N 1.342 0.189 0 C-N-CA 122.664 2.243 . . . . 75.109999999999999 112.374 179.953 . . . . . . . . 2 2 . 1 . 033 nuclear orig full ' A' A ' 19' ' ' PRO . . . . . 0.901 ' HD2' ' N ' ' A' ' 18' ' ' PRO . 53.2 Cg_endo -69.81 -16.2 37.25 Favored 'Trans proline' 0 C--N 1.341 0.145 0 C-N-CA 122.664 2.243 . . . . 74.109999999999999 112.329 179.946 . . . . . . . . 2 2 . 1 . 033 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 5.8 tm-20 -83.02 -21.25 33.9 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.2 -0.455 . . . . 74.510000000000005 110.855 -179.968 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -57.55 -32.78 67.44 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.166 -0.47 . . . . 75.019999999999996 110.896 -179.932 . . . . . . . . 2 2 . 1 . 033 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.366 0 C-N-CA 120.754 -0.736 . . . . 42.149999999999999 112.508 -179.95 . . . . . . . . 0 0 . 1 . 034 nuclear orig full ' A' A ' 1' ' ' TRP . . . . . . . . . . . . . 53.9 m0 . . . . . 0 C--O 1.231 0.117 0 CA-C-O 120.711 0.291 . . . . 74.510000000000005 110.938 . . . . . . . . . 0 0 . 1 . 034 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 2.1 mtt-85 57.81 73.33 0.77 Allowed Pre-proline 0 C--N 1.329 -0.297 0 CA-C-O 121.628 0.728 . . . . 74.219999999999999 110.881 -179.955 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.78 78.77 0.99 Allowed 'Trans proline' 0 C--O 1.232 0.194 0 C-N-CA 122.664 2.242 . . . . 74.400000000000006 112.327 -179.981 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -134.67 -65.24 0.64 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.217 -0.447 . . . . 72.420000000000002 110.917 -179.908 . . . . . . . . 2 2 . 1 . 034 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -80.36 -24.58 39.72 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.131 -0.486 . . . . 75.120000000000005 110.926 179.936 . . . . . . . . 2 2 . 1 . 034 nuclear orig full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 87.7 mm-40 -51.85 -49.89 61.99 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.189 -0.46 . . . . 65.219999999999999 110.905 179.918 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 11.2 t -68.0 -31.63 71.46 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.236 -0.438 . . . . 75.439999999999998 111.198 -179.945 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 1.2 mt-10 -55.77 -31.7 62.83 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.18 -0.464 . . . . 74.439999999999998 110.856 179.992 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -76.77 -44.58 32.37 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.201 -0.454 . . . . 75.150000000000006 110.883 -179.814 . . . . . . . . 2 2 . 1 . 034 nuclear orig full ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 14.4 m-85 -64.66 -26.72 68.5 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.122 -0.49 . . . . 74.239999999999995 110.908 -179.917 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 11.7 t70 -67.98 -27.85 66.93 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.121 -0.49 . . . . 73.129999999999995 110.862 179.958 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 55.7 t -83.2 -24.2 8.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.204 -0.453 . . . . 73.430000000000007 111.091 -179.962 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 10.1 ttp -105.76 6.26 31.63 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.144 -0.48 . . . . 72.349999999999994 110.913 179.92 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 6.0 t -70.18 -6.34 33.68 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.221 -0.445 . . . . 73.430000000000007 111.104 -179.922 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . 0.604 ' C ' ' HG3' ' A' ' 19' ' ' PRO . 40.3 t -96.27 9.83 5.85 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.242 -0.436 . . . . 64.519999999999996 111.177 179.922 . . . . . . . . 2 2 . 1 . 034 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 10.6 mt -143.96 2.11 0.3 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.092 -0.504 . . . . 74.540000000000006 111.102 179.963 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 17' ' ' SER . . . . . 0.804 ' C ' ' HD2' ' A' ' 19' ' ' PRO . 0.0 OUTLIER -99.74 -65.89 0.06 OUTLIER Pre-proline 0 C--N 1.329 -0.288 0 CA-C-O 121.65 0.738 . . . . 74.099999999999994 110.818 -179.898 . . . . . . . . 3 3 . 1 . 034 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . 0.898 ' N ' ' HD2' ' A' ' 19' ' ' PRO . 53.7 Cg_endo -69.77 -27.38 26.5 Favored 'Trans proline' 0 C--O 1.231 0.156 0 C-N-CA 122.649 2.232 . . . . 74.209999999999994 112.331 -179.976 . . . . . . . . 2 2 . 1 . 034 nuclear orig full ' A' A ' 19' ' ' PRO . . . . . 0.898 ' HD2' ' N ' ' A' ' 18' ' ' PRO . 53.6 Cg_endo -69.74 -16.98 37.91 Favored 'Trans proline' 0 C--N 1.341 0.177 0 C-N-CA 122.651 2.234 . . . . 74.230000000000004 112.336 179.952 . . . . . . . . 2 2 . 1 . 034 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 1.9 mt-10 -82.79 -19.99 36.66 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.228 -0.442 . . . . 73.299999999999997 110.879 -179.967 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -58.59 -33.35 69.88 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.21 -0.45 . . . . 73.510000000000005 110.894 -179.945 . . . . . . . . 2 2 . 1 . 034 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.302 0 C-N-CA 120.7 -0.762 . . . . 73.430000000000007 112.461 179.998 . . . . . . . . 0 0 . 1 . 035 nuclear orig full ' A' A ' 1' ' ' TRP . . . . . . . . . . . . . 3.1 t90 . . . . . 0 C--O 1.231 0.11 0 CA-C-O 120.775 0.321 . . . . 73.109999999999999 110.927 . . . . . . . . . 0 0 . 1 . 035 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 2.3 mtm180 -59.7 160.64 13.81 Favored Pre-proline 0 C--N 1.329 -0.287 0 CA-C-O 121.614 0.721 . . . . 74.409999999999997 110.866 -179.936 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.8 -48.93 0.61 Allowed 'Trans proline' 0 C--O 1.231 0.159 0 C-N-CA 122.677 2.251 . . . . 74.349999999999994 112.35 -179.991 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 6.5 p90 179.49 133.3 0.09 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.253 -0.43 . . . . 75.129999999999995 110.917 -179.941 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -142.49 -41.26 0.33 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.095 -0.502 . . . . 74.150000000000006 110.913 179.986 . . . . . . . . 2 2 . 1 . 035 nuclear orig full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 6.4 mm-40 -54.73 -46.97 74.32 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.179 -0.464 . . . . 74.409999999999997 110.914 179.912 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 13.5 t -81.25 -25.24 36.77 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.207 -0.451 . . . . 70.340000000000003 111.161 -179.942 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 33.0 tp10 -77.72 -19.75 54.69 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.218 -0.446 . . . . 75.239999999999995 110.926 179.948 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 1.4 t80 -86.21 -34.07 20.58 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.151 -0.477 . . . . 62.109999999999999 110.925 -179.844 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 22.1 m-85 -59.71 -26.66 65.79 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.109 -0.496 . . . . 74.230000000000004 110.927 -179.93 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -64.32 -44.66 90.88 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.139 -0.482 . . . . 64.219999999999999 110.891 179.9 . . . . . . . . 2 2 . 1 . 035 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 50.8 t -75.3 -30.01 22.14 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.219 -0.446 . . . . 73.040000000000006 111.159 179.96 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 10.4 ttp -102.3 33.93 2.93 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.191 -0.459 . . . . 73.140000000000001 110.884 179.884 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 5.6 t -86.74 -3.92 59.11 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.212 -0.449 . . . . 71.230000000000004 111.138 -179.92 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . 0.66 ' C ' ' HG3' ' A' ' 19' ' ' PRO . 25.1 t -93.04 3.45 8.2 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.222 -0.445 . . . . 71.319999999999993 111.125 179.895 . . . . . . . . 2 2 . 1 . 035 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 2.8 mp -142.33 3.6 0.41 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.144 -0.48 . . . . 75.439999999999998 111.156 179.949 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 17' ' ' SER . . . . . 0.78 ' C ' ' HD2' ' A' ' 19' ' ' PRO . 0.5 OUTLIER -99.86 -68.78 0.04 OUTLIER Pre-proline 0 C--N 1.33 -0.271 0 CA-C-O 121.671 0.748 . . . . 75.040000000000006 110.855 -179.879 . . . . . . . . 3 3 . 1 . 035 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . 0.895 ' N ' ' HD2' ' A' ' 19' ' ' PRO . 53.6 Cg_endo -69.77 -27.99 25.74 Favored 'Trans proline' 0 C--N 1.341 0.172 0 C-N-CA 122.651 2.234 . . . . 55.520000000000003 112.323 179.981 . . . . . . . . 2 2 . 1 . 035 nuclear orig full ' A' A ' 19' ' ' PRO . . . . . 0.895 ' HD2' ' N ' ' A' ' 18' ' ' PRO . 54.1 Cg_endo -69.7 -16.76 37.97 Favored 'Trans proline' 0 C--N 1.341 0.149 0 C-N-CA 122.702 2.268 . . . . 72.340000000000003 112.366 179.942 . . . . . . . . 2 2 . 1 . 035 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 28.4 tt0 -82.64 -21.24 35.13 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.191 -0.459 . . . . 74.420000000000002 110.888 -179.975 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -59.13 -25.39 63.82 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.113 -0.494 . . . . 71.219999999999999 110.875 -179.878 . . . . . . . . 2 2 . 1 . 035 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.339 0 C-N-CA 120.746 -0.74 . . . . 75.230000000000004 112.516 -179.987 . . . . . . . . 0 0 . 1 . 036 nuclear orig full ' A' A ' 1' ' ' TRP . . . . . . . . . . . . . 37.0 m0 . . . . . 0 C--O 1.231 0.124 0 CA-C-O 120.769 0.319 . . . . 72.209999999999994 110.945 . . . . . . . . . 0 0 . 1 . 036 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 3.1 mpp_? -128.39 73.29 80.27 Favored Pre-proline 0 C--N 1.329 -0.319 0 CA-C-O 121.6 0.714 . . . . 74.510000000000005 110.866 -179.93 . . . . . . . . 1 1 . 1 . 036 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.75 133.14 24.87 Favored 'Trans proline' 0 C--O 1.232 0.193 0 C-N-CA 122.688 2.259 . . . . 72.540000000000006 112.359 -179.997 . . . . . . . . 1 1 . 1 . 036 nuclear orig full ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 6.1 t80 -134.66 -65.98 0.61 Allowed 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.272 -0.422 . . . . 75.340000000000003 110.959 -179.943 . . . . . . . . 1 1 . 1 . 036 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -78.98 -22.63 45.32 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.127 -0.488 . . . . 74.239999999999995 110.932 179.936 . . . . . . . . 2 2 . 1 . 036 nuclear orig full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 22.0 mt-30 -51.58 -51.0 59.05 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.194 -0.457 . . . . 74.510000000000005 110.892 179.954 . . . . . . . . 1 1 . 1 . 036 nuclear orig full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 8.9 t -71.12 -33.36 70.04 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.226 -0.443 . . . . 72.319999999999993 111.191 -179.96 . . . . . . . . 1 1 . 1 . 036 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 2.4 tt0 -56.07 -26.38 49.21 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.2 -0.455 . . . . 72.120000000000005 110.888 179.949 . . . . . . . . 1 1 . 1 . 036 nuclear orig full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 20.9 t80 -82.78 -43.6 16.54 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.162 -0.472 . . . . 73.310000000000002 110.877 -179.819 . . . . . . . . 1 1 . 1 . 036 nuclear orig full ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 22.4 m-85 -62.15 -26.78 68.52 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.128 -0.487 . . . . 74.230000000000004 110.909 -179.912 . . . . . . . . 1 1 . 1 . 036 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 3.2 t0 -64.49 -24.83 67.75 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.119 -0.491 . . . . 72.349999999999994 110.848 179.93 . . . . . . . . 1 1 . 1 . 036 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 47.8 t -82.95 -24.05 8.4 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.232 -0.44 . . . . 74.439999999999998 111.147 -179.976 . . . . . . . . 1 1 . 1 . 036 nuclear orig full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 9.0 ttp -105.58 2.98 28.77 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.134 -0.485 . . . . 74.129999999999995 110.852 179.918 . . . . . . . . 1 1 . 1 . 036 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 5.6 t -70.28 -5.93 31.3 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.272 -0.422 . . . . 75.340000000000003 111.162 -179.98 . . . . . . . . 1 1 . 1 . 036 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . 0.613 ' C ' ' HG3' ' A' ' 19' ' ' PRO . 40.0 t -96.18 9.84 5.79 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.229 -0.442 . . . . 75.239999999999995 111.171 179.872 . . . . . . . . 2 2 . 1 . 036 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 10.4 mt -143.86 2.05 0.31 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.176 -0.466 . . . . 75.530000000000001 111.16 179.945 . . . . . . . . 1 1 . 1 . 036 nuclear orig full ' A' A ' 17' ' ' SER . . . . . 0.812 ' C ' ' HD2' ' A' ' 19' ' ' PRO . 0.0 OUTLIER -99.73 -65.79 0.06 OUTLIER Pre-proline 0 C--N 1.33 -0.252 0 CA-C-O 121.673 0.749 . . . . 72.219999999999999 110.864 -179.922 . . . . . . . . 3 3 . 1 . 036 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . 0.894 ' N ' ' HD2' ' A' ' 19' ' ' PRO . 53.6 Cg_endo -69.74 -27.4 26.61 Favored 'Trans proline' 0 C--N 1.341 0.175 0 C-N-CA 122.713 2.276 . . . . 65.209999999999994 112.36 179.978 . . . . . . . . 2 2 . 1 . 036 nuclear orig full ' A' A ' 19' ' ' PRO . . . . . 0.894 ' HD2' ' N ' ' A' ' 18' ' ' PRO . 53.5 Cg_endo -69.82 -16.95 37.55 Favored 'Trans proline' 0 C--N 1.342 0.217 0 C-N-CA 122.673 2.249 . . . . 71.340000000000003 112.318 179.981 . . . . . . . . 2 2 . 1 . 036 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 1.2 mt-10 -82.81 -20.23 36.15 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.232 -0.44 . . . . 74.319999999999993 110.836 -179.969 . . . . . . . . 1 1 . 1 . 036 nuclear orig full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -58.41 -32.8 68.98 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.188 -0.46 . . . . 75.420000000000002 110.903 -179.91 . . . . . . . . 2 2 . 1 . 036 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.288 0 C-N-CA 120.735 -0.745 . . . . 63.229999999999997 112.475 -179.999 . . . . . . . . 0 0 . 1 . 037 nuclear orig full ' A' A ' 1' ' ' TRP . . . . . . . . . . . . . 2.5 t90 . . . . . 0 C--O 1.231 0.082 0 CA-C-O 120.771 0.32 . . . . 71.25 110.904 . . . . . . . . . 0 0 . 1 . 037 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 8.3 mtt-85 -53.67 160.61 1.94 Allowed Pre-proline 0 C--N 1.329 -0.283 0 CA-C-O 121.592 0.71 . . . . 75.120000000000005 110.85 -179.931 . . . . . . . . 1 1 . 1 . 037 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.79 105.0 1.41 Allowed 'Trans proline' 0 C--N 1.341 0.164 0 C-N-CA 122.665 2.243 . . . . 72.200000000000003 112.36 -179.997 . . . . . . . . 1 1 . 1 . 037 nuclear orig full ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 12.6 t80 -135.84 -68.16 0.51 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.207 -0.451 . . . . 74.329999999999998 110.946 -179.896 . . . . . . . . 1 1 . 1 . 037 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -74.93 -24.73 58.54 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.12 -0.491 . . . . 75.540000000000006 110.867 179.964 . . . . . . . . 2 2 . 1 . 037 nuclear orig full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -51.62 -58.03 7.5 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.201 -0.454 . . . . 73.329999999999998 110.917 179.952 . . . . . . . . 2 2 . 1 . 037 nuclear orig full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 13.4 t -58.87 -28.27 65.97 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.178 -0.465 . . . . 70.230000000000004 111.148 -179.901 . . . . . . . . 1 1 . 1 . 037 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -70.16 -21.83 63.03 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.227 -0.442 . . . . 74.219999999999999 110.908 179.948 . . . . . . . . 2 2 . 1 . 037 nuclear orig full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -82.37 -27.6 32.02 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.189 -0.46 . . . . 75.340000000000003 110.906 -179.876 . . . . . . . . 2 2 . 1 . 037 nuclear orig full ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 15.9 m-85 -52.1 -37.52 54.34 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.122 -0.49 . . . . 75.420000000000002 110.936 -179.932 . . . . . . . . 1 1 . 1 . 037 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 11.1 m-20 -56.86 -31.46 64.82 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.095 -0.502 . . . . 74.420000000000002 110.879 179.911 . . . . . . . . 1 1 . 1 . 037 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 39.7 t -78.21 -23.03 13.53 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-N 116.207 -0.451 . . . . 73.120000000000005 111.159 179.992 . . . . . . . . 1 1 . 1 . 037 nuclear orig full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 9.7 ttp -104.36 6.37 35.11 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.138 -0.483 . . . . 70.310000000000002 110.872 179.9 . . . . . . . . 1 1 . 1 . 037 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 5.8 t -70.04 -6.34 32.92 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.257 -0.429 . . . . 65.310000000000002 111.183 -179.955 . . . . . . . . 1 1 . 1 . 037 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . 0.611 ' C ' ' HG3' ' A' ' 19' ' ' PRO . 40.7 t -96.28 9.87 5.83 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.207 -0.451 . . . . 74.400000000000006 111.137 179.907 . . . . . . . . 2 2 . 1 . 037 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 10.8 mt -143.96 1.98 0.3 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.193 -0.458 . . . . 75.409999999999997 111.132 179.942 . . . . . . . . 1 1 . 1 . 037 nuclear orig full ' A' A ' 17' ' ' SER . . . . . 0.809 ' C ' ' HD2' ' A' ' 19' ' ' PRO . 0.0 OUTLIER -99.66 -65.88 0.06 OUTLIER Pre-proline 0 C--N 1.329 -0.307 0 CA-C-O 121.707 0.765 . . . . 65.109999999999999 110.863 -179.895 . . . . . . . . 3 3 . 1 . 037 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . 0.892 ' N ' ' HD2' ' A' ' 19' ' ' PRO . 53.8 Cg_endo -69.77 -27.42 26.43 Favored 'Trans proline' 0 C--N 1.342 0.205 0 C-N-CA 122.739 2.292 . . . . 75.519999999999996 112.321 179.999 . . . . . . . . 2 2 . 1 . 037 nuclear orig full ' A' A ' 19' ' ' PRO . . . . . 0.892 ' HD2' ' N ' ' A' ' 18' ' ' PRO . 54.1 Cg_endo -69.74 -17.02 37.9 Favored 'Trans proline' 0 C--N 1.341 0.176 0 C-N-CA 122.657 2.238 . . . . 75.340000000000003 112.392 179.922 . . . . . . . . 2 2 . 1 . 037 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 1.3 mt-10 -82.73 -19.88 37.07 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.208 -0.451 . . . . 74.239999999999995 110.92 179.989 . . . . . . . . 1 1 . 1 . 037 nuclear orig full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -58.62 -33.72 70.35 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.111 -0.495 . . . . 74.450000000000003 110.903 -179.943 . . . . . . . . 2 2 . 1 . 037 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.309 0 C-N-CA 120.715 -0.755 . . . . 64.319999999999993 112.469 -179.953 . . . . . . . . 0 0 . 1 . 038 nuclear orig full ' A' A ' 1' ' ' TRP . . . . . . . . . . . . . 46.3 m0 . . . . . 0 C--O 1.231 0.128 0 CA-C-O 120.786 0.327 . . . . 72.530000000000001 110.944 . . . . . . . . . 0 0 . 1 . 038 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER 52.94 72.77 1.07 Allowed Pre-proline 0 C--N 1.329 -0.319 0 CA-C-O 121.631 0.729 . . . . 71.129999999999995 110.868 -179.928 . . . . . . . . 2 2 . 1 . 038 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -69.78 141.18 44.46 Favored 'Trans proline' 0 C--N 1.342 0.205 0 C-N-CA 122.705 2.27 . . . . 74.409999999999997 112.362 179.98 . . . . . . . . 1 1 . 1 . 038 nuclear orig full ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 5.9 t80 -134.43 -65.43 0.64 Allowed 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.197 -0.456 . . . . 71.219999999999999 110.989 -179.917 . . . . . . . . 1 1 . 1 . 038 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -79.88 -24.43 41.2 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.122 -0.49 . . . . 73.430000000000007 110.911 179.926 . . . . . . . . 2 2 . 1 . 038 nuclear orig full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -51.92 -51.18 58.75 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.241 -0.436 . . . . 71.209999999999994 110.942 179.904 . . . . . . . . 2 2 . 1 . 038 nuclear orig full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 10.4 t -66.63 -31.97 72.99 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.178 -0.465 . . . . 70.25 111.143 -179.935 . . . . . . . . 1 1 . 1 . 038 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -56.95 -26.29 59.33 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.191 -0.459 . . . . 75.109999999999999 110.905 -179.983 . . . . . . . . 2 2 . 1 . 038 nuclear orig full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -81.86 -44.56 16.71 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.151 -0.477 . . . . 75.109999999999999 110.934 -179.879 . . . . . . . . 2 2 . 1 . 038 nuclear orig full ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 20.9 m-85 -61.11 -27.88 68.7 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.101 -0.499 . . . . 73.230000000000004 110.926 -179.898 . . . . . . . . 1 1 . 1 . 038 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -68.46 -27.28 66.02 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.131 -0.486 . . . . 53.409999999999997 110.92 179.879 . . . . . . . . 1 1 . 1 . 038 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 46.3 t -84.43 -24.45 7.4 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.125 -0.489 . . . . 75.420000000000002 111.109 179.98 . . . . . . . . 1 1 . 1 . 038 nuclear orig full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 9.7 ttp -105.4 6.37 32.5 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.229 -0.442 . . . . 75.109999999999999 110.876 179.939 . . . . . . . . 1 1 . 1 . 038 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 6.0 t -70.02 -6.32 32.68 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.186 -0.461 . . . . 75.25 111.177 -179.981 . . . . . . . . 1 1 . 1 . 038 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . 0.611 ' C ' ' HG3' ' A' ' 19' ' ' PRO . 40.5 t -96.33 9.94 5.81 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.195 -0.457 . . . . 75.230000000000004 111.127 179.93 . . . . . . . . 2 2 . 1 . 038 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 10.6 mt -143.96 1.96 0.3 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.159 -0.473 . . . . 73.219999999999999 111.117 179.952 . . . . . . . . 1 1 . 1 . 038 nuclear orig full ' A' A ' 17' ' ' SER . . . . . 0.814 ' C ' ' HD2' ' A' ' 19' ' ' PRO . 0.0 OUTLIER -99.64 -65.88 0.06 OUTLIER Pre-proline 0 C--N 1.329 -0.301 0 CA-C-O 121.688 0.756 . . . . 63.420000000000002 110.859 -179.934 . . . . . . . . 3 3 . 1 . 038 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . 0.898 ' N ' ' HD2' ' A' ' 19' ' ' PRO . 53.7 Cg_endo -69.73 -27.41 26.67 Favored 'Trans proline' 0 C--N 1.342 0.199 0 C-N-CA 122.691 2.261 . . . . 75.239999999999995 112.324 -179.999 . . . . . . . . 2 2 . 1 . 038 nuclear orig full ' A' A ' 19' ' ' PRO . . . . . 0.898 ' HD2' ' N ' ' A' ' 18' ' ' PRO . 53.4 Cg_endo -69.82 -17.34 37.36 Favored 'Trans proline' 0 C--N 1.342 0.191 0 C-N-CA 122.691 2.26 . . . . 71.310000000000002 112.348 179.979 . . . . . . . . 2 2 . 1 . 038 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 6.2 tm-20 -83.06 -20.74 34.39 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.204 -0.453 . . . . 72.519999999999996 110.898 179.993 . . . . . . . . 1 1 . 1 . 038 nuclear orig full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -58.64 -32.63 69.23 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.151 -0.477 . . . . 74.120000000000005 110.888 -179.916 . . . . . . . . 2 2 . 1 . 038 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.321 0 C-N-CA 120.761 -0.733 . . . . 73.219999999999999 112.506 -179.99 . . . . . . . . 0 0 . 1 . 039 nuclear orig full ' A' A ' 1' ' ' TRP . . . . . . . . . . . . . 51.3 m0 . . . . . 0 C--O 1.231 0.097 0 CA-C-O 120.811 0.338 . . . . 75.140000000000001 110.89 . . . . . . . . . 0 0 . 1 . 039 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 3.5 ptt180 -51.64 156.86 2.09 Favored Pre-proline 0 C--N 1.329 -0.292 0 CA-C-O 121.604 0.716 . . . . 72.420000000000002 110.849 -179.952 . . . . . . . . 1 1 . 1 . 039 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_endo -69.73 153.57 68.91 Favored 'Trans proline' 0 C--N 1.342 0.204 0 C-N-CA 122.667 2.245 . . . . 72.349999999999994 112.373 179.945 . . . . . . . . 1 1 . 1 . 039 nuclear orig full ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 5.5 t80 -134.57 -65.24 0.65 Allowed 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.24 -0.436 . . . . 73.310000000000002 110.896 -179.91 . . . . . . . . 1 1 . 1 . 039 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -80.46 -24.5 39.48 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.12 -0.491 . . . . 74.519999999999996 110.924 179.961 . . . . . . . . 2 2 . 1 . 039 nuclear orig full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 4.3 mm-40 -51.95 -49.81 62.43 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.179 -0.464 . . . . 72.400000000000006 110.907 179.924 . . . . . . . . 1 1 . 1 . 039 nuclear orig full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 11.0 t -68.13 -31.8 71.64 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.219 -0.446 . . . . 71.239999999999995 111.102 -179.902 . . . . . . . . 1 1 . 1 . 039 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -55.73 -27.74 52.14 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.232 -0.44 . . . . 65.230000000000004 110.9 -179.986 . . . . . . . . 2 2 . 1 . 039 nuclear orig full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -81.76 -44.65 16.72 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.154 -0.476 . . . . 75.299999999999997 110.943 -179.869 . . . . . . . . 2 2 . 1 . 039 nuclear orig full ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 16.7 m-85 -63.13 -27.83 69.65 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.113 -0.494 . . . . 74.519999999999996 110.959 -179.938 . . . . . . . . 1 1 . 1 . 039 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 3.3 t70 -67.98 -28.78 67.74 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.111 -0.495 . . . . 71.120000000000005 110.883 179.897 . . . . . . . . 1 1 . 1 . 039 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 59.0 t -82.55 -24.41 8.81 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.166 -0.47 . . . . 74.049999999999997 111.12 -179.979 . . . . . . . . 1 1 . 1 . 039 nuclear orig full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 9.7 ttp -105.47 6.38 32.37 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.185 -0.461 . . . . 65.319999999999993 110.901 179.86 . . . . . . . . 1 1 . 1 . 039 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 6.1 t -70.11 -6.37 33.56 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.235 -0.439 . . . . 74.239999999999995 111.193 -179.991 . . . . . . . . 1 1 . 1 . 039 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . 0.6 ' C ' ' HG3' ' A' ' 19' ' ' PRO . 40.5 t -96.26 9.91 5.79 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.164 -0.471 . . . . 75.409999999999997 111.119 179.891 . . . . . . . . 2 2 . 1 . 039 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 10.8 mt -143.93 2.04 0.31 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.192 -0.458 . . . . 75.209999999999994 111.121 179.899 . . . . . . . . 1 1 . 1 . 039 nuclear orig full ' A' A ' 17' ' ' SER . . . . . 0.796 ' C ' ' HD2' ' A' ' 19' ' ' PRO . 0.0 OUTLIER -99.67 -65.89 0.06 OUTLIER Pre-proline 0 C--N 1.329 -0.303 0 CA-C-O 121.678 0.752 . . . . 62.130000000000003 110.861 -179.916 . . . . . . . . 3 3 . 1 . 039 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . 0.893 ' N ' ' HD2' ' A' ' 19' ' ' PRO . 53.7 Cg_endo -69.74 -27.44 26.55 Favored 'Trans proline' 0 C--N 1.341 0.168 0 C-N-CA 122.716 2.277 . . . . 75.120000000000005 112.341 179.995 . . . . . . . . 2 2 . 1 . 039 nuclear orig full ' A' A ' 19' ' ' PRO . . . . . 0.893 ' HD2' ' N ' ' A' ' 18' ' ' PRO . 53.7 Cg_endo -69.81 -16.87 37.55 Favored 'Trans proline' 0 C--N 1.342 0.203 0 C-N-CA 122.65 2.234 . . . . 75.400000000000006 112.336 179.991 . . . . . . . . 2 2 . 1 . 039 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 1.1 mt-10 -82.83 -19.49 37.51 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.221 -0.445 . . . . 61.109999999999999 110.933 179.975 . . . . . . . . 1 1 . 1 . 039 nuclear orig full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -59.68 -25.82 65.05 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.122 -0.49 . . . . 75.230000000000004 110.881 -179.965 . . . . . . . . 2 2 . 1 . 039 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.313 0 C-N-CA 120.73 -0.747 . . . . 72.329999999999998 112.483 -179.955 . . . . . . . . 0 0 . 1 . 040 nuclear orig full ' A' A ' 1' ' ' TRP . . . . . . . . . . . . . 1.7 t90 . . . . . 0 C--O 1.23 0.076 0 CA-C-O 120.801 0.334 . . . . 71.540000000000006 110.962 . . . . . . . . . 0 0 . 1 . 040 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -117.41 72.36 7.16 Favored Pre-proline 0 C--N 1.329 -0.294 0 CA-C-O 121.573 0.702 . . . . 72.420000000000002 110.836 -179.913 . . . . . . . . 2 2 . 1 . 040 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.78 -172.27 0.56 Allowed 'Trans proline' 0 C--N 1.341 0.173 0 C-N-CA 122.661 2.241 . . . . 75.019999999999996 112.345 179.982 . . . . . . . . 1 1 . 1 . 040 nuclear orig full ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 45.1 m-85 -134.12 -65.56 0.65 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.22 -0.445 . . . . 74.530000000000001 110.931 -179.896 . . . . . . . . 1 1 . 1 . 040 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -79.77 -24.54 41.45 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.13 -0.486 . . . . 74.549999999999997 110.896 179.936 . . . . . . . . 2 2 . 1 . 040 nuclear orig full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -54.38 -54.13 44.73 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.204 -0.453 . . . . 74.519999999999996 110.926 179.97 . . . . . . . . 2 2 . 1 . 040 nuclear orig full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 12.3 t -59.33 -31.19 68.95 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.187 -0.46 . . . . 75.510000000000005 111.16 -179.956 . . . . . . . . 1 1 . 1 . 040 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -55.71 -26.1 43.5 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.196 -0.456 . . . . 64.400000000000006 110.856 -179.985 . . . . . . . . 2 2 . 1 . 040 nuclear orig full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -88.93 -45.44 9.68 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.174 -0.466 . . . . 74.239999999999995 110.961 -179.834 . . . . . . . . 2 2 . 1 . 040 nuclear orig full ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 16.4 m-85 -60.91 -26.5 67.51 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.11 -0.495 . . . . 74.25 110.932 -179.963 . . . . . . . . 1 1 . 1 . 040 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -63.21 -25.57 68.4 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.111 -0.495 . . . . 74.030000000000001 110.883 179.919 . . . . . . . . 2 2 . 1 . 040 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 48.5 t -81.03 -24.26 10.68 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 116.181 -0.463 . . . . 65.400000000000006 111.154 -179.989 . . . . . . . . 1 1 . 1 . 040 nuclear orig full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 8.5 ttp -106.05 3.25 27.99 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.135 -0.484 . . . . 64.140000000000001 110.86 179.921 . . . . . . . . 1 1 . 1 . 040 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 5.6 t -70.8 -5.72 32.36 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.217 -0.447 . . . . 75.319999999999993 111.142 -179.927 . . . . . . . . 1 1 . 1 . 040 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . 0.622 ' C ' ' HG3' ' A' ' 19' ' ' PRO . 40.3 t -96.33 9.09 6.37 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.18 -0.464 . . . . 73.400000000000006 111.163 179.88 . . . . . . . . 2 2 . 1 . 040 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 2.9 mp -142.78 2.26 0.38 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.136 -0.484 . . . . 75.430000000000007 111.128 179.934 . . . . . . . . 1 1 . 1 . 040 nuclear orig full ' A' A ' 17' ' ' SER . . . . . 0.821 ' C ' ' HD2' ' A' ' 19' ' ' PRO . 0.0 OUTLIER -99.65 -65.79 0.06 OUTLIER Pre-proline 0 C--N 1.33 -0.281 0 CA-C-O 121.657 0.741 . . . . 61.450000000000003 110.844 -179.924 . . . . . . . . 3 3 . 1 . 040 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . 0.908 ' N ' ' HD2' ' A' ' 19' ' ' PRO . 53.4 Cg_endo -69.76 -27.33 26.62 Favored 'Trans proline' 0 C--N 1.342 0.195 0 C-N-CA 122.651 2.234 . . . . 75.219999999999999 112.315 -179.979 . . . . . . . . 2 2 . 1 . 040 nuclear orig full ' A' A ' 19' ' ' PRO . . . . . 0.908 ' HD2' ' N ' ' A' ' 18' ' ' PRO . 53.3 Cg_endo -69.75 -17.09 37.82 Favored 'Trans proline' 0 C--N 1.341 0.18 0 C-N-CA 122.705 2.27 . . . . 75.540000000000006 112.321 179.986 . . . . . . . . 2 2 . 1 . 040 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -82.65 -19.72 37.68 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.184 -0.462 . . . . 72.5 110.857 -179.946 . . . . . . . . 2 2 . 1 . 040 nuclear orig full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -59.57 -25.83 64.9 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.153 -0.476 . . . . 72.430000000000007 110.89 -179.913 . . . . . . . . 2 2 . 1 . 040 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.304 0 C-N-CA 120.739 -0.743 . . . . 72.209999999999994 112.476 -179.953 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 58.0 t . . . . . 0 N--CA 1.457 -0.086 0 CA-C-O 120.817 0.341 . . . . 71.4 111.163 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 10.5 ttp -101.73 33.23 3.06 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.172 -0.467 . . . . 72.34 110.879 179.899 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 5.7 t -85.96 -3.95 59.05 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.245 -0.434 . . . . 72.24 111.182 -179.985 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 15' ' ' VAL . . . . . 0.672 ' C ' ' HG3' ' A' ' 19' ' ' PRO . 24.5 t -93.78 4.75 7.77 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.228 -0.442 . . . . 74.12 111.119 179.927 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 16' ' ' ILE . . . . . 0.46 ' O ' HG22 ' A' ' 16' ' ' ILE . 9.5 mt -143.47 3.19 0.34 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.184 -0.462 . . . . 64.51 111.16 179.922 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 17' ' ' SER . . . . . 0.796 ' C ' ' HD2' ' A' ' 19' ' ' PRO . 0.5 OUTLIER -100.26 -68.44 0.04 OUTLIER Pre-proline 0 C--N 1.329 -0.294 0 CA-C-O 121.643 0.735 . . . . 74.02 110.836 -179.895 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 18' ' ' PRO . . . . . 0.918 ' N ' ' HD2' ' A' ' 19' ' ' PRO . 54.2 Cg_endo -69.71 -27.89 26.14 Favored 'Trans proline' 0 C--O 1.231 0.154 0 C-N-CA 122.664 2.243 . . . . 70.15 112.391 179.953 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 19' ' ' PRO . . . . . 0.918 ' HD2' ' N ' ' A' ' 18' ' ' PRO . 54.0 Cg_endo -69.68 -16.52 37.93 Favored 'Trans proline' 0 C--N 1.342 0.189 0 C-N-CA 122.704 2.269 . . . . 70.05 112.352 179.934 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 2.8 mt-10 -81.93 -19.4 40.83 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.248 -0.433 . . . . 73.01 110.906 -179.982 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -59.62 -25.74 64.9 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.175 -0.466 . . . . 72.43 110.864 -179.954 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.302 0 C-N-CA 120.688 -0.768 . . . . 60.12 112.484 -179.934 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 48.1 t . . . . . 0 C--O 1.231 0.116 0 CA-C-O 120.795 0.331 . . . . 63.33 111.174 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 10.5 ttp -101.97 33.34 3.08 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.153 -0.476 . . . . 75.13 110.847 179.926 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 5.5 t -86.09 -4.03 59.08 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.242 -0.435 . . . . 65.2 111.171 -179.957 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 15' ' ' VAL . . . . . 0.664 ' C ' ' HG3' ' A' ' 19' ' ' PRO . 25.4 t -92.9 4.12 7.69 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.212 -0.449 . . . . 71.53 111.087 179.965 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 16' ' ' ILE . . . . . 0.459 ' O ' HG22 ' A' ' 16' ' ' ILE . 9.5 mt -143.34 3.37 0.35 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.164 -0.471 . . . . 74.12 111.089 179.928 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 17' ' ' SER . . . . . 0.807 ' C ' ' HD2' ' A' ' 19' ' ' PRO . 0.5 OUTLIER -99.91 -68.73 0.04 OUTLIER Pre-proline 0 C--N 1.33 -0.28 0 CA-C-O 121.688 0.756 . . . . 71.02 110.876 -179.92 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 18' ' ' PRO . . . . . 0.908 ' N ' ' HD2' ' A' ' 19' ' ' PRO . 53.9 Cg_endo -69.77 -27.89 25.86 Favored 'Trans proline' 0 C--N 1.342 0.211 0 C-N-CA 122.683 2.256 . . . . 72.31 112.324 179.977 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 19' ' ' PRO . . . . . 0.908 ' HD2' ' N ' ' A' ' 18' ' ' PRO . 54.2 Cg_endo -69.7 -16.47 37.83 Favored 'Trans proline' 0 C--N 1.342 0.202 0 C-N-CA 122.702 2.268 . . . . 55.2 112.358 179.949 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 2.8 mt-10 -81.94 -19.89 39.76 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.207 -0.451 . . . . 74.43 110.89 -179.964 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -58.64 -34.73 71.52 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.129 -0.487 . . . . 70.42 110.842 -179.911 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.303 0 C-N-CA 120.697 -0.763 . . . . 60.42 112.491 -179.975 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 48.1 t . . . . . 0 C--O 1.231 0.108 0 CA-C-O 120.857 0.36 . . . . 73.51 111.168 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 10.5 ttp -102.06 33.36 3.09 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.182 -0.463 . . . . 65.41 110.899 179.908 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 5.5 t -86.16 -3.94 59.06 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.183 -0.462 . . . . 55.1 111.153 -179.935 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 15' ' ' VAL . . . . . 0.668 ' C ' ' HG3' ' A' ' 19' ' ' PRO . 25.4 t -92.94 4.13 7.7 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.219 -0.446 . . . . 73.55 111.124 179.898 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 16' ' ' ILE . . . . . 0.457 ' O ' HG22 ' A' ' 16' ' ' ILE . 9.5 mt -143.27 3.3 0.35 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 116.152 -0.476 . . . . 72.22 111.123 179.914 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 17' ' ' SER . . . . . 0.811 ' C ' ' HD2' ' A' ' 19' ' ' PRO . 0.5 OUTLIER -99.84 -68.78 0.04 OUTLIER Pre-proline 0 C--N 1.329 -0.313 0 CA-C-O 121.676 0.75 . . . . 70.14 110.893 -179.917 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 18' ' ' PRO . . . . . 0.92 ' N ' ' HD2' ' A' ' 19' ' ' PRO . 53.7 Cg_endo -69.77 -27.86 25.92 Favored 'Trans proline' 0 C--N 1.341 0.165 0 C-N-CA 122.673 2.249 . . . . 64.3 112.36 179.952 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 19' ' ' PRO . . . . . 0.92 ' HD2' ' N ' ' A' ' 18' ' ' PRO . 53.2 Cg_endo -69.77 -16.42 37.51 Favored 'Trans proline' 0 C--N 1.341 0.176 0 C-N-CA 122.668 2.246 . . . . 65.14 112.329 179.96 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 1.5 mt-10 -81.91 -19.52 40.65 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.207 -0.451 . . . . 62.23 110.871 -179.995 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -59.56 -25.71 64.79 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.178 -0.465 . . . . 71.02 110.911 -179.918 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.342 0 C-N-CA 120.752 -0.737 . . . . 53.33 112.469 -179.963 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 50.4 t . . . . . 0 C--O 1.23 0.074 0 CA-C-O 120.862 0.363 . . . . 72.53 111.141 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 10.4 ttp -102.26 33.7 3.01 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.13 -0.486 . . . . 65.14 110.884 179.926 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 5.8 t -86.47 -3.94 59.09 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.264 -0.425 . . . . 73.35 111.143 -179.912 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 15' ' ' VAL . . . . . 0.68 ' C ' ' HG3' ' A' ' 19' ' ' PRO . 24.3 t -93.87 4.1 8.21 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.208 -0.451 . . . . 72.42 111.155 179.911 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 16' ' ' ILE . . . . . 0.458 HG22 ' O ' ' A' ' 16' ' ' ILE . 2.8 mp -142.5 3.46 0.4 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.194 -0.457 . . . . 54.51 111.144 179.893 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 17' ' ' SER . . . . . 0.794 ' C ' ' HD2' ' A' ' 19' ' ' PRO . 0.5 OUTLIER -100.19 -68.43 0.04 OUTLIER Pre-proline 0 C--N 1.329 -0.296 0 CA-C-O 121.675 0.75 . . . . 74.34 110.895 -179.962 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 18' ' ' PRO . . . . . 0.919 ' N ' ' HD2' ' A' ' 19' ' ' PRO . 53.1 Cg_endo -69.73 -27.94 26.02 Favored 'Trans proline' 0 C--N 1.341 0.144 0 C-N-CA 122.73 2.286 . . . . 64.14 112.319 179.973 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 19' ' ' PRO . . . . . 0.919 ' HD2' ' N ' ' A' ' 18' ' ' PRO . 53.9 Cg_endo -69.71 -16.42 37.74 Favored 'Trans proline' 0 C--N 1.342 0.213 0 C-N-CA 122.651 2.234 . . . . 74.14 112.366 179.952 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -81.93 -19.76 40.08 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.207 -0.451 . . . . 75.41 110.863 -179.979 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -58.63 -32.93 69.5 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.151 -0.477 . . . . 62.44 110.896 -179.891 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.45 -0.372 0 C-N-CA 120.764 -0.732 . . . . 75.22 112.502 179.979 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 61.5 t . . . . . 0 C--O 1.231 0.101 0 CA-C-O 120.833 0.349 . . . . 70.02 111.132 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 10.4 ttp -102.05 33.84 2.91 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.159 -0.473 . . . . 53.14 110.882 179.955 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 5.8 t -86.59 -3.84 59.09 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.212 -0.449 . . . . 64.14 111.193 -179.949 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 15' ' ' VAL . . . . . 0.684 ' C ' ' HG3' ' A' ' 19' ' ' PRO . 24.2 t -93.94 4.07 8.27 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.191 -0.459 . . . . 71.13 111.132 179.904 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 16' ' ' ILE . . . . . 0.465 ' O ' HG22 ' A' ' 16' ' ' ILE . 2.8 mp -142.45 3.45 0.4 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.138 -0.483 . . . . 50.25 111.127 179.872 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 17' ' ' SER . . . . . 0.798 ' C ' ' HD2' ' A' ' 19' ' ' PRO . 0.5 OUTLIER -100.18 -68.41 0.04 OUTLIER Pre-proline 0 C--N 1.329 -0.291 0 CA-C-O 121.661 0.743 . . . . 72.23 110.884 -179.952 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 18' ' ' PRO . . . . . 0.919 ' N ' ' HD2' ' A' ' 19' ' ' PRO . 53.6 Cg_endo -69.75 -27.84 26.03 Favored 'Trans proline' 0 N--CA 1.465 -0.159 0 C-N-CA 122.716 2.277 . . . . 71.32 112.37 179.961 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 19' ' ' PRO . . . . . 0.919 ' HD2' ' N ' ' A' ' 18' ' ' PRO . 54.1 Cg_endo -69.77 -16.41 37.5 Favored 'Trans proline' 0 C--N 1.342 0.203 0 C-N-CA 122.624 2.216 . . . . 72.33 112.361 179.932 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -81.95 -19.85 39.84 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.206 -0.452 . . . . 72.5 110.879 -179.949 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -58.65 -34.54 71.31 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.125 -0.488 . . . . 71.52 110.864 -179.907 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.279 0 C-N-CA 120.748 -0.739 . . . . 52.33 112.427 -179.979 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 42.4 t . . . . . 0 C--O 1.23 0.07 0 CA-C-O 120.84 0.352 . . . . 75.03 111.124 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 10.3 ttp -102.02 33.77 2.93 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.183 -0.462 . . . . 74.11 110.884 179.928 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 5.8 t -86.5 -3.91 59.09 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.214 -0.448 . . . . 64.34 111.172 -179.978 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 15' ' ' VAL . . . . . 0.679 ' C ' ' HG3' ' A' ' 19' ' ' PRO . 24.1 t -93.86 4.07 8.22 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.243 -0.435 . . . . 62.11 111.107 179.933 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 16' ' ' ILE . . . . . 0.463 ' O ' HG22 ' A' ' 16' ' ' ILE . 2.8 mp -142.48 3.45 0.4 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.197 -0.456 . . . . 64.31 111.124 179.916 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 17' ' ' SER . . . . . 0.811 ' C ' ' HD2' ' A' ' 19' ' ' PRO . 0.5 OUTLIER -100.23 -68.42 0.04 OUTLIER Pre-proline 0 C--N 1.329 -0.293 0 CA-C-O 121.629 0.728 . . . . 72.12 110.838 -179.936 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 18' ' ' PRO . . . . . 0.911 ' N ' ' HD2' ' A' ' 19' ' ' PRO . 54.0 Cg_endo -69.72 -27.93 26.07 Favored 'Trans proline' 0 C--N 1.341 0.153 0 C-N-CA 122.726 2.284 . . . . 71.12 112.338 179.995 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 19' ' ' PRO . . . . . 0.911 ' HD2' ' N ' ' A' ' 18' ' ' PRO . 54.1 Cg_endo -69.69 -16.44 37.84 Favored 'Trans proline' 0 C--N 1.341 0.172 0 C-N-CA 122.704 2.27 . . . . 53.24 112.365 179.958 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -81.99 -19.51 40.39 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.184 -0.462 . . . . 74.42 110.852 -179.953 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -59.54 -25.72 64.75 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.139 -0.482 . . . . 72.51 110.912 -179.954 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.347 0 C-N-CA 120.795 -0.717 . . . . 71.24 112.496 -179.968 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 41.4 t . . . . . 0 C--O 1.231 0.116 0 CA-C-O 120.82 0.343 . . . . 53.13 111.121 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 9.4 ttp -102.24 32.78 3.36 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.212 -0.449 . . . . 73.03 110.872 179.928 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 5.9 t -86.78 -3.76 59.09 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.209 -0.45 . . . . 74.42 111.143 -179.899 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 15' ' ' VAL . . . . . 0.69 ' C ' ' HG3' ' A' ' 19' ' ' PRO . 23.2 t -94.25 4.58 8.13 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.187 -0.461 . . . . 64.42 111.122 179.904 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 16' ' ' ILE . . . . . 0.461 ' O ' HG22 ' A' ' 16' ' ' ILE . 2.8 mp -142.46 3.28 0.4 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.157 -0.474 . . . . 74.01 111.149 179.892 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 17' ' ' SER . . . . . 0.791 ' C ' ' HD2' ' A' ' 19' ' ' PRO . 0.5 OUTLIER -100.27 -68.24 0.05 OUTLIER Pre-proline 0 C--N 1.33 -0.272 0 CA-C-O 121.688 0.756 . . . . 75.3 110.926 -179.965 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 18' ' ' PRO . . . . . 0.929 ' N ' ' HD2' ' A' ' 19' ' ' PRO . 53.8 Cg_endo -69.79 -27.8 25.88 Favored 'Trans proline' 0 C--N 1.342 0.206 0 C-N-CA 122.681 2.254 . . . . 73.13 112.362 179.946 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 19' ' ' PRO . . . . . 0.929 ' HD2' ' N ' ' A' ' 18' ' ' PRO . 53.5 Cg_endo -69.77 -16.46 37.54 Favored 'Trans proline' 0 C--N 1.342 0.205 0 C-N-CA 122.717 2.278 . . . . 55.15 112.32 179.949 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -81.94 -19.91 39.72 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.249 -0.432 . . . . 73.02 110.909 -179.954 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -58.57 -34.34 70.96 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.136 -0.484 . . . . 72.45 110.866 -179.934 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.296 0 C-N-CA 120.775 -0.726 . . . . 64.11 112.488 -179.906 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 64.1 t . . . . . 0 C--O 1.231 0.091 0 CA-C-O 120.822 0.344 . . . . 75.12 111.152 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 10.4 ttp -101.74 33.28 3.05 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.188 -0.46 . . . . 72.33 110.863 179.897 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 5.7 t -86.02 -3.97 59.06 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.219 -0.446 . . . . 61.13 111.162 -179.956 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 15' ' ' VAL . . . . . 0.669 ' C ' ' HG3' ' A' ' 19' ' ' PRO . 24.4 t -93.84 4.85 7.74 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.191 -0.459 . . . . 53.24 111.11 179.95 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 16' ' ' ILE . . . . . 0.459 ' O ' HG22 ' A' ' 16' ' ' ILE . 9.6 mt -143.47 3.04 0.34 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 116.177 -0.465 . . . . 72.3 111.121 179.943 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 17' ' ' SER . . . . . 0.805 ' C ' ' HD2' ' A' ' 19' ' ' PRO . 0.5 OUTLIER -100.18 -68.39 0.04 OUTLIER Pre-proline 0 C--N 1.329 -0.295 0 CA-C-O 121.613 0.72 . . . . 75.4 110.837 -179.911 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 18' ' ' PRO . . . . . 0.909 ' N ' ' HD2' ' A' ' 19' ' ' PRO . 54.0 Cg_endo -69.74 -27.89 26.01 Favored 'Trans proline' 0 C--O 1.232 0.203 0 C-N-CA 122.657 2.238 . . . . 72.31 112.339 179.983 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 19' ' ' PRO . . . . . 0.909 ' HD2' ' N ' ' A' ' 18' ' ' PRO . 54.1 Cg_endo -69.71 -16.78 37.91 Favored 'Trans proline' 0 C--N 1.341 0.155 0 C-N-CA 122.725 2.284 . . . . 63.0 112.383 179.921 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 24.4 tt0 -82.55 -21.26 35.41 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.177 -0.465 . . . . 64.21 110.906 179.991 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -58.22 -34.16 70.11 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.173 -0.467 . . . . 74.12 110.864 -179.92 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.292 0 C-N-CA 120.755 -0.736 . . . . 73.32 112.475 -179.957 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 58.5 t . . . . . 0 C--O 1.23 0.066 0 CA-C-O 120.833 0.349 . . . . 72.32 111.142 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 10.5 ttp -102.08 33.88 2.9 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.167 -0.469 . . . . 63.24 110.906 179.878 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 5.6 t -86.67 -3.92 59.1 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.198 -0.455 . . . . 73.42 111.186 -179.944 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 15' ' ' VAL . . . . . 0.686 ' C ' ' HG3' ' A' ' 19' ' ' PRO . 25.0 t -93.07 3.49 8.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.17 -0.468 . . . . 44.13 111.094 179.937 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 16' ' ' ILE . . . . . 0.458 ' O ' HG22 ' A' ' 16' ' ' ILE . 2.8 mp -142.45 3.71 0.4 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.171 -0.468 . . . . 62.21 111.121 179.929 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 17' ' ' SER . . . . . 0.805 ' C ' ' HD2' ' A' ' 19' ' ' PRO . 0.5 OUTLIER -99.92 -68.77 0.04 OUTLIER Pre-proline 0 C--N 1.329 -0.303 0 CA-C-O 121.681 0.753 . . . . 44.1 110.904 -179.951 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 18' ' ' PRO . . . . . 0.92 ' N ' ' HD2' ' A' ' 19' ' ' PRO . 53.7 Cg_endo -69.82 -27.86 25.69 Favored 'Trans proline' 0 C--O 1.231 0.174 0 C-N-CA 122.675 2.25 . . . . 71.51 112.334 179.963 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 19' ' ' PRO . . . . . 0.92 ' HD2' ' N ' ' A' ' 18' ' ' PRO . 53.7 Cg_endo -69.78 -16.48 37.51 Favored 'Trans proline' 0 C--N 1.341 0.145 0 C-N-CA 122.701 2.267 . . . . 74.04 112.372 179.938 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 1.5 mt-10 -81.94 -19.89 39.75 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.193 -0.458 . . . . 71.42 110.911 -179.984 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -58.59 -34.43 71.08 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.119 -0.491 . . . . 75.54 110.848 -179.91 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.289 0 C-N-CA 120.715 -0.755 . . . . 73.35 112.529 -179.929 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 23.5 t . . . . . 0 N--CA 1.457 -0.081 0 CA-C-O 120.831 0.348 . . . . 62.51 111.152 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 10.5 ttp -102.12 33.97 2.88 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.112 -0.494 . . . . 75.22 110.878 179.937 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 5.7 t -86.68 -4.0 59.12 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.247 -0.433 . . . . 70.32 111.158 -179.927 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 15' ' ' VAL . . . . . 0.679 ' C ' ' HG3' ' A' ' 19' ' ' PRO . 25.0 t -92.98 3.43 8.18 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 116.198 -0.455 . . . . 63.14 111.129 179.932 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 16' ' ' ILE . . . . . 0.452 ' O ' HG22 ' A' ' 16' ' ' ILE . 2.8 mp -142.37 3.68 0.41 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.175 -0.466 . . . . 74.44 111.178 179.95 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 17' ' ' SER . . . . . 0.809 ' C ' ' HD2' ' A' ' 19' ' ' PRO . 0.5 OUTLIER -99.95 -68.81 0.04 OUTLIER Pre-proline 0 C--N 1.33 -0.268 0 CA-C-O 121.615 0.721 . . . . 73.44 110.846 -179.942 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 18' ' ' PRO . . . . . 0.927 ' N ' ' HD2' ' A' ' 19' ' ' PRO . 54.5 Cg_endo -69.68 -27.88 26.3 Favored 'Trans proline' 0 C--N 1.341 0.166 0 C-N-CA 122.681 2.254 . . . . 52.45 112.379 179.939 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 19' ' ' PRO . . . . . 0.927 ' HD2' ' N ' ' A' ' 18' ' ' PRO . 53.9 Cg_endo -69.75 -16.57 37.65 Favored 'Trans proline' 0 C--N 1.341 0.151 0 C-N-CA 122.689 2.259 . . . . 62.32 112.378 179.922 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -81.85 -19.91 40.04 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.186 -0.461 . . . . 74.02 110.906 -179.982 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -58.54 -33.4 69.85 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.14 -0.482 . . . . 73.54 110.883 -179.933 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.314 0 C-N-CA 120.715 -0.755 . . . . 72.44 112.516 -179.929 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 61.9 t . . . . . 0 C--O 1.231 0.106 0 CA-C-O 120.801 0.334 . . . . 75.03 111.102 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 10.3 ttp -101.94 33.76 2.92 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.191 -0.459 . . . . 73.45 110.906 179.908 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 5.8 t -86.48 -3.93 59.09 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.236 -0.438 . . . . 54.11 111.177 -179.972 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 15' ' ' VAL . . . . . 0.673 ' C ' ' HG3' ' A' ' 19' ' ' PRO . 24.1 t -93.85 4.07 8.22 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.207 -0.451 . . . . 72.41 111.111 179.924 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 16' ' ' ILE . . . . . 0.461 ' O ' HG22 ' A' ' 16' ' ' ILE . 2.8 mp -142.49 3.43 0.4 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.225 -0.443 . . . . 74.43 111.128 179.954 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 17' ' ' SER . . . . . 0.811 ' C ' ' HD2' ' A' ' 19' ' ' PRO . 0.5 OUTLIER -100.24 -68.39 0.04 OUTLIER Pre-proline 0 C--N 1.33 -0.239 0 CA-C-O 121.639 0.733 . . . . 55.23 110.832 -179.91 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 18' ' ' PRO . . . . . 0.908 ' N ' ' HD2' ' A' ' 19' ' ' PRO . 53.6 Cg_endo -69.73 -27.89 26.07 Favored 'Trans proline' 0 C--N 1.341 0.179 0 C-N-CA 122.746 2.297 . . . . 72.44 112.298 179.994 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 19' ' ' PRO . . . . . 0.908 ' HD2' ' N ' ' A' ' 18' ' ' PRO . 53.4 Cg_endo -69.76 -16.45 37.58 Favored 'Trans proline' 0 C--N 1.342 0.187 0 C-N-CA 122.687 2.258 . . . . 72.25 112.355 179.972 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -81.9 -19.88 39.92 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.235 -0.439 . . . . 71.24 110.924 179.987 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -58.68 -33.95 70.72 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.123 -0.49 . . . . 73.12 110.874 -179.928 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.326 0 C-N-CA 120.782 -0.723 . . . . 61.31 112.469 -179.962 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 57.6 t . . . . . 0 C--O 1.231 0.084 0 CA-C-O 120.762 0.315 . . . . 72.42 111.122 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 10.3 ttp -102.0 33.75 2.94 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.184 -0.462 . . . . 74.24 110.86 179.898 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 5.8 t -86.52 -3.89 59.09 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.234 -0.439 . . . . 32.45 111.136 -179.948 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 15' ' ' VAL . . . . . 0.686 ' C ' ' HG3' ' A' ' 19' ' ' PRO . 24.3 t -93.88 4.07 8.23 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.232 -0.44 . . . . 62.43 111.116 179.926 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 16' ' ' ILE . . . . . 0.453 ' O ' HG22 ' A' ' 16' ' ' ILE . 2.8 mp -142.44 3.4 0.4 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.188 -0.46 . . . . 54.04 111.143 179.911 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 17' ' ' SER . . . . . 0.806 ' C ' ' HD2' ' A' ' 19' ' ' PRO . 0.5 OUTLIER -100.2 -68.36 0.04 OUTLIER Pre-proline 0 C--N 1.329 -0.325 0 CA-C-O 121.642 0.734 . . . . 63.14 110.865 -179.88 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 18' ' ' PRO . . . . . 0.915 ' N ' ' HD2' ' A' ' 19' ' ' PRO . 53.5 Cg_endo -69.82 -27.88 25.62 Favored 'Trans proline' 0 C--N 1.341 0.158 0 C-N-CA 122.678 2.252 . . . . 61.33 112.323 179.985 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 19' ' ' PRO . . . . . 0.915 ' HD2' ' N ' ' A' ' 18' ' ' PRO . 53.9 Cg_endo -69.74 -16.82 37.81 Favored 'Trans proline' 0 C--N 1.341 0.168 0 C-N-CA 122.73 2.287 . . . . 70.44 112.323 179.929 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 29.4 tt0 -82.52 -21.29 35.46 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.243 -0.435 . . . . 74.12 110.887 -179.969 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -58.28 -31.34 67.37 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.144 -0.48 . . . . 61.42 110.842 -179.884 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.325 0 C-N-CA 120.716 -0.754 . . . . 63.13 112.52 -179.945 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 60.8 t . . . . . 0 C--O 1.231 0.083 0 CA-C-O 120.81 0.338 . . . . 70.41 111.077 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 10.4 ttp -102.2 34.27 2.79 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.193 -0.458 . . . . 62.12 110.895 179.923 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 5.6 t -86.85 -4.05 59.13 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.243 -0.435 . . . . 72.14 111.162 -179.964 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 15' ' ' VAL . . . . . 0.686 ' C ' ' HG3' ' A' ' 19' ' ' PRO . 24.6 t -93.0 3.45 8.18 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.217 -0.447 . . . . 61.23 111.09 179.93 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 16' ' ' ILE . . . . . 0.463 ' O ' HG22 ' A' ' 16' ' ' ILE . 2.8 mp -142.3 3.63 0.41 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 116.19 -0.459 . . . . 75.3 111.132 179.942 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 17' ' ' SER . . . . . 0.789 ' C ' ' HD2' ' A' ' 19' ' ' PRO . 0.5 OUTLIER -99.91 -68.8 0.04 OUTLIER Pre-proline 0 C--N 1.329 -0.326 0 CA-C-O 121.618 0.723 . . . . 63.12 110.869 -179.89 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 18' ' ' PRO . . . . . 0.918 ' N ' ' HD2' ' A' ' 19' ' ' PRO . 53.3 Cg_endo -69.77 -27.91 25.86 Favored 'Trans proline' 0 C--O 1.231 0.168 0 C-N-CA 122.738 2.292 . . . . 72.41 112.326 179.975 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 19' ' ' PRO . . . . . 0.918 ' HD2' ' N ' ' A' ' 18' ' ' PRO . 54.1 Cg_endo -69.76 -16.24 37.48 Favored 'Trans proline' 0 C--N 1.341 0.181 0 C-N-CA 122.715 2.276 . . . . 64.33 112.335 179.956 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 1.8 mt-10 -82.12 -19.74 39.45 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.221 -0.445 . . . . 72.23 110.891 -179.973 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -59.39 -25.6 64.41 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.167 -0.469 . . . . 75.2 110.88 -179.891 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.45 -0.368 0 C-N-CA 120.771 -0.728 . . . . 62.51 112.513 -179.985 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 47.5 t . . . . . 0 N--CA 1.457 -0.077 0 CA-C-O 120.835 0.35 . . . . 62.32 111.092 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 10.4 ttp -102.01 33.9 2.89 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.163 -0.471 . . . . 73.14 110.92 179.903 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 5.6 t -86.71 -3.91 59.11 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.206 -0.452 . . . . 73.35 111.175 -179.913 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 15' ' ' VAL . . . . . 0.673 ' C ' ' HG3' ' A' ' 19' ' ' PRO . 24.7 t -93.04 3.44 8.21 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.194 -0.457 . . . . 74.1 111.155 179.866 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 16' ' ' ILE . . . . . 0.457 ' O ' HG22 ' A' ' 16' ' ' ILE . 2.8 mp -142.31 3.67 0.41 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.17 -0.468 . . . . 53.34 111.138 179.89 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 17' ' ' SER . . . . . 0.795 ' C ' ' HD2' ' A' ' 19' ' ' PRO . 0.5 OUTLIER -99.91 -68.78 0.04 OUTLIER Pre-proline 0 C--N 1.33 -0.274 0 CA-C-O 121.664 0.745 . . . . 74.22 110.848 -179.889 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 18' ' ' PRO . . . . . 0.913 ' N ' ' HD2' ' A' ' 19' ' ' PRO . 53.6 Cg_endo -69.75 -27.95 25.91 Favored 'Trans proline' 0 C--N 1.341 0.167 0 C-N-CA 122.752 2.301 . . . . 62.54 112.335 179.974 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 19' ' ' PRO . . . . . 0.913 ' HD2' ' N ' ' A' ' 18' ' ' PRO . 53.7 Cg_endo -69.81 -16.71 37.48 Favored 'Trans proline' 0 C--N 1.342 0.188 0 C-N-CA 122.66 2.24 . . . . 72.23 112.361 179.939 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 60.2 tt0 -82.63 -21.28 35.13 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.216 -0.447 . . . . 74.11 110.854 179.994 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -58.19 -34.24 70.15 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.223 -0.444 . . . . 74.45 110.83 -179.876 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.271 0 C-N-CA 120.754 -0.736 . . . . 61.42 112.465 -179.953 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 53.4 t . . . . . 0 C--O 1.23 0.064 0 CA-C-O 120.825 0.345 . . . . 51.0 111.135 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 10.5 ttp -101.68 33.22 3.06 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.171 -0.468 . . . . 72.25 110.9 179.887 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 5.7 t -85.92 -4.01 59.06 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.223 -0.444 . . . . 71.15 111.14 -179.94 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 15' ' ' VAL . . . . . 0.68 ' C ' ' HG3' ' A' ' 19' ' ' PRO . 24.5 t -93.78 4.77 7.76 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.229 -0.441 . . . . 73.12 111.13 179.966 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 16' ' ' ILE . . . . . 0.447 ' O ' HG22 ' A' ' 16' ' ' ILE . 9.7 mt -143.49 3.2 0.34 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.156 -0.474 . . . . 71.1 111.097 179.927 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 17' ' ' SER . . . . . 0.791 ' C ' ' HD2' ' A' ' 19' ' ' PRO . 0.5 OUTLIER -100.27 -68.42 0.04 OUTLIER Pre-proline 0 C--N 1.329 -0.291 0 CA-C-O 121.674 0.749 . . . . 73.35 110.839 -179.911 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 18' ' ' PRO . . . . . 0.912 ' N ' ' HD2' ' A' ' 19' ' ' PRO . 54.4 Cg_endo -69.71 -27.88 26.17 Favored 'Trans proline' 0 C--O 1.232 0.184 0 C-N-CA 122.683 2.255 . . . . 73.44 112.373 179.933 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 19' ' ' PRO . . . . . 0.912 ' HD2' ' N ' ' A' ' 18' ' ' PRO . 54.4 Cg_endo -69.72 -16.43 37.74 Favored 'Trans proline' 0 C--N 1.341 0.149 0 C-N-CA 122.693 2.262 . . . . 64.41 112.38 179.906 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 2.9 mt-10 -81.91 -19.92 39.83 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.194 -0.457 . . . . 74.31 110.901 -179.998 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -58.61 -34.4 71.09 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.127 -0.488 . . . . 73.23 110.914 -179.916 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.266 0 C-N-CA 120.766 -0.731 . . . . 45.15 112.472 -179.981 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 26.0 t . . . . . 0 C--O 1.231 0.117 0 CA-C-O 120.767 0.318 . . . . 53.12 111.086 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 10.6 ttp -101.93 33.43 3.04 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.215 -0.448 . . . . 64.31 110.894 179.901 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 5.5 t -86.12 -4.04 59.08 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.194 -0.457 . . . . 74.53 111.139 -179.94 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 15' ' ' VAL . . . . . 0.664 ' C ' ' HG3' ' A' ' 19' ' ' PRO . 25.8 t -92.89 4.15 7.66 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-N 116.228 -0.442 . . . . 52.3 111.113 179.901 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 16' ' ' ILE . . . . . 0.458 ' O ' HG22 ' A' ' 16' ' ' ILE . 9.3 mt -143.34 3.4 0.35 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.195 -0.457 . . . . 61.35 111.102 179.901 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 17' ' ' SER . . . . . 0.792 ' C ' ' HD2' ' A' ' 19' ' ' PRO . 0.5 OUTLIER -99.9 -68.75 0.04 OUTLIER Pre-proline 0 C--N 1.329 -0.295 0 CA-C-O 121.683 0.754 . . . . 73.44 110.882 -179.94 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 18' ' ' PRO . . . . . 0.93 ' N ' ' HD2' ' A' ' 19' ' ' PRO . 53.3 Cg_endo -69.83 -27.79 25.72 Favored 'Trans proline' 0 C--N 1.341 0.168 0 C-N-CA 122.673 2.248 . . . . 74.23 112.333 179.994 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 19' ' ' PRO . . . . . 0.93 ' HD2' ' N ' ' A' ' 18' ' ' PRO . 53.3 Cg_endo -69.82 -16.43 37.3 Favored 'Trans proline' 0 C--N 1.342 0.193 0 C-N-CA 122.683 2.255 . . . . 62.31 112.301 179.957 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -81.91 -19.55 40.57 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.267 -0.424 . . . . 73.51 110.872 -179.965 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -59.78 -25.77 65.18 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.144 -0.48 . . . . 71.52 110.827 -179.887 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.299 0 C-N-CA 120.75 -0.738 . . . . 55.11 112.527 -179.991 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 56.4 t . . . . . 0 C--O 1.23 0.051 0 CA-C-O 120.826 0.346 . . . . 74.35 111.154 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 10.4 ttp -102.23 33.7 3.0 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.117 -0.492 . . . . 74.12 110.883 179.931 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 5.8 t -86.49 -3.89 59.08 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.203 -0.453 . . . . 63.11 111.153 -179.912 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 15' ' ' VAL . . . . . 0.688 ' C ' ' HG3' ' A' ' 19' ' ' PRO . 24.0 t -93.88 4.07 8.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.186 -0.461 . . . . 64.22 111.131 179.928 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 16' ' ' ILE . . . . . 0.45 ' O ' HG22 ' A' ' 16' ' ' ILE . 2.8 mp -142.47 3.41 0.4 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.172 -0.467 . . . . 70.22 111.176 179.898 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 17' ' ' SER . . . . . 0.797 ' C ' ' HD2' ' A' ' 19' ' ' PRO . 0.5 OUTLIER -100.16 -68.48 0.04 OUTLIER Pre-proline 0 C--N 1.328 -0.33 0 CA-C-O 121.654 0.74 . . . . 73.21 110.877 -179.941 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 18' ' ' PRO . . . . . 0.914 ' N ' ' HD2' ' A' ' 19' ' ' PRO . 53.6 Cg_endo -69.74 -27.84 26.09 Favored 'Trans proline' 0 C--N 1.341 0.178 0 C-N-CA 122.701 2.268 . . . . 74.11 112.344 179.987 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 19' ' ' PRO . . . . . 0.914 ' HD2' ' N ' ' A' ' 18' ' ' PRO . 53.5 Cg_endo -69.77 -16.5 37.55 Favored 'Trans proline' 0 C--N 1.342 0.216 0 C-N-CA 122.685 2.257 . . . . 71.01 112.339 179.943 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -81.85 -19.85 40.16 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.222 -0.444 . . . . 71.34 110.908 179.999 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -58.65 -34.52 71.29 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.172 -0.467 . . . . 72.33 110.832 -179.9 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.352 0 C-N-CA 120.744 -0.741 . . . . 70.11 112.506 -179.946 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 21.9 t . . . . . 0 N--CA 1.457 -0.086 0 CA-C-O 120.823 0.344 . . . . 53.04 111.149 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 10.5 ttp -102.21 33.85 2.94 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.182 -0.463 . . . . 41.34 110.856 179.939 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 5.6 t -86.62 -3.98 59.11 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.23 -0.441 . . . . 71.2 111.145 -179.939 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 15' ' ' VAL . . . . . 0.68 ' C ' ' HG3' ' A' ' 19' ' ' PRO . 25.3 t -93.01 3.47 8.17 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.201 -0.454 . . . . 41.41 111.143 179.912 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 16' ' ' ILE . . . . . 0.464 ' O ' HG22 ' A' ' 16' ' ' ILE . 2.8 mp -142.39 3.68 0.41 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.139 -0.482 . . . . 73.13 111.127 179.913 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 17' ' ' SER . . . . . 0.798 ' C ' ' HD2' ' A' ' 19' ' ' PRO . 0.5 OUTLIER -99.9 -68.78 0.04 OUTLIER Pre-proline 0 C--N 1.329 -0.287 0 CA-C-O 121.678 0.751 . . . . 61.21 110.831 -179.906 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 18' ' ' PRO . . . . . 0.926 ' N ' ' HD2' ' A' ' 19' ' ' PRO . 54.0 Cg_endo -69.78 -27.88 25.86 Favored 'Trans proline' 0 C--O 1.232 0.182 0 C-N-CA 122.664 2.243 . . . . 41.33 112.361 179.982 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 19' ' ' PRO . . . . . 0.926 ' HD2' ' N ' ' A' ' 18' ' ' PRO . 53.6 Cg_endo -69.82 -16.38 37.3 Favored 'Trans proline' 0 C--N 1.341 0.155 0 C-N-CA 122.713 2.275 . . . . 72.13 112.322 179.964 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -82.01 -19.85 39.63 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.248 -0.433 . . . . 75.32 110.868 -179.977 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -58.66 -34.36 71.14 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.12 -0.491 . . . . 74.44 110.832 -179.88 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.45 -0.367 0 C-N-CA 120.696 -0.764 . . . . 45.24 112.529 -179.97 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 25.9 t . . . . . 0 C--O 1.23 0.056 0 CA-C-O 120.862 0.363 . . . . 74.15 111.127 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 10.5 ttp -102.22 33.93 2.92 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.146 -0.479 . . . . 75.14 110.878 179.959 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 5.7 t -86.7 -3.91 59.11 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.213 -0.449 . . . . 71.11 111.118 -179.897 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 15' ' ' VAL . . . . . 0.683 ' C ' ' HG3' ' A' ' 19' ' ' PRO . 25.1 t -93.06 3.48 8.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.233 -0.44 . . . . 71.15 111.171 179.884 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 16' ' ' ILE . . . . . 0.462 ' O ' HG22 ' A' ' 16' ' ' ILE . 2.8 mp -142.36 3.63 0.41 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.108 -0.497 . . . . 63.32 111.128 179.912 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 17' ' ' SER . . . . . 0.79 ' C ' ' HD2' ' A' ' 19' ' ' PRO . 0.5 OUTLIER -99.89 -68.8 0.04 OUTLIER Pre-proline 0 C--N 1.329 -0.287 0 CA-C-O 121.631 0.729 . . . . 71.22 110.874 -179.914 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 18' ' ' PRO . . . . . 0.918 ' N ' ' HD2' ' A' ' 19' ' ' PRO . 53.9 Cg_endo -69.75 -27.88 25.99 Favored 'Trans proline' 0 C--N 1.341 0.175 0 C-N-CA 122.672 2.248 . . . . 73.51 112.387 179.952 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 19' ' ' PRO . . . . . 0.918 ' HD2' ' N ' ' A' ' 18' ' ' PRO . 53.4 Cg_endo -69.79 -16.43 37.44 Favored 'Trans proline' 0 C--N 1.342 0.203 0 C-N-CA 122.686 2.258 . . . . 43.13 112.323 179.97 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -81.95 -19.83 39.85 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.228 -0.442 . . . . 72.14 110.893 -179.991 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -58.65 -32.52 69.15 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.145 -0.479 . . . . 74.22 110.904 -179.919 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.312 0 C-N-CA 120.771 -0.728 . . . . 73.25 112.494 -179.94 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 39.7 t . . . . . 0 C--O 1.231 0.08 0 CA-C-O 120.812 0.339 . . . . 73.21 111.139 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 10.4 ttp -102.0 33.98 2.86 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.174 -0.466 . . . . 42.24 110.871 179.939 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 5.8 t -86.64 -3.87 59.09 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.258 -0.428 . . . . 53.44 111.108 -179.896 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 15' ' ' VAL . . . . . 0.683 ' C ' ' HG3' ' A' ' 19' ' ' PRO . 24.7 t -93.77 3.97 8.23 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.23 -0.441 . . . . 75.22 111.141 179.885 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 16' ' ' ILE . . . . . 0.463 HG22 ' O ' ' A' ' 16' ' ' ILE . 2.8 mp -142.52 3.49 0.4 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.183 -0.462 . . . . 73.13 111.099 179.922 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 17' ' ' SER . . . . . 0.794 ' C ' ' HD2' ' A' ' 19' ' ' PRO . 0.5 OUTLIER -100.25 -68.42 0.04 OUTLIER Pre-proline 0 C--N 1.329 -0.305 0 CA-C-O 121.656 0.741 . . . . 64.01 110.85 -179.923 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 18' ' ' PRO . . . . . 0.929 ' N ' ' HD2' ' A' ' 19' ' ' PRO . 53.7 Cg_endo -69.76 -27.81 26.01 Favored 'Trans proline' 0 C--N 1.342 0.199 0 C-N-CA 122.612 2.208 . . . . 61.1 112.363 179.97 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 19' ' ' PRO . . . . . 0.929 ' HD2' ' N ' ' A' ' 18' ' ' PRO . 53.8 Cg_endo -69.74 -16.52 37.68 Favored 'Trans proline' 0 C--N 1.341 0.156 0 C-N-CA 122.699 2.266 . . . . 74.45 112.326 179.948 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 2.1 mt-10 -81.88 -19.94 39.86 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.216 -0.447 . . . . 52.41 110.907 -179.975 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -58.56 -33.13 69.59 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.145 -0.479 . . . . 73.2 110.858 -179.908 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.286 0 C-N-CA 120.725 -0.75 . . . . 15.15 112.489 -179.964 . . . . . . . . 0 0 . 1 . 021 nuclear build core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 56.4 t . . . . . 0 C--O 1.231 0.091 0 CA-C-O 120.84 0.352 . . . . 73.34 111.146 . . . . . . . . . 0 0 . 1 . 021 nuclear build core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 10.6 ttp -101.91 33.43 3.03 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.124 -0.489 . . . . 62.23 110.906 179.906 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 5.5 t -86.15 -4.04 59.08 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.178 -0.465 . . . . 52.02 111.099 -179.908 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 15' ' ' VAL . . . . . 0.666 ' C ' ' HG3' ' A' ' 19' ' ' PRO . 25.5 t -92.91 4.11 7.7 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.262 -0.426 . . . . 55.21 111.095 179.948 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 16' ' ' ILE . . . . . 0.449 ' O ' HG22 ' A' ' 16' ' ' ILE . 9.4 mt -143.28 3.37 0.35 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.196 -0.456 . . . . 65.12 111.172 179.913 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 17' ' ' SER . . . . . 0.791 ' C ' ' HD2' ' A' ' 19' ' ' PRO . 0.5 OUTLIER -99.98 -68.78 0.04 OUTLIER Pre-proline 0 C--N 1.33 -0.274 0 CA-C-O 121.633 0.73 . . . . 74.33 110.825 -179.843 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' A' A ' 18' ' ' PRO . . . . . 0.925 ' N ' ' HD2' ' A' ' 19' ' ' PRO . 53.6 Cg_endo -69.79 -27.83 25.87 Favored 'Trans proline' 0 C--O 1.231 0.171 0 C-N-CA 122.72 2.28 . . . . 61.33 112.339 179.96 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 19' ' ' PRO . . . . . 0.925 ' HD2' ' N ' ' A' ' 18' ' ' PRO . 53.9 Cg_endo -69.75 -16.47 37.61 Favored 'Trans proline' 0 C--N 1.341 0.137 0 C-N-CA 122.697 2.265 . . . . 75.23 112.341 179.917 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -82.0 -19.39 40.6 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.249 -0.432 . . . . 73.44 110.866 -179.952 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -59.69 -25.7 64.98 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.168 -0.469 . . . . 74.31 110.866 -179.936 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.315 0 C-N-CA 120.718 -0.753 . . . . 53.24 112.502 -179.983 . . . . . . . . 0 0 . 1 . 022 nuclear build core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 37.7 t . . . . . 0 C--O 1.231 0.096 0 CA-C-O 120.816 0.341 . . . . 60.32 111.145 . . . . . . . . . 0 0 . 1 . 022 nuclear build core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 10.4 ttp -102.11 33.91 2.9 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.186 -0.461 . . . . 70.13 110.868 179.944 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 5.6 t -86.65 -3.94 59.11 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.224 -0.443 . . . . 71.25 111.156 -179.922 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 15' ' ' VAL . . . . . 0.678 ' C ' ' HG3' ' A' ' 19' ' ' PRO . 25.2 t -93.01 3.45 8.18 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-N 116.206 -0.452 . . . . 72.41 111.147 179.912 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 16' ' ' ILE . . . . . 0.464 ' O ' HG22 ' A' ' 16' ' ' ILE . 2.8 mp -142.35 3.61 0.41 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.161 -0.472 . . . . 73.31 111.159 179.964 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 17' ' ' SER . . . . . 0.781 ' C ' ' HD2' ' A' ' 19' ' ' PRO . 0.5 OUTLIER -99.92 -68.74 0.04 OUTLIER Pre-proline 0 C--N 1.329 -0.302 0 CA-C-O 121.673 0.749 . . . . 52.11 110.885 -179.882 . . . . . . . . 3 3 . 1 . 022 nuclear build core ' A' A ' 18' ' ' PRO . . . . . 0.929 ' N ' ' HD2' ' A' ' 19' ' ' PRO . 53.4 Cg_endo -69.85 -27.88 25.51 Favored 'Trans proline' 0 C--O 1.232 0.188 0 C-N-CA 122.681 2.254 . . . . 73.31 112.345 179.965 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 19' ' ' PRO . . . . . 0.929 ' HD2' ' N ' ' A' ' 18' ' ' PRO . 54.1 Cg_endo -69.68 -16.47 37.91 Favored 'Trans proline' 0 C--N 1.341 0.169 0 C-N-CA 122.693 2.262 . . . . 74.53 112.377 179.871 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -82.03 -19.45 40.36 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.215 -0.448 . . . . 50.01 110.907 -179.957 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -59.63 -25.74 64.92 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.182 -0.463 . . . . 72.23 110.892 -179.988 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.307 0 C-N-CA 120.75 -0.738 . . . . 65.42 112.486 -179.932 . . . . . . . . 0 0 . 1 . 023 nuclear build core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 41.9 t . . . . . 0 C--O 1.231 0.117 0 CA-C-O 120.848 0.356 . . . . 75.21 111.141 . . . . . . . . . 0 0 . 1 . 023 nuclear build core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 10.5 ttp -101.95 33.39 3.06 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.185 -0.461 . . . . 72.43 110.91 179.873 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 5.5 t -86.17 -4.02 59.08 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.214 -0.448 . . . . 65.2 111.139 -179.925 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 15' ' ' VAL . . . . . 0.665 ' C ' ' HG3' ' A' ' 19' ' ' PRO . 25.4 t -92.85 4.15 7.63 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.208 -0.451 . . . . 71.31 111.167 179.87 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 16' ' ' ILE . . . . . 0.456 ' O ' HG22 ' A' ' 16' ' ' ILE . 9.4 mt -143.33 3.32 0.35 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.18 -0.463 . . . . 71.22 111.121 179.927 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 17' ' ' SER . . . . . 0.8 ' C ' ' HD2' ' A' ' 19' ' ' PRO . 0.5 OUTLIER -99.89 -68.72 0.04 OUTLIER Pre-proline 0 C--N 1.329 -0.31 0 CA-C-O 121.624 0.726 . . . . 62.53 110.882 -179.943 . . . . . . . . 3 3 . 1 . 023 nuclear build core ' A' A ' 18' ' ' PRO . . . . . 0.93 ' N ' ' HD2' ' A' ' 19' ' ' PRO . 53.2 Cg_endo -69.8 -27.86 25.76 Favored 'Trans proline' 0 C--O 1.232 0.178 0 C-N-CA 122.681 2.254 . . . . 75.15 112.32 -179.996 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 19' ' ' PRO . . . . . 0.93 ' HD2' ' N ' ' A' ' 18' ' ' PRO . 54.1 Cg_endo -69.73 -16.49 37.71 Favored 'Trans proline' 0 C--N 1.342 0.203 0 C-N-CA 122.732 2.288 . . . . 40.33 112.346 179.964 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -81.87 -19.92 39.94 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.195 -0.457 . . . . 55.32 110.902 -179.97 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -58.52 -33.37 69.77 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.129 -0.487 . . . . 63.43 110.871 -179.913 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.337 0 C-N-CA 120.782 -0.723 . . . . 72.22 112.49 -179.943 . . . . . . . . 0 0 . 1 . 024 nuclear build core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 38.4 t . . . . . 0 C--O 1.231 0.106 0 CA-C-O 120.852 0.358 . . . . 63.33 111.163 . . . . . . . . . 0 0 . 1 . 024 nuclear build core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 10.4 ttp -102.0 33.84 2.9 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.18 -0.464 . . . . 74.34 110.861 179.902 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 5.8 t -86.52 -3.89 59.09 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.225 -0.443 . . . . 73.12 111.211 -179.986 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 15' ' ' VAL . . . . . 0.675 ' C ' ' HG3' ' A' ' 19' ' ' PRO . 24.1 t -93.85 4.04 8.24 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.183 -0.462 . . . . 70.12 111.1 179.933 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 16' ' ' ILE . . . . . 0.46 ' O ' HG22 ' A' ' 16' ' ' ILE . 2.8 mp -142.52 3.43 0.4 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-N 116.168 -0.469 . . . . 75.22 111.153 179.94 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 17' ' ' SER . . . . . 0.791 ' C ' ' HD2' ' A' ' 19' ' ' PRO . 0.5 OUTLIER -100.19 -68.42 0.04 OUTLIER Pre-proline 0 C--N 1.329 -0.307 0 CA-C-O 121.615 0.721 . . . . 53.4 110.85 -179.951 . . . . . . . . 3 3 . 1 . 024 nuclear build core ' A' A ' 18' ' ' PRO . . . . . 0.919 ' N ' ' HD2' ' A' ' 19' ' ' PRO . 53.9 Cg_endo -69.77 -27.81 25.97 Favored 'Trans proline' 0 C--O 1.232 0.19 0 C-N-CA 122.624 2.216 . . . . 45.0 112.352 179.975 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 19' ' ' PRO . . . . . 0.919 ' HD2' ' N ' ' A' ' 18' ' ' PRO . 53.8 Cg_endo -69.77 -16.49 37.54 Favored 'Trans proline' 0 C--N 1.341 0.166 0 C-N-CA 122.714 2.276 . . . . 71.31 112.334 179.975 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -81.88 -19.9 39.97 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.203 -0.453 . . . . 70.43 110.889 -179.987 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -58.67 -34.71 71.54 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.168 -0.469 . . . . 74.05 110.855 -179.875 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.302 0 C-N-CA 120.696 -0.764 . . . . 62.42 112.485 179.984 . . . . . . . . 0 0 . 1 . 025 nuclear build core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 36.1 t . . . . . 0 C--O 1.231 0.114 0 CA-C-O 120.804 0.335 . . . . 72.33 111.128 . . . . . . . . . 0 0 . 1 . 025 nuclear build core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 10.5 ttp -102.46 33.89 2.98 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.187 -0.461 . . . . 64.11 110.862 179.916 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 5.6 t -86.68 -3.97 59.11 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.262 -0.426 . . . . 73.34 111.145 -179.925 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 15' ' ' VAL . . . . . 0.685 ' C ' ' HG3' ' A' ' 19' ' ' PRO . 25.1 t -93.03 3.47 8.18 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-N 116.221 -0.445 . . . . 75.31 111.122 179.895 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 16' ' ' ILE . . . . . 0.463 ' O ' HG22 ' A' ' 16' ' ' ILE . 2.8 mp -142.36 3.72 0.41 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.184 -0.462 . . . . 72.32 111.132 179.865 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 17' ' ' SER . . . . . 0.801 ' C ' ' HD2' ' A' ' 19' ' ' PRO . 0.5 OUTLIER -99.93 -68.82 0.04 OUTLIER Pre-proline 0 C--N 1.329 -0.294 0 CA-C-O 121.697 0.761 . . . . 73.45 110.83 -179.897 . . . . . . . . 3 3 . 1 . 025 nuclear build core ' A' A ' 18' ' ' PRO . . . . . 0.924 ' N ' ' HD2' ' A' ' 19' ' ' PRO . 54.2 Cg_endo -69.7 -27.94 26.14 Favored 'Trans proline' 0 C--O 1.232 0.181 0 C-N-CA 122.7 2.267 . . . . 73.14 112.358 179.954 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 19' ' ' PRO . . . . . 0.924 ' HD2' ' N ' ' A' ' 18' ' ' PRO . 53.5 Cg_endo -69.77 -16.43 37.51 Favored 'Trans proline' 0 C--N 1.342 0.213 0 C-N-CA 122.664 2.243 . . . . 73.21 112.38 179.961 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -81.93 -19.86 39.87 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.171 -0.468 . . . . 74.13 110.911 179.977 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -58.6 -33.16 69.68 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.131 -0.486 . . . . 74.34 110.876 -179.92 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.279 0 C-N-CA 120.74 -0.743 . . . . 72.12 112.46 -179.947 . . . . . . . . 0 0 . 1 . 026 nuclear build core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 61.5 t . . . . . 0 C--O 1.231 0.113 0 CA-C-O 120.84 0.352 . . . . 73.4 111.115 . . . . . . . . . 0 0 . 1 . 026 nuclear build core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 10.6 ttp -102.06 33.4 3.07 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.152 -0.476 . . . . 72.44 110.862 179.932 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 5.6 t -86.17 -3.99 59.08 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.23 -0.441 . . . . 71.42 111.148 -179.937 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 15' ' ' VAL . . . . . 0.666 ' C ' ' HG3' ' A' ' 19' ' ' PRO . 25.3 t -92.89 4.12 7.68 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-N 116.221 -0.445 . . . . 63.42 111.158 179.853 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 16' ' ' ILE . . . . . 0.454 ' O ' HG22 ' A' ' 16' ' ' ILE . 9.6 mt -143.29 3.34 0.35 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.206 -0.452 . . . . 74.11 111.153 179.898 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 17' ' ' SER . . . . . 0.79 ' C ' ' HD2' ' A' ' 19' ' ' PRO . 0.5 OUTLIER -99.82 -68.77 0.04 OUTLIER Pre-proline 0 C--N 1.33 -0.277 0 CA-C-O 121.694 0.759 . . . . 72.3 110.849 -179.929 . . . . . . . . 3 3 . 1 . 026 nuclear build core ' A' A ' 18' ' ' PRO . . . . . 0.909 ' N ' ' HD2' ' A' ' 19' ' ' PRO . 53.7 Cg_endo -69.77 -27.93 25.82 Favored 'Trans proline' 0 C--N 1.342 0.185 0 C-N-CA 122.66 2.24 . . . . 55.44 112.337 -179.992 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 19' ' ' PRO . . . . . 0.909 ' HD2' ' N ' ' A' ' 18' ' ' PRO . 54.1 Cg_endo -69.75 -16.8 37.77 Favored 'Trans proline' 0 C--N 1.341 0.184 0 C-N-CA 122.643 2.229 . . . . 74.52 112.354 179.937 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 21.3 tt0 -82.5 -21.29 35.53 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.222 -0.445 . . . . 72.5 110.903 179.981 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -58.27 -33.21 69.17 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.201 -0.454 . . . . 74.55 110.854 -179.913 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.317 0 C-N-CA 120.693 -0.765 . . . . 72.22 112.527 -179.953 . . . . . . . . 0 0 . 1 . 027 nuclear build core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 58.8 t . . . . . 0 N--CA 1.458 -0.058 0 CA-C-O 120.828 0.347 . . . . 75.32 111.139 . . . . . . . . . 0 0 . 1 . 027 nuclear build core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 9.4 ttp -102.26 32.83 3.34 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.162 -0.472 . . . . 64.43 110.851 179.927 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 5.9 t -86.82 -3.74 59.1 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.212 -0.449 . . . . 64.32 111.149 -179.974 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 15' ' ' VAL . . . . . 0.683 ' C ' ' HG3' ' A' ' 19' ' ' PRO . 23.0 t -94.26 4.65 8.09 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.228 -0.442 . . . . 63.33 111.12 179.867 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 16' ' ' ILE . . . . . 0.452 ' O ' HG22 ' A' ' 16' ' ' ILE . 2.8 mp -142.54 3.36 0.4 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.326 0 CA-C-N 116.173 -0.467 . . . . 74.24 111.122 179.894 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 17' ' ' SER . . . . . 0.799 ' C ' ' HD2' ' A' ' 19' ' ' PRO . 0.5 OUTLIER -100.32 -68.38 0.04 OUTLIER Pre-proline 0 C--N 1.329 -0.323 0 CA-C-O 121.739 0.78 . . . . 73.22 110.836 -179.911 . . . . . . . . 3 3 . 1 . 027 nuclear build core ' A' A ' 18' ' ' PRO . . . . . 0.916 ' N ' ' HD2' ' A' ' 19' ' ' PRO . 54.2 Cg_endo -69.69 -27.87 26.29 Favored 'Trans proline' 0 C--N 1.342 0.214 0 C-N-CA 122.686 2.258 . . . . 62.35 112.349 179.989 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 19' ' ' PRO . . . . . 0.916 ' HD2' ' N ' ' A' ' 18' ' ' PRO . 53.7 Cg_endo -69.79 -16.47 37.46 Favored 'Trans proline' 0 C--N 1.342 0.192 0 C-N-CA 122.637 2.225 . . . . 71.31 112.341 179.989 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -81.87 -19.88 40.01 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.22 -0.446 . . . . 75.54 110.903 -179.994 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -58.66 -34.05 70.79 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.185 -0.461 . . . . 74.52 110.868 -179.947 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.303 0 C-N-CA 120.724 -0.751 . . . . 74.23 112.503 -179.977 . . . . . . . . 0 0 . 1 . 028 nuclear build core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 23.7 t . . . . . 0 C--O 1.23 0.067 0 CA-C-O 120.851 0.358 . . . . 70.04 111.16 . . . . . . . . . 0 0 . 1 . 028 nuclear build core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 10.6 ttp -101.86 33.4 3.03 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.154 -0.475 . . . . 44.21 110.851 179.968 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 5.5 t -86.18 -4.0 59.08 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.217 -0.447 . . . . 72.21 111.106 -179.923 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 15' ' ' VAL . . . . . 0.668 ' C ' ' HG3' ' A' ' 19' ' ' PRO . 25.3 t -92.93 4.15 7.68 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.24 -0.436 . . . . 72.54 111.132 179.911 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 16' ' ' ILE . . . . . 0.455 ' O ' HG22 ' A' ' 16' ' ' ILE . 9.4 mt -143.32 3.39 0.35 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.215 -0.448 . . . . 75.31 111.141 179.888 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 17' ' ' SER . . . . . 0.799 ' C ' ' HD2' ' A' ' 19' ' ' PRO . 0.5 OUTLIER -99.86 -68.8 0.04 OUTLIER Pre-proline 0 C--N 1.329 -0.301 0 CA-C-O 121.686 0.755 . . . . 65.22 110.863 -179.941 . . . . . . . . 3 3 . 1 . 028 nuclear build core ' A' A ' 18' ' ' PRO . . . . . 0.913 ' N ' ' HD2' ' A' ' 19' ' ' PRO . 54.2 Cg_endo -69.73 -27.89 26.05 Favored 'Trans proline' 0 C--N 1.342 0.203 0 C-N-CA 122.702 2.268 . . . . 73.3 112.361 179.953 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 19' ' ' PRO . . . . . 0.913 ' HD2' ' N ' ' A' ' 18' ' ' PRO . 53.7 Cg_endo -69.8 -16.75 37.52 Favored 'Trans proline' 0 C--N 1.341 0.171 0 C-N-CA 122.64 2.227 . . . . 54.03 112.312 179.956 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 15.1 tp10 -82.51 -21.35 35.49 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.264 -0.425 . . . . 70.22 110.883 -179.986 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -58.14 -34.48 70.31 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.139 -0.482 . . . . 62.43 110.876 -179.903 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.348 0 C-N-CA 120.722 -0.751 . . . . 73.43 112.529 -179.932 . . . . . . . . 0 0 . 1 . 029 nuclear build core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 21.8 t . . . . . 0 C--O 1.231 0.097 0 CA-C-O 120.85 0.357 . . . . 75.3 111.131 . . . . . . . . . 0 0 . 1 . 029 nuclear build core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 10.4 ttp -101.29 33.82 2.77 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.141 -0.481 . . . . 71.14 110.907 179.927 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 5.6 t -86.67 -3.91 59.1 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.21 -0.45 . . . . 74.55 111.167 -179.897 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 15' ' ' VAL . . . . . 0.685 ' C ' ' HG3' ' A' ' 19' ' ' PRO . 25.0 t -93.07 3.49 8.19 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-N 116.149 -0.478 . . . . 54.35 111.114 179.932 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 16' ' ' ILE . . . . . 0.447 ' O ' HG22 ' A' ' 16' ' ' ILE . 2.8 mp -142.34 3.63 0.41 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.212 -0.449 . . . . 71.23 111.155 179.924 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 17' ' ' SER . . . . . 0.786 ' C ' ' HD2' ' A' ' 19' ' ' PRO . 0.5 OUTLIER -99.89 -68.77 0.04 OUTLIER Pre-proline 0 C--N 1.329 -0.319 0 CA-C-O 121.674 0.75 . . . . 72.21 110.844 -179.879 . . . . . . . . 3 3 . 1 . 029 nuclear build core ' A' A ' 18' ' ' PRO . . . . . 0.912 ' N ' ' HD2' ' A' ' 19' ' ' PRO . 53.5 Cg_endo -69.83 -27.9 25.58 Favored 'Trans proline' 0 C--N 1.342 0.191 0 C-N-CA 122.645 2.23 . . . . 55.45 112.325 -179.982 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 19' ' ' PRO . . . . . 0.912 ' HD2' ' N ' ' A' ' 18' ' ' PRO . 54.2 Cg_endo -69.74 -16.81 37.81 Favored 'Trans proline' 0 C--N 1.342 0.195 0 C-N-CA 122.72 2.28 . . . . 72.43 112.346 179.903 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 25.6 tt0 -82.59 -21.24 35.28 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.205 -0.452 . . . . 74.13 110.867 -179.94 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -58.1 -32.86 68.49 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.154 -0.476 . . . . 74.12 110.872 -179.913 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.303 0 C-N-CA 120.72 -0.752 . . . . 70.21 112.462 179.978 . . . . . . . . 0 0 . 1 . 030 nuclear build core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 57.7 t . . . . . 0 C--O 1.231 0.092 0 CA-C-O 120.8 0.333 . . . . 60.11 111.115 . . . . . . . . . 0 0 . 1 . 030 nuclear build core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 10.6 ttp -101.97 33.38 3.06 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.182 -0.463 . . . . 72.32 110.83 179.962 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 5.5 t -86.18 -4.0 59.08 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.261 -0.427 . . . . 64.33 111.139 -179.941 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 15' ' ' VAL . . . . . 0.678 ' C ' ' HG3' ' A' ' 19' ' ' PRO . 25.4 t -92.95 4.18 7.67 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.22 -0.446 . . . . 73.44 111.134 179.904 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 16' ' ' ILE . . . . . 0.459 ' O ' HG22 ' A' ' 16' ' ' ILE . 9.5 mt -143.3 3.31 0.35 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.186 -0.461 . . . . 72.01 111.164 179.926 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 17' ' ' SER . . . . . 0.809 ' C ' ' HD2' ' A' ' 19' ' ' PRO . 0.5 OUTLIER -99.9 -68.73 0.04 OUTLIER Pre-proline 0 C--N 1.33 -0.278 0 CA-C-O 121.612 0.72 . . . . 61.45 110.866 -179.919 . . . . . . . . 3 3 . 1 . 030 nuclear build core ' A' A ' 18' ' ' PRO . . . . . 0.913 ' N ' ' HD2' ' A' ' 19' ' ' PRO . 53.5 Cg_endo -69.75 -27.97 25.88 Favored 'Trans proline' 0 C--N 1.341 0.157 0 C-N-CA 122.721 2.281 . . . . 44.24 112.32 179.988 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 19' ' ' PRO . . . . . 0.913 ' HD2' ' N ' ' A' ' 18' ' ' PRO . 53.8 Cg_endo -69.72 -16.75 37.87 Favored 'Trans proline' 0 C--N 1.342 0.201 0 C-N-CA 122.684 2.256 . . . . 64.43 112.389 179.935 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 57.6 tt0 -82.53 -21.34 35.43 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.197 -0.456 . . . . 72.54 110.936 179.988 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -58.17 -34.42 70.29 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.103 -0.499 . . . . 73.32 110.926 -179.934 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.342 0 C-N-CA 120.727 -0.749 . . . . 73.2 112.478 179.988 . . . . . . . . 0 0 . 1 . 031 nuclear build core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 60.6 t . . . . . 0 C--O 1.231 0.102 0 CA-C-O 120.866 0.365 . . . . 65.51 111.118 . . . . . . . . . 0 0 . 1 . 031 nuclear build core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 10.6 ttp -101.97 33.38 3.06 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.182 -0.463 . . . . 72.33 110.876 179.929 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 5.5 t -86.11 -4.03 59.08 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.215 -0.448 . . . . 73.42 111.137 -179.921 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 15' ' ' VAL . . . . . 0.675 ' C ' ' HG3' ' A' ' 19' ' ' PRO . 25.4 t -92.91 4.14 7.68 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.183 -0.462 . . . . 74.02 111.122 179.937 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 16' ' ' ILE . . . . . 0.456 ' O ' HG22 ' A' ' 16' ' ' ILE . 9.5 mt -143.28 3.34 0.35 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.178 -0.465 . . . . 72.13 111.169 179.911 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 17' ' ' SER . . . . . 0.792 ' C ' ' HD2' ' A' ' 19' ' ' PRO . 0.5 OUTLIER -99.86 -68.81 0.04 OUTLIER Pre-proline 0 C--N 1.329 -0.297 0 CA-C-O 121.696 0.76 . . . . 63.43 110.895 -179.92 . . . . . . . . 3 3 . 1 . 031 nuclear build core ' A' A ' 18' ' ' PRO . . . . . 0.919 ' N ' ' HD2' ' A' ' 19' ' ' PRO . 54.0 Cg_endo -69.75 -27.88 25.99 Favored 'Trans proline' 0 C--N 1.342 0.213 0 C-N-CA 122.684 2.256 . . . . 75.1 112.329 179.971 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 19' ' ' PRO . . . . . 0.919 ' HD2' ' N ' ' A' ' 18' ' ' PRO . 53.9 Cg_endo -69.72 -16.49 37.73 Favored 'Trans proline' 0 C--N 1.341 0.153 0 C-N-CA 122.69 2.26 . . . . 73.02 112.315 179.966 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -81.92 -19.44 40.77 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.261 -0.427 . . . . 72.11 110.909 -179.966 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -59.7 -25.74 65.02 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.13 -0.486 . . . . 74.31 110.852 -179.902 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.325 0 C-N-CA 120.699 -0.762 . . . . 54.41 112.51 -179.993 . . . . . . . . 0 0 . 1 . 032 nuclear build core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 58.3 t . . . . . 0 C--O 1.231 0.083 0 CA-C-O 120.822 0.344 . . . . 75.02 111.109 . . . . . . . . . 0 0 . 1 . 032 nuclear build core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 10.4 ttp -102.49 33.9 2.98 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.181 -0.463 . . . . 72.23 110.895 179.954 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 5.6 t -86.65 -3.96 59.11 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.199 -0.455 . . . . 51.14 111.182 -179.973 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 15' ' ' VAL . . . . . 0.685 ' C ' ' HG3' ' A' ' 19' ' ' PRO . 24.9 t -93.0 3.49 8.15 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.203 -0.453 . . . . 72.3 111.129 179.879 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' A' A ' 16' ' ' ILE . . . . . 0.465 ' O ' HG22 ' A' ' 16' ' ' ILE . 2.8 mp -142.38 3.61 0.41 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.19 -0.459 . . . . 72.25 111.146 179.918 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' A' A ' 17' ' ' SER . . . . . 0.797 ' C ' ' HD2' ' A' ' 19' ' ' PRO . 0.5 OUTLIER -99.85 -68.79 0.04 OUTLIER Pre-proline 0 C--N 1.329 -0.284 0 CA-C-O 121.674 0.75 . . . . 74.53 110.868 -179.94 . . . . . . . . 3 3 . 1 . 032 nuclear build core ' A' A ' 18' ' ' PRO . . . . . 0.924 ' N ' ' HD2' ' A' ' 19' ' ' PRO . 53.7 Cg_endo -69.73 -27.99 25.94 Favored 'Trans proline' 0 C--O 1.231 0.171 0 C-N-CA 122.718 2.278 . . . . 74.34 112.313 179.994 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' A' A ' 19' ' ' PRO . . . . . 0.924 ' HD2' ' N ' ' A' ' 18' ' ' PRO . 53.9 Cg_endo -69.74 -16.71 37.77 Favored 'Trans proline' 0 C--N 1.341 0.179 0 C-N-CA 122.669 2.246 . . . . 75.42 112.359 179.939 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 17.6 tp10 -82.61 -21.36 35.16 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.252 -0.431 . . . . 75.41 110.875 -179.978 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -58.14 -34.11 69.91 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.167 -0.469 . . . . 74.25 110.864 -179.894 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.291 0 C-N-CA 120.719 -0.753 . . . . 63.41 112.485 -179.993 . . . . . . . . 0 0 . 1 . 033 nuclear build core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 93.6 t . . . . . 0 N--CA 1.458 -0.069 0 CA-C-O 120.868 0.366 . . . . 52.23 111.146 . . . . . . . . . 0 0 . 1 . 033 nuclear build core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 2.8 ttp -113.61 -2.45 13.8 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.159 -0.473 . . . . 42.43 110.886 179.922 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 14' ' ' THR . . . . . 0.486 HG22 ' O ' ' A' ' 14' ' ' THR . 25.7 m -76.55 -4.92 45.32 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.211 -0.449 . . . . 74.13 111.135 -179.967 . . . . . . . . 2 2 . 1 . 033 nuclear build core ' A' A ' 15' ' ' VAL . . . . . 0.684 ' C ' ' HG3' ' A' ' 19' ' ' PRO . 23.5 t -97.88 10.97 5.93 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.269 -0.423 . . . . 54.32 111.176 179.861 . . . . . . . . 2 2 . 1 . 033 nuclear build core ' A' A ' 16' ' ' ILE . . . . . 0.462 HG22 ' O ' ' A' ' 16' ' ' ILE . 3.0 mp -142.37 2.56 0.41 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.189 -0.46 . . . . 64.45 111.14 179.924 . . . . . . . . 2 2 . 1 . 033 nuclear build core ' A' A ' 17' ' ' SER . . . . . 0.798 ' C ' ' HD2' ' A' ' 19' ' ' PRO . 0.6 OUTLIER -101.74 -66.2 0.05 OUTLIER Pre-proline 0 C--N 1.33 -0.273 0 CA-C-O 121.622 0.725 . . . . 72.22 110.88 -179.935 . . . . . . . . 3 3 . 1 . 033 nuclear build core ' A' A ' 18' ' ' PRO . . . . . 0.92 ' N ' ' HD2' ' A' ' 19' ' ' PRO . 53.7 Cg_endo -69.8 -27.66 26.02 Favored 'Trans proline' 0 C--N 1.342 0.189 0 C-N-CA 122.664 2.243 . . . . 63.12 112.374 179.953 . . . . . . . . 2 2 . 1 . 033 nuclear build core ' A' A ' 19' ' ' PRO . . . . . 0.92 ' HD2' ' N ' ' A' ' 18' ' ' PRO . 53.2 Cg_endo -69.81 -16.2 37.25 Favored 'Trans proline' 0 C--N 1.341 0.145 0 C-N-CA 122.664 2.243 . . . . 73.31 112.329 179.946 . . . . . . . . 2 2 . 1 . 033 nuclear build core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 5.8 tm-20 -83.02 -21.25 33.9 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.2 -0.455 . . . . 74.22 110.855 -179.968 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -57.55 -32.78 67.44 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.166 -0.47 . . . . 75.02 110.896 -179.932 . . . . . . . . 2 2 . 1 . 033 nuclear build core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.366 0 C-N-CA 120.754 -0.736 . . . . 33.43 112.508 -179.95 . . . . . . . . 0 0 . 1 . 034 nuclear build core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 55.7 t . . . . . 0 N--CA 1.458 -0.051 0 CA-C-O 120.835 0.35 . . . . 45.15 111.091 . . . . . . . . . 0 0 . 1 . 034 nuclear build core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 10.1 ttp -105.76 6.26 31.63 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.144 -0.48 . . . . 44.43 110.913 179.92 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 6.0 t -70.18 -6.34 33.68 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.221 -0.445 . . . . 53.41 111.104 -179.922 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 15' ' ' VAL . . . . . 0.663 HG12 ' O ' ' A' ' 15' ' ' VAL . 40.3 t -96.27 9.83 5.85 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.242 -0.436 . . . . 64.52 111.177 179.922 . . . . . . . . 2 2 . 1 . 034 nuclear build core ' A' A ' 16' ' ' ILE . . . . . 0.457 ' O ' HG22 ' A' ' 16' ' ' ILE . 10.6 mt -143.96 2.11 0.3 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.092 -0.504 . . . . 71.43 111.102 179.963 . . . . . . . . 2 2 . 1 . 034 nuclear build core ' A' A ' 17' ' ' SER . . . . . 0.815 ' C ' ' HD2' ' A' ' 19' ' ' PRO . 0.0 OUTLIER -99.74 -65.89 0.06 OUTLIER Pre-proline 0 C--N 1.329 -0.288 0 CA-C-O 121.65 0.738 . . . . 73.12 110.818 -179.898 . . . . . . . . 3 3 . 1 . 034 nuclear build core ' A' A ' 18' ' ' PRO . . . . . 0.922 ' N ' ' HD2' ' A' ' 19' ' ' PRO . 53.7 Cg_endo -69.77 -27.38 26.5 Favored 'Trans proline' 0 C--O 1.231 0.156 0 C-N-CA 122.649 2.232 . . . . 74.21 112.331 -179.976 . . . . . . . . 2 2 . 1 . 034 nuclear build core ' A' A ' 19' ' ' PRO . . . . . 0.922 ' HD2' ' N ' ' A' ' 18' ' ' PRO . 53.6 Cg_endo -69.74 -16.98 37.91 Favored 'Trans proline' 0 C--N 1.341 0.177 0 C-N-CA 122.651 2.234 . . . . 51.14 112.336 179.952 . . . . . . . . 2 2 . 1 . 034 nuclear build core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 1.9 mt-10 -82.79 -19.99 36.66 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.228 -0.442 . . . . 73.3 110.879 -179.967 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -58.59 -33.35 69.88 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.21 -0.45 . . . . 73.51 110.894 -179.945 . . . . . . . . 2 2 . 1 . 034 nuclear build core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.302 0 C-N-CA 120.7 -0.762 . . . . 54.23 112.461 179.998 . . . . . . . . 0 0 . 1 . 035 nuclear build core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 50.8 t . . . . . 0 C--O 1.231 0.097 0 CA-C-O 120.864 0.364 . . . . 73.04 111.159 . . . . . . . . . 0 0 . 1 . 035 nuclear build core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 10.4 ttp -102.3 33.93 2.93 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.191 -0.459 . . . . 73.14 110.884 179.884 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 5.6 t -86.74 -3.92 59.11 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.212 -0.449 . . . . 71.23 111.138 -179.92 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 15' ' ' VAL . . . . . 0.687 ' C ' ' HG3' ' A' ' 19' ' ' PRO . 25.1 t -93.04 3.45 8.2 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.222 -0.445 . . . . 71.32 111.125 179.895 . . . . . . . . 2 2 . 1 . 035 nuclear build core ' A' A ' 16' ' ' ILE . . . . . 0.462 ' O ' HG22 ' A' ' 16' ' ' ILE . 2.8 mp -142.33 3.6 0.41 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.144 -0.48 . . . . 53.34 111.156 179.949 . . . . . . . . 2 2 . 1 . 035 nuclear build core ' A' A ' 17' ' ' SER . . . . . 0.79 ' C ' ' HD2' ' A' ' 19' ' ' PRO . 0.5 OUTLIER -99.86 -68.78 0.04 OUTLIER Pre-proline 0 C--N 1.33 -0.271 0 CA-C-O 121.671 0.748 . . . . 75.04 110.855 -179.879 . . . . . . . . 3 3 . 1 . 035 nuclear build core ' A' A ' 18' ' ' PRO . . . . . 0.911 ' N ' ' HD2' ' A' ' 19' ' ' PRO . 53.6 Cg_endo -69.77 -27.99 25.74 Favored 'Trans proline' 0 C--N 1.341 0.172 0 C-N-CA 122.651 2.234 . . . . 53.55 112.323 179.981 . . . . . . . . 2 2 . 1 . 035 nuclear build core ' A' A ' 19' ' ' PRO . . . . . 0.911 ' HD2' ' N ' ' A' ' 18' ' ' PRO . 54.1 Cg_endo -69.7 -16.76 37.97 Favored 'Trans proline' 0 C--N 1.341 0.149 0 C-N-CA 122.702 2.268 . . . . 72.34 112.366 179.942 . . . . . . . . 2 2 . 1 . 035 nuclear build core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 28.4 tt0 -82.64 -21.24 35.13 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.191 -0.459 . . . . 73.33 110.888 -179.975 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -59.13 -25.39 63.82 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.113 -0.494 . . . . 63.41 110.875 -179.878 . . . . . . . . 2 2 . 1 . 035 nuclear build core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.339 0 C-N-CA 120.746 -0.74 . . . . 75.23 112.516 -179.987 . . . . . . . . 0 0 . 1 . 036 nuclear build core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 47.8 t . . . . . 0 N--CA 1.457 -0.083 0 CA-C-O 120.857 0.36 . . . . 73.45 111.147 . . . . . . . . . 0 0 . 1 . 036 nuclear build core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 9.0 ttp -105.58 2.98 28.77 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.134 -0.485 . . . . 54.15 110.852 179.918 . . . . . . . . 1 1 . 1 . 036 nuclear build core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 5.6 t -70.28 -5.93 31.3 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.272 -0.422 . . . . 75.34 111.162 -179.98 . . . . . . . . 1 1 . 1 . 036 nuclear build core ' A' A ' 15' ' ' VAL . . . . . 0.655 HG12 ' O ' ' A' ' 15' ' ' VAL . 40.0 t -96.18 9.84 5.79 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.229 -0.442 . . . . 71.32 111.171 179.872 . . . . . . . . 2 2 . 1 . 036 nuclear build core ' A' A ' 16' ' ' ILE . . . . . 0.449 ' O ' HG22 ' A' ' 16' ' ' ILE . 10.4 mt -143.86 2.05 0.31 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.176 -0.466 . . . . 70.33 111.16 179.945 . . . . . . . . 2 2 . 1 . 036 nuclear build core ' A' A ' 17' ' ' SER . . . . . 0.815 ' C ' ' HD2' ' A' ' 19' ' ' PRO . 0.0 OUTLIER -99.73 -65.79 0.06 OUTLIER Pre-proline 0 C--N 1.33 -0.252 0 CA-C-O 121.673 0.749 . . . . 61.52 110.864 -179.922 . . . . . . . . 3 3 . 1 . 036 nuclear build core ' A' A ' 18' ' ' PRO . . . . . 0.911 ' N ' ' HD2' ' A' ' 19' ' ' PRO . 53.6 Cg_endo -69.74 -27.4 26.61 Favored 'Trans proline' 0 C--N 1.341 0.175 0 C-N-CA 122.713 2.276 . . . . 62.33 112.36 179.978 . . . . . . . . 2 2 . 1 . 036 nuclear build core ' A' A ' 19' ' ' PRO . . . . . 0.911 ' HD2' ' N ' ' A' ' 18' ' ' PRO . 53.5 Cg_endo -69.82 -16.95 37.55 Favored 'Trans proline' 0 C--N 1.342 0.217 0 C-N-CA 122.673 2.249 . . . . 71.34 112.318 179.981 . . . . . . . . 2 2 . 1 . 036 nuclear build core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 1.2 mt-10 -82.81 -20.23 36.15 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.232 -0.44 . . . . 74.32 110.836 -179.969 . . . . . . . . 1 1 . 1 . 036 nuclear build core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -58.41 -32.8 68.98 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.188 -0.46 . . . . 75.42 110.903 -179.91 . . . . . . . . 2 2 . 1 . 036 nuclear build core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.288 0 C-N-CA 120.735 -0.745 . . . . 63.23 112.475 -179.999 . . . . . . . . 0 0 . 1 . 037 nuclear build core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 39.7 t . . . . . 0 N--CA 1.457 -0.089 0 CA-C-O 120.831 0.348 . . . . 73.12 111.159 . . . . . . . . . 0 0 . 1 . 037 nuclear build core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 9.7 ttp -104.36 6.37 35.11 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.138 -0.483 . . . . 64.23 110.872 179.9 . . . . . . . . 1 1 . 1 . 037 nuclear build core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 5.8 t -70.04 -6.34 32.92 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.257 -0.429 . . . . 61.12 111.183 -179.955 . . . . . . . . 1 1 . 1 . 037 nuclear build core ' A' A ' 15' ' ' VAL . . . . . 0.647 HG12 ' O ' ' A' ' 15' ' ' VAL . 40.7 t -96.28 9.87 5.83 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.207 -0.451 . . . . 74.4 111.137 179.907 . . . . . . . . 2 2 . 1 . 037 nuclear build core ' A' A ' 16' ' ' ILE . . . . . 0.447 ' O ' HG22 ' A' ' 16' ' ' ILE . 10.8 mt -143.96 1.98 0.3 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.193 -0.458 . . . . 75.41 111.132 179.942 . . . . . . . . 2 2 . 1 . 037 nuclear build core ' A' A ' 17' ' ' SER . . . . . 0.812 ' C ' ' HD2' ' A' ' 19' ' ' PRO . 0.0 OUTLIER -99.66 -65.88 0.06 OUTLIER Pre-proline 0 C--N 1.329 -0.307 0 CA-C-O 121.707 0.765 . . . . 65.11 110.863 -179.895 . . . . . . . . 3 3 . 1 . 037 nuclear build core ' A' A ' 18' ' ' PRO . . . . . 0.91 ' N ' ' HD2' ' A' ' 19' ' ' PRO . 53.8 Cg_endo -69.77 -27.42 26.43 Favored 'Trans proline' 0 C--N 1.342 0.205 0 C-N-CA 122.739 2.292 . . . . 75.52 112.321 179.999 . . . . . . . . 2 2 . 1 . 037 nuclear build core ' A' A ' 19' ' ' PRO . . . . . 0.91 ' HD2' ' N ' ' A' ' 18' ' ' PRO . 54.1 Cg_endo -69.74 -17.02 37.9 Favored 'Trans proline' 0 C--N 1.341 0.176 0 C-N-CA 122.657 2.238 . . . . 75.34 112.392 179.922 . . . . . . . . 2 2 . 1 . 037 nuclear build core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 1.3 mt-10 -82.73 -19.88 37.07 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.208 -0.451 . . . . 74.24 110.92 179.989 . . . . . . . . 1 1 . 1 . 037 nuclear build core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -58.62 -33.72 70.35 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.111 -0.495 . . . . 73.44 110.903 -179.943 . . . . . . . . 2 2 . 1 . 037 nuclear build core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.309 0 C-N-CA 120.715 -0.755 . . . . 64.32 112.469 -179.953 . . . . . . . . 0 0 . 1 . 038 nuclear build core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 46.3 t . . . . . 0 C--O 1.232 0.132 0 CA-C-O 120.83 0.347 . . . . 72.51 111.109 . . . . . . . . . 0 0 . 1 . 038 nuclear build core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 9.7 ttp -105.4 6.37 32.5 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.229 -0.442 . . . . 72.44 110.876 179.939 . . . . . . . . 1 1 . 1 . 038 nuclear build core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 6.0 t -70.02 -6.32 32.68 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.186 -0.461 . . . . 55.54 111.177 -179.981 . . . . . . . . 1 1 . 1 . 038 nuclear build core ' A' A ' 15' ' ' VAL . . . . . 0.662 HG12 ' O ' ' A' ' 15' ' ' VAL . 40.5 t -96.33 9.94 5.81 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.195 -0.457 . . . . 51.2 111.127 179.93 . . . . . . . . 2 2 . 1 . 038 nuclear build core ' A' A ' 16' ' ' ILE . . . . . 0.449 ' O ' HG22 ' A' ' 16' ' ' ILE . 10.6 mt -143.96 1.96 0.3 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.159 -0.473 . . . . 73.22 111.117 179.952 . . . . . . . . 2 2 . 1 . 038 nuclear build core ' A' A ' 17' ' ' SER . . . . . 0.817 ' C ' ' HD2' ' A' ' 19' ' ' PRO . 0.0 OUTLIER -99.64 -65.88 0.06 OUTLIER Pre-proline 0 C--N 1.329 -0.301 0 CA-C-O 121.688 0.756 . . . . 63.42 110.859 -179.934 . . . . . . . . 3 3 . 1 . 038 nuclear build core ' A' A ' 18' ' ' PRO . . . . . 0.923 ' N ' ' HD2' ' A' ' 19' ' ' PRO . 53.7 Cg_endo -69.73 -27.41 26.67 Favored 'Trans proline' 0 C--N 1.342 0.199 0 C-N-CA 122.691 2.261 . . . . 75.24 112.324 -179.999 . . . . . . . . 2 2 . 1 . 038 nuclear build core ' A' A ' 19' ' ' PRO . . . . . 0.923 ' HD2' ' N ' ' A' ' 18' ' ' PRO . 53.4 Cg_endo -69.82 -17.34 37.36 Favored 'Trans proline' 0 C--N 1.342 0.191 0 C-N-CA 122.691 2.26 . . . . 71.31 112.348 179.979 . . . . . . . . 2 2 . 1 . 038 nuclear build core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 6.2 tm-20 -83.06 -20.74 34.39 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.204 -0.453 . . . . 43.15 110.898 179.993 . . . . . . . . 1 1 . 1 . 038 nuclear build core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -58.64 -32.63 69.23 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.151 -0.477 . . . . 74.12 110.888 -179.916 . . . . . . . . 2 2 . 1 . 038 nuclear build core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.321 0 C-N-CA 120.761 -0.733 . . . . 52.31 112.506 -179.99 . . . . . . . . 0 0 . 1 . 039 nuclear build core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 59.0 t . . . . . 0 C--O 1.23 0.055 0 CA-C-O 120.829 0.347 . . . . 61.23 111.12 . . . . . . . . . 0 0 . 1 . 039 nuclear build core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 9.7 ttp -105.47 6.38 32.37 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.185 -0.461 . . . . 64.22 110.901 179.86 . . . . . . . . 1 1 . 1 . 039 nuclear build core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 6.1 t -70.11 -6.37 33.56 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.235 -0.439 . . . . 73.42 111.193 -179.991 . . . . . . . . 1 1 . 1 . 039 nuclear build core ' A' A ' 15' ' ' VAL . . . . . 0.644 HG12 ' O ' ' A' ' 15' ' ' VAL . 40.5 t -96.26 9.91 5.79 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.164 -0.471 . . . . 75.41 111.119 179.891 . . . . . . . . 2 2 . 1 . 039 nuclear build core ' A' A ' 16' ' ' ILE . . . . . 0.455 ' O ' HG22 ' A' ' 16' ' ' ILE . 10.8 mt -143.93 2.04 0.31 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.192 -0.458 . . . . 75.21 111.121 179.899 . . . . . . . . 2 2 . 1 . 039 nuclear build core ' A' A ' 17' ' ' SER . . . . . 0.804 ' C ' ' HD2' ' A' ' 19' ' ' PRO . 0.0 OUTLIER -99.67 -65.89 0.06 OUTLIER Pre-proline 0 C--N 1.329 -0.303 0 CA-C-O 121.678 0.752 . . . . 62.13 110.861 -179.916 . . . . . . . . 3 3 . 1 . 039 nuclear build core ' A' A ' 18' ' ' PRO . . . . . 0.907 ' N ' ' HD2' ' A' ' 19' ' ' PRO . 53.7 Cg_endo -69.74 -27.44 26.55 Favored 'Trans proline' 0 C--N 1.341 0.168 0 C-N-CA 122.716 2.277 . . . . 61.23 112.341 179.995 . . . . . . . . 2 2 . 1 . 039 nuclear build core ' A' A ' 19' ' ' PRO . . . . . 0.907 ' HD2' ' N ' ' A' ' 18' ' ' PRO . 53.7 Cg_endo -69.81 -16.87 37.55 Favored 'Trans proline' 0 C--N 1.342 0.203 0 C-N-CA 122.65 2.234 . . . . 75.4 112.336 179.991 . . . . . . . . 2 2 . 1 . 039 nuclear build core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 1.1 mt-10 -82.83 -19.49 37.51 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.221 -0.445 . . . . 55.31 110.933 179.975 . . . . . . . . 1 1 . 1 . 039 nuclear build core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -59.68 -25.82 65.05 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.122 -0.49 . . . . 73.21 110.881 -179.965 . . . . . . . . 2 2 . 1 . 039 nuclear build core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.313 0 C-N-CA 120.73 -0.747 . . . . 52.34 112.483 -179.955 . . . . . . . . 0 0 . 1 . 040 nuclear build core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 48.5 t . . . . . 0 C--O 1.23 0.067 0 CA-C-O 120.85 0.357 . . . . 62.43 111.154 . . . . . . . . . 0 0 . 1 . 040 nuclear build core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 8.5 ttp -106.05 3.25 27.99 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.135 -0.484 . . . . 64.14 110.86 179.921 . . . . . . . . 1 1 . 1 . 040 nuclear build core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 5.6 t -70.8 -5.72 32.36 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.217 -0.447 . . . . 72.33 111.142 -179.927 . . . . . . . . 1 1 . 1 . 040 nuclear build core ' A' A ' 15' ' ' VAL . . . . . 0.654 HG12 ' O ' ' A' ' 15' ' ' VAL . 40.3 t -96.33 9.09 6.37 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.18 -0.464 . . . . 44.0 111.163 179.88 . . . . . . . . 2 2 . 1 . 040 nuclear build core ' A' A ' 16' ' ' ILE . . . . . 0.452 ' O ' HG22 ' A' ' 16' ' ' ILE . 2.9 mp -142.78 2.26 0.38 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.136 -0.484 . . . . 72.41 111.128 179.934 . . . . . . . . 2 2 . 1 . 040 nuclear build core ' A' A ' 17' ' ' SER . . . . . 0.827 ' C ' ' HD2' ' A' ' 19' ' ' PRO . 0.0 OUTLIER -99.65 -65.79 0.06 OUTLIER Pre-proline 0 C--N 1.33 -0.281 0 CA-C-O 121.657 0.741 . . . . 61.45 110.844 -179.924 . . . . . . . . 3 3 . 1 . 040 nuclear build core ' A' A ' 18' ' ' PRO . . . . . 0.93 ' N ' ' HD2' ' A' ' 19' ' ' PRO . 53.4 Cg_endo -69.76 -27.33 26.62 Favored 'Trans proline' 0 C--N 1.342 0.195 0 C-N-CA 122.651 2.234 . . . . 75.22 112.315 -179.979 . . . . . . . . 2 2 . 1 . 040 nuclear build core ' A' A ' 19' ' ' PRO . . . . . 0.93 ' HD2' ' N ' ' A' ' 18' ' ' PRO . 53.3 Cg_endo -69.75 -17.09 37.82 Favored 'Trans proline' 0 C--N 1.341 0.18 0 C-N-CA 122.705 2.27 . . . . 75.54 112.321 179.986 . . . . . . . . 2 2 . 1 . 040 nuclear build core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -82.65 -19.72 37.68 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.184 -0.462 . . . . 72.5 110.857 -179.946 . . . . . . . . 2 2 . 1 . 040 nuclear build core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -59.57 -25.83 64.9 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.153 -0.476 . . . . 54.4 110.89 -179.913 . . . . . . . . 2 2 . 1 . 040 nuclear build core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.304 0 C-N-CA 120.739 -0.743 . . . . 50.43 112.476 -179.953 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 1' ' ' TRP . . . . . . . . . . . . . 38.8 m0 . . . . . 0 C--O 1.231 0.126 0 CA-C-O 120.777 0.323 . . . . 63.11 110.943 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -56.48 160.59 5.11 Favored Pre-proline 0 C--N 1.329 -0.323 0 CA-C-O 121.621 0.724 . . . . 74.51 110.857 -179.941 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.78 79.11 0.97 Allowed 'Trans proline' 0 C--N 1.341 0.181 0 C-N-CA 122.652 2.235 . . . . 63.14 112.349 -179.98 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 2.1 t80 -135.37 -65.03 0.62 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.21 -0.45 . . . . 72.02 110.935 -179.916 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 5' ' ' LEU . . . . . 0.422 ' O ' HD12 ' A' ' 5' ' ' LEU . 0.3 OUTLIER -80.8 -24.4 38.56 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.116 -0.493 . . . . 75.31 110.914 179.976 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 27.6 mt-30 -51.97 -49.09 63.9 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.185 -0.461 . . . . 71.33 110.896 179.927 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 11.6 t -68.86 -31.41 70.34 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.246 -0.434 . . . . 51.52 111.157 -179.93 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -55.08 -29.28 57.24 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.209 -0.45 . . . . 73.52 110.912 179.951 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 0.7 OUTLIER -80.67 -45.45 17.18 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.182 -0.463 . . . . 74.45 110.973 -179.912 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 14.7 m-85 -63.15 -31.75 72.97 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.074 -0.512 . . . . 73.23 110.873 -179.904 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -55.17 -33.38 62.92 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.179 -0.464 . . . . 74.51 110.817 179.951 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 58.0 t -93.19 -29.18 4.38 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.228 -0.442 . . . . 71.4 111.163 179.999 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 10.5 ttp -101.73 33.23 3.06 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.172 -0.467 . . . . 72.34 110.879 179.899 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 5.7 t -85.96 -3.95 59.05 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.245 -0.434 . . . . 72.24 111.182 -179.985 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 15' ' ' VAL . . . . . 0.672 ' C ' ' HG3' ' A' ' 19' ' ' PRO . 24.5 t -93.78 4.75 7.77 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.228 -0.442 . . . . 74.12 111.119 179.927 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 16' ' ' ILE . . . . . 0.46 HG22 ' O ' ' A' ' 16' ' ' ILE . 9.5 mt -143.47 3.19 0.34 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.184 -0.462 . . . . 64.51 111.16 179.922 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 17' ' ' SER . . . . . 0.796 ' C ' ' HD2' ' A' ' 19' ' ' PRO . 0.5 OUTLIER -100.26 -68.44 0.04 OUTLIER Pre-proline 0 C--N 1.329 -0.294 0 CA-C-O 121.643 0.735 . . . . 74.02 110.836 -179.895 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 18' ' ' PRO . . . . . 0.918 ' N ' ' HD2' ' A' ' 19' ' ' PRO . 54.2 Cg_endo -69.71 -27.89 26.14 Favored 'Trans proline' 0 C--O 1.231 0.154 0 C-N-CA 122.664 2.243 . . . . 70.15 112.391 179.953 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 19' ' ' PRO . . . . . 0.918 ' HD2' ' N ' ' A' ' 18' ' ' PRO . 54.0 Cg_endo -69.68 -16.52 37.93 Favored 'Trans proline' 0 C--N 1.342 0.189 0 C-N-CA 122.704 2.269 . . . . 70.05 112.352 179.934 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 2.8 mt-10 -81.93 -19.4 40.83 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.248 -0.433 . . . . 73.01 110.906 -179.982 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -59.62 -25.74 64.9 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.175 -0.466 . . . . 72.43 110.864 -179.954 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.302 0 C-N-CA 120.688 -0.768 . . . . 60.12 112.484 -179.934 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 1' ' ' TRP . . . . . . . . . . . . . 46.2 m0 . . . . . 0 C--O 1.231 0.083 0 CA-C-O 120.773 0.321 . . . . 75.44 110.901 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 11.1 ptt180 -119.4 68.93 10.79 Favored Pre-proline 0 C--N 1.329 -0.291 0 CA-C-O 121.611 0.719 . . . . 73.22 110.883 -179.966 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.76 78.74 0.99 Allowed 'Trans proline' 0 C--N 1.341 0.165 0 C-N-CA 122.688 2.259 . . . . 61.35 112.382 -179.998 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 42.1 m-85 -134.95 -64.02 0.67 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.171 -0.468 . . . . 72.34 110.868 -179.872 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 5' ' ' LEU . . . . . 0.432 ' O ' HD12 ' A' ' 5' ' ' LEU . 0.3 OUTLIER -81.88 -24.45 35.72 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.162 -0.472 . . . . 62.24 110.902 179.989 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -55.2 -52.51 63.1 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.196 -0.456 . . . . 70.31 110.928 179.938 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 8.9 t -61.66 -32.74 72.92 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.195 -0.457 . . . . 71.42 111.137 -179.915 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -53.54 -28.57 32.26 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.247 -0.433 . . . . 54.42 110.901 -179.998 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 2.8 m-85 -94.21 -44.97 7.72 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.126 -0.488 . . . . 74.34 110.93 -179.872 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 23.3 m-85 -56.28 -30.07 61.99 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.111 -0.495 . . . . 75.25 110.915 -179.909 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 13.9 t70 -57.96 -30.63 66.16 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.137 -0.483 . . . . 74.44 110.883 179.896 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 48.1 t -91.99 -29.84 4.64 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.17 -0.468 . . . . 63.33 111.174 179.952 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 10.5 ttp -101.97 33.34 3.08 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.153 -0.476 . . . . 75.13 110.847 179.926 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 5.5 t -86.09 -4.03 59.08 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.242 -0.435 . . . . 65.2 111.171 -179.957 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 15' ' ' VAL . . . . . 0.664 ' C ' ' HG3' ' A' ' 19' ' ' PRO . 25.4 t -92.9 4.12 7.69 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.212 -0.449 . . . . 71.53 111.087 179.965 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 16' ' ' ILE . . . . . 0.459 HG22 ' O ' ' A' ' 16' ' ' ILE . 9.5 mt -143.34 3.37 0.35 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.164 -0.471 . . . . 74.12 111.089 179.928 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 17' ' ' SER . . . . . 0.807 ' C ' ' HD2' ' A' ' 19' ' ' PRO . 0.5 OUTLIER -99.91 -68.73 0.04 OUTLIER Pre-proline 0 C--N 1.33 -0.28 0 CA-C-O 121.688 0.756 . . . . 71.02 110.876 -179.92 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 18' ' ' PRO . . . . . 0.908 ' N ' ' HD2' ' A' ' 19' ' ' PRO . 53.9 Cg_endo -69.77 -27.89 25.86 Favored 'Trans proline' 0 C--N 1.342 0.211 0 C-N-CA 122.683 2.256 . . . . 72.31 112.324 179.977 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 19' ' ' PRO . . . . . 0.908 ' HD2' ' N ' ' A' ' 18' ' ' PRO . 54.2 Cg_endo -69.7 -16.47 37.83 Favored 'Trans proline' 0 C--N 1.342 0.202 0 C-N-CA 122.702 2.268 . . . . 55.2 112.358 179.949 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 2.8 mt-10 -81.94 -19.89 39.76 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.207 -0.451 . . . . 74.43 110.89 -179.964 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -58.64 -34.73 71.52 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.129 -0.487 . . . . 70.42 110.842 -179.911 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.303 0 C-N-CA 120.697 -0.763 . . . . 60.42 112.491 -179.975 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 1' ' ' TRP . . . . . . . . . . . . . 54.8 m0 . . . . . 0 C--O 1.231 0.104 0 CA-C-O 120.787 0.327 . . . . 64.42 110.887 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 4.8 mtt-85 -114.09 73.0 2.36 Favored Pre-proline 0 C--N 1.329 -0.294 0 CA-C-O 121.594 0.711 . . . . 62.41 110.84 -179.953 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.77 78.8 0.99 Allowed 'Trans proline' 0 C--N 1.341 0.175 0 C-N-CA 122.678 2.252 . . . . 74.03 112.342 179.99 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 25.9 m-85 -135.94 -63.7 0.64 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.22 -0.445 . . . . 74.51 110.919 -179.921 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 5' ' ' LEU . . . . . 0.437 ' O ' HD12 ' A' ' 5' ' ' LEU . 0.3 OUTLIER -82.18 -24.47 34.95 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.092 -0.503 . . . . 71.32 110.904 179.963 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 6.8 mt-30 -55.88 -52.91 62.42 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.202 -0.454 . . . . 71.25 110.891 179.962 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 9.3 t -60.95 -33.11 72.67 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.25 -0.432 . . . . 74.03 111.103 -179.884 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -53.74 -28.21 33.03 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.237 -0.438 . . . . 74.5 110.876 179.986 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 0.7 OUTLIER -91.39 -45.24 8.68 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.176 -0.466 . . . . 74.34 110.936 -179.848 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 22.0 m-85 -58.11 -32.23 67.91 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.123 -0.489 . . . . 55.5 110.942 -179.981 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -53.48 -37.01 62.3 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.128 -0.487 . . . . 75.1 110.858 179.945 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 48.1 t -84.69 -28.21 6.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.229 -0.441 . . . . 73.51 111.168 179.963 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 10.5 ttp -102.06 33.36 3.09 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.182 -0.463 . . . . 65.41 110.899 179.908 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 5.5 t -86.16 -3.94 59.06 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.183 -0.462 . . . . 55.1 111.153 -179.935 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 15' ' ' VAL . . . . . 0.668 ' C ' ' HG3' ' A' ' 19' ' ' PRO . 25.4 t -92.94 4.13 7.7 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.219 -0.446 . . . . 73.55 111.124 179.898 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 16' ' ' ILE . . . . . 0.457 HG22 ' O ' ' A' ' 16' ' ' ILE . 9.5 mt -143.27 3.3 0.35 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 116.152 -0.476 . . . . 72.22 111.123 179.914 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 17' ' ' SER . . . . . 0.811 ' C ' ' HD2' ' A' ' 19' ' ' PRO . 0.5 OUTLIER -99.84 -68.78 0.04 OUTLIER Pre-proline 0 C--N 1.329 -0.313 0 CA-C-O 121.676 0.75 . . . . 70.14 110.893 -179.917 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 18' ' ' PRO . . . . . 0.92 ' N ' ' HD2' ' A' ' 19' ' ' PRO . 53.7 Cg_endo -69.77 -27.86 25.92 Favored 'Trans proline' 0 C--N 1.341 0.165 0 C-N-CA 122.673 2.249 . . . . 64.3 112.36 179.952 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 19' ' ' PRO . . . . . 0.92 ' HD2' ' N ' ' A' ' 18' ' ' PRO . 53.2 Cg_endo -69.77 -16.42 37.51 Favored 'Trans proline' 0 C--N 1.341 0.176 0 C-N-CA 122.668 2.246 . . . . 65.14 112.329 179.96 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 1.5 mt-10 -81.91 -19.52 40.65 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.207 -0.451 . . . . 62.23 110.871 -179.995 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -59.56 -25.71 64.79 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.178 -0.465 . . . . 71.02 110.911 -179.918 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.342 0 C-N-CA 120.752 -0.737 . . . . 53.33 112.469 -179.963 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 1' ' ' TRP . . . . . . . . . . . . . 55.0 m0 . . . . . 0 C--O 1.231 0.127 0 CA-C-O 120.742 0.306 . . . . 72.44 110.917 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER 52.07 68.52 3.1 Favored Pre-proline 0 C--N 1.329 -0.314 0 CA-C-O 121.615 0.722 . . . . 62.15 110.902 -179.933 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.76 -171.04 0.43 Allowed 'Trans proline' 0 C--N 1.341 0.183 0 C-N-CA 122.665 2.243 . . . . 64.23 112.335 -179.968 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 46.0 m-85 -132.21 -64.49 0.77 Allowed 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.192 -0.458 . . . . 71.54 110.891 -179.909 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 5' ' ' LEU . . . . . 0.425 ' O ' HD12 ' A' ' 5' ' ' LEU . 0.3 OUTLIER -81.11 -24.44 37.68 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.116 -0.493 . . . . 64.02 110.971 179.952 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 1.1 tp60 -55.68 -53.93 50.55 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.16 -0.473 . . . . 70.21 110.917 179.928 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 9.0 t -59.33 -32.32 69.97 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.202 -0.454 . . . . 72.31 111.128 -179.944 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -55.39 -26.26 40.42 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.258 -0.428 . . . . 74.32 110.88 -179.997 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 1.0 OUTLIER -94.71 -41.88 9.04 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.157 -0.474 . . . . 72.22 110.872 -179.836 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 22.7 m-85 -61.03 -26.3 67.52 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.137 -0.483 . . . . 73.24 110.934 -179.881 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -57.14 -41.35 78.96 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.119 -0.491 . . . . 53.44 110.881 179.896 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 50.4 t -84.66 -26.87 6.86 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.195 -0.457 . . . . 72.53 111.141 -179.999 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 10.4 ttp -102.26 33.7 3.01 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.13 -0.486 . . . . 65.14 110.884 179.926 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 5.8 t -86.47 -3.94 59.09 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.264 -0.425 . . . . 73.35 111.143 -179.912 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 15' ' ' VAL . . . . . 0.68 ' C ' ' HG3' ' A' ' 19' ' ' PRO . 24.3 t -93.87 4.1 8.21 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.208 -0.451 . . . . 72.42 111.155 179.911 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 16' ' ' ILE . . . . . 0.458 HG22 ' O ' ' A' ' 16' ' ' ILE . 2.8 mp -142.5 3.46 0.4 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.194 -0.457 . . . . 54.51 111.144 179.893 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 17' ' ' SER . . . . . 0.794 ' C ' ' HD2' ' A' ' 19' ' ' PRO . 0.5 OUTLIER -100.19 -68.43 0.04 OUTLIER Pre-proline 0 C--N 1.329 -0.296 0 CA-C-O 121.675 0.75 . . . . 74.34 110.895 -179.962 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 18' ' ' PRO . . . . . 0.919 ' N ' ' HD2' ' A' ' 19' ' ' PRO . 53.1 Cg_endo -69.73 -27.94 26.02 Favored 'Trans proline' 0 C--N 1.341 0.144 0 C-N-CA 122.73 2.286 . . . . 64.14 112.319 179.973 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 19' ' ' PRO . . . . . 0.919 ' HD2' ' N ' ' A' ' 18' ' ' PRO . 53.9 Cg_endo -69.71 -16.42 37.74 Favored 'Trans proline' 0 C--N 1.342 0.213 0 C-N-CA 122.651 2.234 . . . . 74.14 112.366 179.952 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -81.93 -19.76 40.08 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.207 -0.451 . . . . 75.41 110.863 -179.979 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -58.63 -32.93 69.5 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.151 -0.477 . . . . 62.44 110.896 -179.891 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.45 -0.372 0 C-N-CA 120.764 -0.732 . . . . 75.22 112.502 179.979 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 1' ' ' TRP . . . . . . . . . . . . . 41.3 m0 . . . . . 0 C--O 1.231 0.11 0 CA-C-O 120.749 0.309 . . . . 73.32 110.899 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 4.3 mtt180 -74.24 160.64 81.01 Favored Pre-proline 0 C--N 1.329 -0.316 0 CA-C-O 121.64 0.733 . . . . 72.23 110.846 -179.951 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.84 79.41 0.97 Allowed 'Trans proline' 0 C--N 1.341 0.181 0 C-N-CA 122.645 2.23 . . . . 71.34 112.319 -179.983 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 1.7 t80 -134.71 -65.02 0.65 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.205 -0.452 . . . . 75.43 110.905 -179.888 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 5' ' ' LEU . . . . . 0.425 ' O ' HD12 ' A' ' 5' ' ' LEU . 0.3 OUTLIER -80.88 -24.4 38.36 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.075 -0.511 . . . . 60.1 110.941 179.954 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -51.91 -49.03 63.86 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.223 -0.444 . . . . 72.2 110.875 179.926 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 11.7 t -68.97 -31.37 70.18 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.209 -0.451 . . . . 35.23 111.144 -179.93 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 2.6 mt-10 -54.83 -27.75 44.41 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.246 -0.433 . . . . 65.44 110.889 -179.973 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -83.38 -45.6 13.52 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.152 -0.477 . . . . 73.54 110.903 -179.892 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 13.3 m-85 -63.34 -30.94 71.99 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.124 -0.489 . . . . 62.55 110.952 -179.9 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 2.3 t70 -56.17 -34.1 65.86 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.126 -0.488 . . . . 71.33 110.833 179.901 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 61.5 t -92.72 -28.13 4.56 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.222 -0.444 . . . . 70.02 111.132 -179.988 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 10.4 ttp -102.05 33.84 2.91 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.159 -0.473 . . . . 53.14 110.882 179.955 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 5.8 t -86.59 -3.84 59.09 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.212 -0.449 . . . . 64.14 111.193 -179.949 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 15' ' ' VAL . . . . . 0.684 ' C ' ' HG3' ' A' ' 19' ' ' PRO . 24.2 t -93.94 4.07 8.27 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.191 -0.459 . . . . 71.13 111.132 179.904 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 16' ' ' ILE . . . . . 0.465 HG22 ' O ' ' A' ' 16' ' ' ILE . 2.8 mp -142.45 3.45 0.4 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.138 -0.483 . . . . 50.25 111.127 179.872 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 17' ' ' SER . . . . . 0.798 ' C ' ' HD2' ' A' ' 19' ' ' PRO . 0.5 OUTLIER -100.18 -68.41 0.04 OUTLIER Pre-proline 0 C--N 1.329 -0.291 0 CA-C-O 121.661 0.743 . . . . 72.23 110.884 -179.952 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 18' ' ' PRO . . . . . 0.919 ' N ' ' HD2' ' A' ' 19' ' ' PRO . 53.6 Cg_endo -69.75 -27.84 26.03 Favored 'Trans proline' 0 N--CA 1.465 -0.159 0 C-N-CA 122.716 2.277 . . . . 71.32 112.37 179.961 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 19' ' ' PRO . . . . . 0.919 ' HD2' ' N ' ' A' ' 18' ' ' PRO . 54.1 Cg_endo -69.77 -16.41 37.5 Favored 'Trans proline' 0 C--N 1.342 0.203 0 C-N-CA 122.624 2.216 . . . . 72.33 112.361 179.932 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -81.95 -19.85 39.84 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.206 -0.452 . . . . 72.5 110.879 -179.949 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -58.65 -34.54 71.31 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.125 -0.488 . . . . 71.52 110.864 -179.907 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.279 0 C-N-CA 120.748 -0.739 . . . . 52.33 112.427 -179.979 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 1' ' ' TRP . . . . . . . . . . . . . 40.9 m0 . . . . . 0 C--O 1.231 0.103 0 CA-C-O 120.798 0.332 . . . . 72.44 110.903 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 5.0 mpt_? -76.81 160.61 76.32 Favored Pre-proline 0 C--N 1.329 -0.283 0 CA-C-O 121.651 0.739 . . . . 74.33 110.898 -179.996 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.74 170.39 16.68 Favored 'Trans proline' 0 C--N 1.342 0.185 0 C-N-CA 122.708 2.272 . . . . 63.33 112.337 -179.984 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 40.6 m-85 -134.47 -64.03 0.69 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.183 -0.462 . . . . 64.01 110.877 -179.88 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 5' ' ' LEU . . . . . 0.428 ' O ' HD12 ' A' ' 5' ' ' LEU . 0.3 OUTLIER -82.0 -24.4 35.46 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.119 -0.491 . . . . 74.01 110.956 179.944 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 4.6 tp60 -54.4 -51.38 65.06 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.223 -0.444 . . . . 71.54 110.915 179.881 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 10.3 t -63.41 -32.16 73.51 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.234 -0.439 . . . . 70.33 111.141 -179.928 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 1.3 tt0 -52.92 -29.14 26.78 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.207 -0.452 . . . . 71.14 110.899 -179.984 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -84.78 -45.31 12.49 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.102 -0.499 . . . . 65.33 110.919 -179.837 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 13.3 m-85 -63.61 -26.46 68.69 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.112 -0.495 . . . . 75.33 110.929 -179.932 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 2.0 t70 -58.62 -31.68 68.31 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.128 -0.487 . . . . 71.04 110.87 179.942 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 42.4 t -94.26 -28.77 4.21 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.148 -0.478 . . . . 75.03 111.124 179.99 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 10.3 ttp -102.02 33.77 2.93 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.183 -0.462 . . . . 74.11 110.884 179.928 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 5.8 t -86.5 -3.91 59.09 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.214 -0.448 . . . . 64.34 111.172 -179.978 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 15' ' ' VAL . . . . . 0.679 ' C ' ' HG3' ' A' ' 19' ' ' PRO . 24.1 t -93.86 4.07 8.22 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.243 -0.435 . . . . 62.11 111.107 179.933 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 16' ' ' ILE . . . . . 0.463 HG22 ' O ' ' A' ' 16' ' ' ILE . 2.8 mp -142.48 3.45 0.4 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.197 -0.456 . . . . 64.31 111.124 179.916 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 17' ' ' SER . . . . . 0.811 ' C ' ' HD2' ' A' ' 19' ' ' PRO . 0.5 OUTLIER -100.23 -68.42 0.04 OUTLIER Pre-proline 0 C--N 1.329 -0.293 0 CA-C-O 121.629 0.728 . . . . 72.12 110.838 -179.936 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 18' ' ' PRO . . . . . 0.911 ' N ' ' HD2' ' A' ' 19' ' ' PRO . 54.0 Cg_endo -69.72 -27.93 26.07 Favored 'Trans proline' 0 C--N 1.341 0.153 0 C-N-CA 122.726 2.284 . . . . 71.12 112.338 179.995 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 19' ' ' PRO . . . . . 0.911 ' HD2' ' N ' ' A' ' 18' ' ' PRO . 54.1 Cg_endo -69.69 -16.44 37.84 Favored 'Trans proline' 0 C--N 1.341 0.172 0 C-N-CA 122.704 2.27 . . . . 53.24 112.365 179.958 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -81.99 -19.51 40.39 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.184 -0.462 . . . . 74.42 110.852 -179.953 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -59.54 -25.72 64.75 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.139 -0.482 . . . . 72.51 110.912 -179.954 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.347 0 C-N-CA 120.795 -0.717 . . . . 71.24 112.496 -179.968 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 1' ' ' TRP . . . . . . . . . . . . . 43.0 m0 . . . . . 0 C--O 1.231 0.102 0 CA-C-O 120.785 0.326 . . . . 75.44 110.932 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER 52.49 72.1 1.27 Allowed Pre-proline 0 C--N 1.329 -0.309 0 CA-C-O 121.57 0.7 . . . . 72.42 110.873 -179.956 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -69.74 78.79 0.98 Allowed 'Trans proline' 0 C--O 1.231 0.164 0 C-N-CA 122.699 2.266 . . . . 74.44 112.36 179.991 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -135.2 -64.83 0.64 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.197 -0.456 . . . . 75.4 110.922 -179.937 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 5' ' ' LEU . . . . . 0.437 ' O ' HD12 ' A' ' 5' ' ' LEU . 0.3 OUTLIER -81.02 -24.48 37.9 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.154 -0.475 . . . . 74.35 110.895 179.955 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 18.0 mt-30 -51.91 -48.81 64.01 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.202 -0.454 . . . . 73.14 110.882 179.967 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 11.8 t -69.21 -31.31 69.81 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.198 -0.456 . . . . 72.44 111.203 -179.957 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -54.89 -28.67 52.2 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.174 -0.466 . . . . 73.11 110.896 -179.989 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -82.59 -45.07 15.06 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.123 -0.49 . . . . 75.11 110.906 -179.848 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 13.9 m-85 -63.76 -28.63 70.01 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.085 -0.507 . . . . 63.15 110.9 -179.907 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 27.8 t70 -61.45 -45.43 94.32 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.127 -0.488 . . . . 72.22 110.898 179.927 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 41.4 t -81.06 -26.88 10.75 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.196 -0.456 . . . . 53.13 111.121 179.976 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 9.4 ttp -102.24 32.78 3.36 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.212 -0.449 . . . . 73.03 110.872 179.928 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 5.9 t -86.78 -3.76 59.09 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.209 -0.45 . . . . 74.42 111.143 -179.899 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 15' ' ' VAL . . . . . 0.69 ' C ' ' HG3' ' A' ' 19' ' ' PRO . 23.2 t -94.25 4.58 8.13 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.187 -0.461 . . . . 64.42 111.122 179.904 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 16' ' ' ILE . . . . . 0.461 HG22 ' O ' ' A' ' 16' ' ' ILE . 2.8 mp -142.46 3.28 0.4 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.157 -0.474 . . . . 74.01 111.149 179.892 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 17' ' ' SER . . . . . 0.791 ' C ' ' HD2' ' A' ' 19' ' ' PRO . 0.5 OUTLIER -100.27 -68.24 0.05 OUTLIER Pre-proline 0 C--N 1.33 -0.272 0 CA-C-O 121.688 0.756 . . . . 75.3 110.926 -179.965 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 18' ' ' PRO . . . . . 0.929 ' N ' ' HD2' ' A' ' 19' ' ' PRO . 53.8 Cg_endo -69.79 -27.8 25.88 Favored 'Trans proline' 0 C--N 1.342 0.206 0 C-N-CA 122.681 2.254 . . . . 73.13 112.362 179.946 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 19' ' ' PRO . . . . . 0.929 ' HD2' ' N ' ' A' ' 18' ' ' PRO . 53.5 Cg_endo -69.77 -16.46 37.54 Favored 'Trans proline' 0 C--N 1.342 0.205 0 C-N-CA 122.717 2.278 . . . . 55.15 112.32 179.949 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -81.94 -19.91 39.72 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.249 -0.432 . . . . 73.02 110.909 -179.954 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -58.57 -34.34 70.96 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.136 -0.484 . . . . 72.45 110.866 -179.934 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.296 0 C-N-CA 120.775 -0.726 . . . . 64.11 112.488 -179.906 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 1' ' ' TRP . . . . . . . . . . . . . 43.0 m0 . . . . . 0 C--O 1.231 0.095 0 CA-C-O 120.787 0.327 . . . . 64.2 110.892 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 2.6 mpp_? -56.3 160.58 4.85 Favored Pre-proline 0 C--N 1.329 -0.302 0 CA-C-O 121.596 0.712 . . . . 71.01 110.879 -179.961 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.75 109.62 2.35 Favored 'Trans proline' 0 C--N 1.341 0.184 0 C-N-CA 122.658 2.239 . . . . 74.14 112.354 180.0 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 5.7 t80 -134.91 -65.46 0.62 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.266 -0.425 . . . . 64.34 110.931 -179.911 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 5' ' ' LEU . . . . . 0.428 ' O ' HD12 ' A' ' 5' ' ' LEU . 0.3 OUTLIER -79.96 -24.49 40.91 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.119 -0.492 . . . . 72.22 110.952 179.946 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -51.98 -50.83 60.5 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.152 -0.477 . . . . 75.1 110.911 179.948 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 11.1 t -66.62 -31.68 72.53 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.202 -0.454 . . . . 50.32 111.156 -179.949 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -55.51 -26.11 41.07 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.2 -0.455 . . . . 70.52 110.921 180.0 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 2.4 m-85 -94.82 -45.06 7.47 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.138 -0.483 . . . . 75.13 110.891 -179.858 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 22.7 m-85 -56.99 -28.53 62.5 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.128 -0.487 . . . . 63.04 110.908 -179.89 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 2.3 t70 -56.72 -27.22 58.77 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.101 -0.5 . . . . 62.33 110.828 179.964 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 64.1 t -95.93 -28.71 3.93 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.222 -0.444 . . . . 75.12 111.152 179.978 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 10.4 ttp -101.74 33.28 3.05 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.188 -0.46 . . . . 72.33 110.863 179.897 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 5.7 t -86.02 -3.97 59.06 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.219 -0.446 . . . . 61.13 111.162 -179.956 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 15' ' ' VAL . . . . . 0.669 ' C ' ' HG3' ' A' ' 19' ' ' PRO . 24.4 t -93.84 4.85 7.74 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.191 -0.459 . . . . 53.24 111.11 179.95 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 16' ' ' ILE . . . . . 0.459 HG22 ' O ' ' A' ' 16' ' ' ILE . 9.6 mt -143.47 3.04 0.34 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 116.177 -0.465 . . . . 72.3 111.121 179.943 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 17' ' ' SER . . . . . 0.805 ' C ' ' HD2' ' A' ' 19' ' ' PRO . 0.5 OUTLIER -100.18 -68.39 0.04 OUTLIER Pre-proline 0 C--N 1.329 -0.295 0 CA-C-O 121.613 0.72 . . . . 75.4 110.837 -179.911 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 18' ' ' PRO . . . . . 0.909 ' N ' ' HD2' ' A' ' 19' ' ' PRO . 54.0 Cg_endo -69.74 -27.89 26.01 Favored 'Trans proline' 0 C--O 1.232 0.203 0 C-N-CA 122.657 2.238 . . . . 72.31 112.339 179.983 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 19' ' ' PRO . . . . . 0.909 ' HD2' ' N ' ' A' ' 18' ' ' PRO . 54.1 Cg_endo -69.71 -16.78 37.91 Favored 'Trans proline' 0 C--N 1.341 0.155 0 C-N-CA 122.725 2.284 . . . . 63.0 112.383 179.921 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 24.4 tt0 -82.55 -21.26 35.41 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.177 -0.465 . . . . 64.21 110.906 179.991 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -58.22 -34.16 70.11 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.173 -0.467 . . . . 74.12 110.864 -179.92 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.292 0 C-N-CA 120.755 -0.736 . . . . 73.32 112.475 -179.957 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 1' ' ' TRP . . . . . . . . . . . . . 41.9 m0 . . . . . 0 C--O 1.231 0.097 0 CA-C-O 120.764 0.316 . . . . 71.33 110.891 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 53.9 73.27 0.94 Allowed Pre-proline 0 C--N 1.329 -0.297 0 CA-C-O 121.609 0.719 . . . . 70.41 110.862 -179.977 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.78 78.74 0.99 Allowed 'Trans proline' 0 C--N 1.341 0.145 0 C-N-CA 122.696 2.264 . . . . 61.13 112.326 179.99 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 5.5 t80 -135.27 -65.24 0.62 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.245 -0.434 . . . . 61.53 110.894 -179.897 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 5' ' ' LEU . . . . . 0.431 ' O ' HD12 ' A' ' 5' ' ' LEU . 0.3 OUTLIER -80.55 -24.45 39.24 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.142 -0.481 . . . . 73.45 110.881 -179.993 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -51.89 -49.38 63.1 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.216 -0.447 . . . . 73.33 110.942 179.939 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 11.4 t -68.58 -31.43 70.62 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.215 -0.448 . . . . 62.31 111.13 -179.912 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -55.38 -28.39 53.68 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.212 -0.449 . . . . 52.23 110.905 179.98 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 1.3 m-85 -85.7 -45.26 11.84 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.153 -0.476 . . . . 75.43 110.885 -179.853 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 13.6 m-85 -62.75 -31.34 72.27 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.165 -0.47 . . . . 71.04 110.931 -179.903 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 16.6 t0 -54.21 -34.38 60.47 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.073 -0.512 . . . . 72.42 110.903 179.924 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 58.5 t -92.92 -28.12 4.52 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.21 -0.45 . . . . 72.32 111.142 179.982 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 10.5 ttp -102.08 33.88 2.9 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.167 -0.469 . . . . 63.24 110.906 179.878 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 5.6 t -86.67 -3.92 59.1 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.198 -0.455 . . . . 73.42 111.186 -179.944 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 15' ' ' VAL . . . . . 0.686 ' C ' ' HG3' ' A' ' 19' ' ' PRO . 25.0 t -93.07 3.49 8.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.17 -0.468 . . . . 44.13 111.094 179.937 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 16' ' ' ILE . . . . . 0.458 HG22 ' O ' ' A' ' 16' ' ' ILE . 2.8 mp -142.45 3.71 0.4 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.171 -0.468 . . . . 62.21 111.121 179.929 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 17' ' ' SER . . . . . 0.805 ' C ' ' HD2' ' A' ' 19' ' ' PRO . 0.5 OUTLIER -99.92 -68.77 0.04 OUTLIER Pre-proline 0 C--N 1.329 -0.303 0 CA-C-O 121.681 0.753 . . . . 44.1 110.904 -179.951 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 18' ' ' PRO . . . . . 0.92 ' N ' ' HD2' ' A' ' 19' ' ' PRO . 53.7 Cg_endo -69.82 -27.86 25.69 Favored 'Trans proline' 0 C--O 1.231 0.174 0 C-N-CA 122.675 2.25 . . . . 71.51 112.334 179.963 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 19' ' ' PRO . . . . . 0.92 ' HD2' ' N ' ' A' ' 18' ' ' PRO . 53.7 Cg_endo -69.78 -16.48 37.51 Favored 'Trans proline' 0 C--N 1.341 0.145 0 C-N-CA 122.701 2.267 . . . . 74.04 112.372 179.938 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 1.5 mt-10 -81.94 -19.89 39.75 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.193 -0.458 . . . . 71.42 110.911 -179.984 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -58.59 -34.43 71.08 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.119 -0.491 . . . . 75.54 110.848 -179.91 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.289 0 C-N-CA 120.715 -0.755 . . . . 73.35 112.529 -179.929 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 1' ' ' TRP . . . . . . . . . . . . . 33.8 m0 . . . . . 0 C--O 1.231 0.131 0 CA-C-O 120.779 0.323 . . . . 72.22 110.909 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -151.05 69.42 8.33 Favored Pre-proline 0 C--N 1.329 -0.298 0 CA-C-O 121.601 0.715 . . . . 44.13 110.876 -179.976 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.79 83.45 0.7 Allowed 'Trans proline' 0 C--N 1.341 0.141 0 C-N-CA 122.676 2.25 . . . . 62.02 112.307 -179.986 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 4' ' ' TYR . . . . . 0.446 ' O ' HG22 ' A' ' 7' ' ' THR . 43.4 m-85 -134.17 -68.0 0.57 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.197 -0.456 . . . . 73.23 110.949 -179.94 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 5' ' ' LEU . . . . . 0.445 ' O ' HD12 ' A' ' 5' ' ' LEU . 0.3 OUTLIER -76.74 -24.2 53.01 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.077 -0.51 . . . . 75.33 110.894 179.973 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 52.7 mm-40 -55.24 -57.63 11.0 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.167 -0.47 . . . . 74.43 110.945 179.9 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 7' ' ' THR . . . . . 0.446 HG22 ' O ' ' A' ' 4' ' ' TYR . 15.1 t -53.52 -27.87 28.11 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.208 -0.451 . . . . 54.13 111.147 -179.922 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 4.1 tt0 -59.53 -20.92 59.02 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.201 -0.454 . . . . 75.21 110.915 179.959 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 0.9 OUTLIER -105.35 -18.75 14.02 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.136 -0.484 . . . . 75.03 110.954 -179.834 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 3.2 m-85 -51.47 -39.49 57.61 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.124 -0.489 . . . . 73.23 110.936 -179.913 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -51.94 -30.9 26.57 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.088 -0.505 . . . . 61.44 110.892 179.865 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 23.5 t -101.03 -26.83 3.49 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.214 -0.448 . . . . 62.51 111.152 179.988 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 10.5 ttp -102.12 33.97 2.88 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.112 -0.494 . . . . 75.22 110.878 179.937 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 5.7 t -86.68 -4.0 59.12 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.247 -0.433 . . . . 70.32 111.158 -179.927 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 15' ' ' VAL . . . . . 0.679 ' C ' ' HG3' ' A' ' 19' ' ' PRO . 25.0 t -92.98 3.43 8.18 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 116.198 -0.455 . . . . 63.14 111.129 179.932 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 16' ' ' ILE . . . . . 0.452 HG22 ' O ' ' A' ' 16' ' ' ILE . 2.8 mp -142.37 3.68 0.41 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.175 -0.466 . . . . 74.44 111.178 179.95 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 17' ' ' SER . . . . . 0.809 ' C ' ' HD2' ' A' ' 19' ' ' PRO . 0.5 OUTLIER -99.95 -68.81 0.04 OUTLIER Pre-proline 0 C--N 1.33 -0.268 0 CA-C-O 121.615 0.721 . . . . 73.44 110.846 -179.942 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 18' ' ' PRO . . . . . 0.927 ' N ' ' HD2' ' A' ' 19' ' ' PRO . 54.5 Cg_endo -69.68 -27.88 26.3 Favored 'Trans proline' 0 C--N 1.341 0.166 0 C-N-CA 122.681 2.254 . . . . 52.45 112.379 179.939 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 19' ' ' PRO . . . . . 0.927 ' HD2' ' N ' ' A' ' 18' ' ' PRO . 53.9 Cg_endo -69.75 -16.57 37.65 Favored 'Trans proline' 0 C--N 1.341 0.151 0 C-N-CA 122.689 2.259 . . . . 62.32 112.378 179.922 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -81.85 -19.91 40.04 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.186 -0.461 . . . . 74.02 110.906 -179.982 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -58.54 -33.4 69.85 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.14 -0.482 . . . . 73.54 110.883 -179.933 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.314 0 C-N-CA 120.715 -0.755 . . . . 72.44 112.516 -179.929 . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 1' ' ' TRP . . . . . . . . . . . . . 37.9 m0 . . . . . 0 C--O 1.231 0.085 0 CA-C-O 120.795 0.331 . . . . 73.34 110.9 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -120.78 157.65 54.06 Favored Pre-proline 0 C--N 1.329 -0.285 0 CA-C-O 121.594 0.711 . . . . 74.24 110.892 -179.988 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.84 159.82 51.94 Favored 'Trans proline' 0 C--N 1.341 0.177 0 C-N-CA 122.708 2.272 . . . . 51.12 112.326 -179.99 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 37.5 m-85 -133.96 -63.95 0.72 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.22 -0.446 . . . . 74.3 110.94 -179.895 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 5' ' ' LEU . . . . . 0.429 ' O ' HD12 ' A' ' 5' ' ' LEU . 0.3 OUTLIER -82.09 -24.39 35.23 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.105 -0.498 . . . . 71.41 110.907 179.948 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 10.2 mm100 -55.06 -52.11 64.23 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.224 -0.443 . . . . 73.13 110.886 179.916 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 9.0 t -62.2 -32.53 73.19 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.213 -0.449 . . . . 75.04 111.141 -179.913 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -52.89 -29.27 27.33 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.223 -0.444 . . . . 71.4 110.906 179.974 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -82.55 -46.06 13.86 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.12 -0.491 . . . . 74.43 110.964 -179.858 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 14.6 m-85 -62.55 -30.31 71.22 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.081 -0.508 . . . . 74.44 110.945 -179.943 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 4.4 t70 -57.93 -44.7 87.06 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.093 -0.503 . . . . 73.45 110.888 179.913 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 61.9 t -83.62 -27.04 7.52 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-N 116.203 -0.453 . . . . 75.03 111.102 -179.973 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 10.3 ttp -101.94 33.76 2.92 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.191 -0.459 . . . . 73.45 110.906 179.908 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 5.8 t -86.48 -3.93 59.09 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.236 -0.438 . . . . 54.11 111.177 -179.972 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 15' ' ' VAL . . . . . 0.673 ' C ' ' HG3' ' A' ' 19' ' ' PRO . 24.1 t -93.85 4.07 8.22 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.207 -0.451 . . . . 72.41 111.111 179.924 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 16' ' ' ILE . . . . . 0.461 HG22 ' O ' ' A' ' 16' ' ' ILE . 2.8 mp -142.49 3.43 0.4 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.225 -0.443 . . . . 74.43 111.128 179.954 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 17' ' ' SER . . . . . 0.811 ' C ' ' HD2' ' A' ' 19' ' ' PRO . 0.5 OUTLIER -100.24 -68.39 0.04 OUTLIER Pre-proline 0 C--N 1.33 -0.239 0 CA-C-O 121.639 0.733 . . . . 55.23 110.832 -179.91 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 18' ' ' PRO . . . . . 0.908 ' N ' ' HD2' ' A' ' 19' ' ' PRO . 53.6 Cg_endo -69.73 -27.89 26.07 Favored 'Trans proline' 0 C--N 1.341 0.179 0 C-N-CA 122.746 2.297 . . . . 72.44 112.298 179.994 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 19' ' ' PRO . . . . . 0.908 ' HD2' ' N ' ' A' ' 18' ' ' PRO . 53.4 Cg_endo -69.76 -16.45 37.58 Favored 'Trans proline' 0 C--N 1.342 0.187 0 C-N-CA 122.687 2.258 . . . . 72.25 112.355 179.972 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -81.9 -19.88 39.92 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.235 -0.439 . . . . 71.24 110.924 179.987 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -58.68 -33.95 70.72 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.123 -0.49 . . . . 73.12 110.874 -179.928 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.326 0 C-N-CA 120.782 -0.723 . . . . 61.31 112.469 -179.962 . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 1' ' ' TRP . . . . . . . . . . . . . 2.3 t90 . . . . . 0 C--O 1.231 0.123 0 CA-C-O 120.787 0.327 . . . . 72.23 110.915 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 2.4 ptt180 -123.18 73.47 48.49 Favored Pre-proline 0 C--N 1.329 -0.297 0 CA-C-O 121.596 0.712 . . . . 73.43 110.846 -179.953 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.75 79.69 0.93 Allowed 'Trans proline' 0 C--O 1.232 0.184 0 C-N-CA 122.682 2.255 . . . . 60.51 112.358 179.959 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 5.2 t80 -135.92 -65.18 0.59 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.245 -0.434 . . . . 72.54 110.915 -179.882 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 5' ' ' LEU . . . . . 0.429 ' O ' HD12 ' A' ' 5' ' ' LEU . 0.3 OUTLIER -80.29 -24.36 40.07 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.122 -0.49 . . . . 64.33 110.922 179.976 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 45.1 mt-30 -51.86 -50.41 60.99 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.2 -0.455 . . . . 64.34 110.949 179.875 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 11.3 t -67.29 -31.63 72.08 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.19 -0.459 . . . . 71.33 111.158 -179.953 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -56.6 -30.28 63.07 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.192 -0.458 . . . . 75.23 110.88 -179.958 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 1.2 m-85 -85.82 -44.29 12.59 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.157 -0.474 . . . . 75.21 110.974 -179.911 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 16.4 m-85 -62.39 -28.56 69.86 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.113 -0.494 . . . . 73.24 110.916 -179.919 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -54.7 -42.87 71.98 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.121 -0.49 . . . . 54.31 110.855 179.901 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 57.6 t -88.73 -25.84 5.7 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.192 -0.458 . . . . 72.42 111.122 -179.974 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 10.3 ttp -102.0 33.75 2.94 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.184 -0.462 . . . . 74.24 110.86 179.898 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 5.8 t -86.52 -3.89 59.09 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.234 -0.439 . . . . 32.45 111.136 -179.948 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 15' ' ' VAL . . . . . 0.686 ' C ' ' HG3' ' A' ' 19' ' ' PRO . 24.3 t -93.88 4.07 8.23 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.232 -0.44 . . . . 62.43 111.116 179.926 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 16' ' ' ILE . . . . . 0.453 HG22 ' O ' ' A' ' 16' ' ' ILE . 2.8 mp -142.44 3.4 0.4 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.188 -0.46 . . . . 54.04 111.143 179.911 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 17' ' ' SER . . . . . 0.806 ' C ' ' HD2' ' A' ' 19' ' ' PRO . 0.5 OUTLIER -100.2 -68.36 0.04 OUTLIER Pre-proline 0 C--N 1.329 -0.325 0 CA-C-O 121.642 0.734 . . . . 63.14 110.865 -179.88 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 18' ' ' PRO . . . . . 0.915 ' N ' ' HD2' ' A' ' 19' ' ' PRO . 53.5 Cg_endo -69.82 -27.88 25.62 Favored 'Trans proline' 0 C--N 1.341 0.158 0 C-N-CA 122.678 2.252 . . . . 61.33 112.323 179.985 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 19' ' ' PRO . . . . . 0.915 ' HD2' ' N ' ' A' ' 18' ' ' PRO . 53.9 Cg_endo -69.74 -16.82 37.81 Favored 'Trans proline' 0 C--N 1.341 0.168 0 C-N-CA 122.73 2.287 . . . . 70.44 112.323 179.929 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 29.4 tt0 -82.52 -21.29 35.46 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.243 -0.435 . . . . 74.12 110.887 -179.969 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -58.28 -31.34 67.37 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.144 -0.48 . . . . 61.42 110.842 -179.884 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.325 0 C-N-CA 120.716 -0.754 . . . . 63.13 112.52 -179.945 . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 1' ' ' TRP . . . . . . . . . . . . . 3.3 t90 . . . . . 0 C--O 1.231 0.121 0 CA-C-O 120.78 0.324 . . . . 74.25 110.885 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -97.0 160.61 28.7 Favored Pre-proline 0 C--N 1.329 -0.305 0 CA-C-O 121.609 0.719 . . . . 64.44 110.89 -179.976 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.73 88.02 0.54 Allowed 'Trans proline' 0 C--O 1.232 0.194 0 C-N-CA 122.726 2.284 . . . . 62.3 112.395 179.967 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -138.43 -66.6 0.48 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.206 -0.452 . . . . 71.43 110.876 -179.878 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 5' ' ' LEU . . . . . 0.414 ' O ' HD12 ' A' ' 5' ' ' LEU . 0.4 OUTLIER -77.86 -24.63 48.51 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.115 -0.493 . . . . 65.42 110.886 -179.966 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 6.8 mt-30 -53.68 -56.53 16.48 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.171 -0.468 . . . . 71.45 110.867 179.983 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 14.9 t -56.67 -27.21 58.3 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.184 -0.462 . . . . 65.2 111.162 -179.878 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -66.16 -16.41 63.95 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.207 -0.451 . . . . 74.24 110.871 179.999 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -101.08 -20.06 15.52 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.169 -0.469 . . . . 72.2 110.916 -179.853 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 3.6 m-85 -51.39 -36.7 44.65 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.14 -0.482 . . . . 74.42 110.905 -179.949 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 11.1 t0 -52.29 -31.41 32.72 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.127 -0.488 . . . . 64.22 110.878 179.932 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 60.8 t -102.42 -25.58 3.72 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.189 -0.46 . . . . 70.41 111.077 -179.946 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 10.4 ttp -102.2 34.27 2.79 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.193 -0.458 . . . . 62.12 110.895 179.923 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 5.6 t -86.85 -4.05 59.13 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.243 -0.435 . . . . 72.14 111.162 -179.964 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 15' ' ' VAL . . . . . 0.686 ' C ' ' HG3' ' A' ' 19' ' ' PRO . 24.6 t -93.0 3.45 8.18 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.217 -0.447 . . . . 61.23 111.09 179.93 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 16' ' ' ILE . . . . . 0.463 HG22 ' O ' ' A' ' 16' ' ' ILE . 2.8 mp -142.3 3.63 0.41 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 116.19 -0.459 . . . . 75.3 111.132 179.942 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 17' ' ' SER . . . . . 0.789 ' C ' ' HD2' ' A' ' 19' ' ' PRO . 0.5 OUTLIER -99.91 -68.8 0.04 OUTLIER Pre-proline 0 C--N 1.329 -0.326 0 CA-C-O 121.618 0.723 . . . . 63.12 110.869 -179.89 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 18' ' ' PRO . . . . . 0.918 ' N ' ' HD2' ' A' ' 19' ' ' PRO . 53.3 Cg_endo -69.77 -27.91 25.86 Favored 'Trans proline' 0 C--O 1.231 0.168 0 C-N-CA 122.738 2.292 . . . . 72.41 112.326 179.975 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 19' ' ' PRO . . . . . 0.918 ' HD2' ' N ' ' A' ' 18' ' ' PRO . 54.1 Cg_endo -69.76 -16.24 37.48 Favored 'Trans proline' 0 C--N 1.341 0.181 0 C-N-CA 122.715 2.276 . . . . 64.33 112.335 179.956 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 1.8 mt-10 -82.12 -19.74 39.45 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.221 -0.445 . . . . 72.23 110.891 -179.973 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -59.39 -25.6 64.41 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.167 -0.469 . . . . 75.2 110.88 -179.891 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.45 -0.368 0 C-N-CA 120.771 -0.728 . . . . 62.51 112.513 -179.985 . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 1' ' ' TRP . . . . . . . . . . . . . 49.3 m0 . . . . . 0 C--O 1.231 0.097 0 CA-C-O 120.779 0.323 . . . . 73.54 110.859 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 53.35 68.34 3.01 Favored Pre-proline 0 C--N 1.329 -0.305 0 CA-C-O 121.63 0.729 . . . . 72.11 110.897 -179.962 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.71 -172.23 0.55 Allowed 'Trans proline' 0 C--N 1.342 0.189 0 C-N-CA 122.692 2.261 . . . . 74.52 112.355 179.975 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 39.9 m-85 -135.28 -63.47 0.68 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.224 -0.444 . . . . 62.42 110.951 -179.906 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 5' ' ' LEU . . . . . 0.429 ' O ' HD12 ' A' ' 5' ' ' LEU . 0.3 OUTLIER -82.61 -24.43 33.87 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.094 -0.503 . . . . 63.14 110.935 179.943 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -56.58 -53.12 61.25 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.187 -0.461 . . . . 60.22 110.884 179.953 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 9.7 t -60.13 -33.51 72.24 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.198 -0.456 . . . . 71.24 111.163 -179.928 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -52.89 -29.26 27.31 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.18 -0.464 . . . . 61.14 110.877 -179.98 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 1.2 m-85 -94.85 -45.02 7.48 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.165 -0.471 . . . . 74.04 110.958 -179.879 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 24.4 m-85 -54.09 -33.74 58.4 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.101 -0.5 . . . . 74.04 110.924 -179.923 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -53.49 -34.61 58.69 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.114 -0.494 . . . . 72.13 110.862 179.951 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 47.5 t -85.06 -30.48 6.71 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.218 -0.446 . . . . 62.32 111.092 -179.965 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 10.4 ttp -102.01 33.9 2.89 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.163 -0.471 . . . . 73.14 110.92 179.903 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 5.6 t -86.71 -3.91 59.11 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.206 -0.452 . . . . 73.35 111.175 -179.913 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 15' ' ' VAL . . . . . 0.673 ' C ' ' HG3' ' A' ' 19' ' ' PRO . 24.7 t -93.04 3.44 8.21 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.194 -0.457 . . . . 74.1 111.155 179.866 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 16' ' ' ILE . . . . . 0.457 HG22 ' O ' ' A' ' 16' ' ' ILE . 2.8 mp -142.31 3.67 0.41 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.17 -0.468 . . . . 53.34 111.138 179.89 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 17' ' ' SER . . . . . 0.795 ' C ' ' HD2' ' A' ' 19' ' ' PRO . 0.5 OUTLIER -99.91 -68.78 0.04 OUTLIER Pre-proline 0 C--N 1.33 -0.274 0 CA-C-O 121.664 0.745 . . . . 74.22 110.848 -179.889 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 18' ' ' PRO . . . . . 0.913 ' N ' ' HD2' ' A' ' 19' ' ' PRO . 53.6 Cg_endo -69.75 -27.95 25.91 Favored 'Trans proline' 0 C--N 1.341 0.167 0 C-N-CA 122.752 2.301 . . . . 62.54 112.335 179.974 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 19' ' ' PRO . . . . . 0.913 ' HD2' ' N ' ' A' ' 18' ' ' PRO . 53.7 Cg_endo -69.81 -16.71 37.48 Favored 'Trans proline' 0 C--N 1.342 0.188 0 C-N-CA 122.66 2.24 . . . . 72.23 112.361 179.939 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 60.2 tt0 -82.63 -21.28 35.13 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.216 -0.447 . . . . 74.11 110.854 179.994 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -58.19 -34.24 70.15 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.223 -0.444 . . . . 74.45 110.83 -179.876 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.271 0 C-N-CA 120.754 -0.736 . . . . 61.42 112.465 -179.953 . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 1' ' ' TRP . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.231 0.109 0 CA-C-O 120.745 0.307 . . . . 72.32 110.936 . . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 5.4 tpt180 -166.19 73.15 1.22 Allowed Pre-proline 0 C--N 1.329 -0.303 0 CA-C-O 121.611 0.719 . . . . 73.31 110.916 -179.929 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.76 93.31 0.52 Allowed 'Trans proline' 0 C--O 1.232 0.202 0 C-N-CA 122.703 2.269 . . . . 75.32 112.324 -179.965 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 1.0 OUTLIER -83.33 -32.53 26.23 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.254 -0.43 . . . . 71.54 110.897 -179.923 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -105.02 -32.66 8.62 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.174 -0.466 . . . . 72.11 110.916 179.978 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -51.85 -43.19 63.1 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.207 -0.451 . . . . 73.34 110.919 179.932 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 12.5 t -85.44 -27.75 25.52 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.203 -0.453 . . . . 71.41 111.136 -179.929 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 2.5 tt0 -68.76 -33.3 73.66 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.238 -0.437 . . . . 75.42 110.885 -179.998 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 2.5 t80 -70.05 -36.33 74.91 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.159 -0.473 . . . . 73.31 110.898 -179.839 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 23.4 m-85 -63.17 -32.27 73.62 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.116 -0.493 . . . . 72.44 110.914 -179.916 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -56.17 -29.22 60.54 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.136 -0.484 . . . . 64.42 110.854 179.938 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 53.4 t -94.39 -29.52 4.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.223 -0.444 . . . . 51.0 111.135 180.0 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 10.5 ttp -101.68 33.22 3.06 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.171 -0.468 . . . . 72.25 110.9 179.887 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 5.7 t -85.92 -4.01 59.06 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.223 -0.444 . . . . 71.15 111.14 -179.94 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 15' ' ' VAL . . . . . 0.68 ' C ' ' HG3' ' A' ' 19' ' ' PRO . 24.5 t -93.78 4.77 7.76 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.229 -0.441 . . . . 73.12 111.13 179.966 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 16' ' ' ILE . . . . . 0.447 ' O ' HG22 ' A' ' 16' ' ' ILE . 9.7 mt -143.49 3.2 0.34 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.156 -0.474 . . . . 71.1 111.097 179.927 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 17' ' ' SER . . . . . 0.791 ' C ' ' HD2' ' A' ' 19' ' ' PRO . 0.5 OUTLIER -100.27 -68.42 0.04 OUTLIER Pre-proline 0 C--N 1.329 -0.291 0 CA-C-O 121.674 0.749 . . . . 73.35 110.839 -179.911 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 18' ' ' PRO . . . . . 0.912 ' N ' ' HD2' ' A' ' 19' ' ' PRO . 54.4 Cg_endo -69.71 -27.88 26.17 Favored 'Trans proline' 0 C--O 1.232 0.184 0 C-N-CA 122.683 2.255 . . . . 73.44 112.373 179.933 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 19' ' ' PRO . . . . . 0.912 ' HD2' ' N ' ' A' ' 18' ' ' PRO . 54.4 Cg_endo -69.72 -16.43 37.74 Favored 'Trans proline' 0 C--N 1.341 0.149 0 C-N-CA 122.693 2.262 . . . . 64.41 112.38 179.906 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 2.9 mt-10 -81.91 -19.92 39.83 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.194 -0.457 . . . . 74.31 110.901 -179.998 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -58.61 -34.4 71.09 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.127 -0.488 . . . . 73.23 110.914 -179.916 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.266 0 C-N-CA 120.766 -0.731 . . . . 45.15 112.472 -179.981 . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 1' ' ' TRP . . . . . . . . . . . . . 53.8 m0 . . . . . 0 C--O 1.231 0.096 0 CA-C-O 120.752 0.311 . . . . 75.44 110.934 . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 4.3 mpt_? 57.81 72.26 0.93 Allowed Pre-proline 0 C--N 1.33 -0.282 0 CA-C-O 121.559 0.695 . . . . 70.33 110.882 -179.927 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_endo -69.81 -171.0 0.43 Allowed 'Trans proline' 0 C--N 1.341 0.182 0 C-N-CA 122.655 2.237 . . . . 72.43 112.326 -179.996 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 4' ' ' TYR . . . . . 0.494 ' C ' HD23 ' A' ' 5' ' ' LEU . 6.3 m-85 66.21 121.64 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.178 -0.465 . . . . 74.14 110.931 -179.876 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 5' ' ' LEU . . . . . 0.494 HD23 ' C ' ' A' ' 4' ' ' TYR . 0.0 OUTLIER -152.34 -41.15 0.11 Allowed 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.138 -0.483 . . . . 64.41 110.929 179.97 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -49.94 -43.59 50.03 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.184 -0.462 . . . . 74.32 110.908 179.988 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 10.2 t -90.59 -30.88 16.94 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.214 -0.448 . . . . 61.42 111.13 -179.946 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 1.1 mt-10 -68.19 -20.6 64.87 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.196 -0.456 . . . . 54.21 110.875 -179.967 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 1.6 t80 -84.1 -38.28 20.96 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.139 -0.482 . . . . 65.41 110.923 -179.88 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 20.7 m-85 -56.6 -29.17 61.83 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.118 -0.492 . . . . 71.54 110.889 -179.901 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 2.6 m-20 -66.05 -43.69 86.73 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.14 -0.482 . . . . 64.03 110.865 179.919 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 26.0 t -78.62 -28.71 14.42 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.218 -0.446 . . . . 53.12 111.086 -179.97 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 10.6 ttp -101.93 33.43 3.04 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.215 -0.448 . . . . 64.31 110.894 179.901 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 5.5 t -86.12 -4.04 59.08 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.194 -0.457 . . . . 74.53 111.139 -179.94 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 15' ' ' VAL . . . . . 0.664 ' C ' ' HG3' ' A' ' 19' ' ' PRO . 25.8 t -92.89 4.15 7.66 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-N 116.228 -0.442 . . . . 52.3 111.113 179.901 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 16' ' ' ILE . . . . . 0.458 HG22 ' O ' ' A' ' 16' ' ' ILE . 9.3 mt -143.34 3.4 0.35 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.195 -0.457 . . . . 61.35 111.102 179.901 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 17' ' ' SER . . . . . 0.792 ' C ' ' HD2' ' A' ' 19' ' ' PRO . 0.5 OUTLIER -99.9 -68.75 0.04 OUTLIER Pre-proline 0 C--N 1.329 -0.295 0 CA-C-O 121.683 0.754 . . . . 73.44 110.882 -179.94 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 18' ' ' PRO . . . . . 0.93 ' N ' ' HD2' ' A' ' 19' ' ' PRO . 53.3 Cg_endo -69.83 -27.79 25.72 Favored 'Trans proline' 0 C--N 1.341 0.168 0 C-N-CA 122.673 2.248 . . . . 74.23 112.333 179.994 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 19' ' ' PRO . . . . . 0.93 ' HD2' ' N ' ' A' ' 18' ' ' PRO . 53.3 Cg_endo -69.82 -16.43 37.3 Favored 'Trans proline' 0 C--N 1.342 0.193 0 C-N-CA 122.683 2.255 . . . . 62.31 112.301 179.957 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -81.91 -19.55 40.57 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.267 -0.424 . . . . 73.51 110.872 -179.965 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -59.78 -25.77 65.18 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.144 -0.48 . . . . 71.52 110.827 -179.887 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.299 0 C-N-CA 120.75 -0.738 . . . . 55.11 112.527 -179.991 . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 1' ' ' TRP . . . . . . . . . . . . . 42.8 m0 . . . . . 0 C--O 1.232 0.137 0 CA-C-O 120.763 0.316 . . . . 74.25 110.925 . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 1.2 mpt_? -117.87 71.32 7.84 Favored Pre-proline 0 C--N 1.328 -0.339 0 CA-C-O 121.621 0.724 . . . . 75.22 110.884 -179.937 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_endo -69.77 136.69 33.6 Favored 'Trans proline' 0 C--O 1.232 0.191 0 C-N-CA 122.672 2.248 . . . . 74.03 112.326 -179.975 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 0.8 OUTLIER -116.78 -32.33 5.17 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.238 -0.437 . . . . 74.35 110.923 -179.911 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -103.93 -31.29 9.82 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.15 -0.477 . . . . 74.45 110.941 179.949 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -51.21 -43.99 61.53 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.167 -0.469 . . . . 62.24 110.934 179.914 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 14.2 t -81.45 -26.01 35.66 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.238 -0.437 . . . . 61.42 111.142 -179.959 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 29.5 tp10 -68.88 -43.5 75.21 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.217 -0.447 . . . . 74.44 110.918 179.993 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 2.3 t80 -59.36 -34.93 72.99 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.139 -0.482 . . . . 74.43 110.927 -179.884 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 22.0 m-85 -66.98 -26.77 66.97 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.141 -0.481 . . . . 64.53 110.933 -179.955 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 17.3 t0 -58.78 -34.09 71.06 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.138 -0.483 . . . . 74.24 110.86 179.911 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 56.4 t -90.5 -27.51 5.05 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.21 -0.45 . . . . 74.35 111.154 -179.998 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 10.4 ttp -102.23 33.7 3.0 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.117 -0.492 . . . . 74.12 110.883 179.931 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 5.8 t -86.49 -3.89 59.08 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.203 -0.453 . . . . 63.11 111.153 -179.912 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 15' ' ' VAL . . . . . 0.688 ' C ' ' HG3' ' A' ' 19' ' ' PRO . 24.0 t -93.88 4.07 8.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.186 -0.461 . . . . 64.22 111.131 179.928 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 16' ' ' ILE . . . . . 0.45 ' O ' HG22 ' A' ' 16' ' ' ILE . 2.8 mp -142.47 3.41 0.4 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.172 -0.467 . . . . 70.22 111.176 179.898 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 17' ' ' SER . . . . . 0.797 ' C ' ' HD2' ' A' ' 19' ' ' PRO . 0.5 OUTLIER -100.16 -68.48 0.04 OUTLIER Pre-proline 0 C--N 1.328 -0.33 0 CA-C-O 121.654 0.74 . . . . 73.21 110.877 -179.941 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 18' ' ' PRO . . . . . 0.914 ' N ' ' HD2' ' A' ' 19' ' ' PRO . 53.6 Cg_endo -69.74 -27.84 26.09 Favored 'Trans proline' 0 C--N 1.341 0.178 0 C-N-CA 122.701 2.268 . . . . 74.11 112.344 179.987 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 19' ' ' PRO . . . . . 0.914 ' HD2' ' N ' ' A' ' 18' ' ' PRO . 53.5 Cg_endo -69.77 -16.5 37.55 Favored 'Trans proline' 0 C--N 1.342 0.216 0 C-N-CA 122.685 2.257 . . . . 71.01 112.339 179.943 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -81.85 -19.85 40.16 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.222 -0.444 . . . . 71.34 110.908 179.999 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -58.65 -34.52 71.29 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.172 -0.467 . . . . 72.33 110.832 -179.9 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.352 0 C-N-CA 120.744 -0.741 . . . . 70.11 112.506 -179.946 . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 1' ' ' TRP . . . . . . . . . . . . . 44.4 m0 . . . . . 0 C--O 1.231 0.13 0 CA-C-O 120.799 0.333 . . . . 70.22 110.926 . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -55.1 160.55 3.1 Favored Pre-proline 0 C--N 1.329 -0.315 0 CA-C-O 121.59 0.709 . . . . 62.32 110.856 -179.919 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.71 95.48 0.55 Allowed 'Trans proline' 0 C--O 1.231 0.162 0 C-N-CA 122.729 2.286 . . . . 62.31 112.359 179.964 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 1.2 t80 -93.91 -32.6 13.83 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.245 -0.434 . . . . 75.42 110.927 -179.923 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -105.05 -32.7 8.59 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.117 -0.492 . . . . 74.34 110.871 179.999 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -51.88 -43.17 63.18 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.224 -0.443 . . . . 71.32 110.893 179.975 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 12.4 t -85.37 -27.84 25.58 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.196 -0.456 . . . . 72.33 111.137 -179.906 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 1.3 tt0 -68.73 -33.17 73.48 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.176 -0.465 . . . . 75.25 110.874 -179.966 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 2.5 t80 -70.26 -36.25 74.31 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.129 -0.487 . . . . 73.01 110.935 -179.841 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 23.4 m-85 -63.15 -28.18 69.88 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.121 -0.49 . . . . 74.44 110.873 -179.912 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 12.0 t0 -61.88 -47.42 85.08 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.128 -0.487 . . . . 75.33 110.906 179.917 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 21.9 t -76.25 -27.31 17.64 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-N 116.181 -0.463 . . . . 53.04 111.149 179.981 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 10.5 ttp -102.21 33.85 2.94 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.182 -0.463 . . . . 41.34 110.856 179.939 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 5.6 t -86.62 -3.98 59.11 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.23 -0.441 . . . . 71.2 111.145 -179.939 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 15' ' ' VAL . . . . . 0.68 ' C ' ' HG3' ' A' ' 19' ' ' PRO . 25.3 t -93.01 3.47 8.17 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.201 -0.454 . . . . 41.41 111.143 179.912 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 16' ' ' ILE . . . . . 0.464 ' O ' HG22 ' A' ' 16' ' ' ILE . 2.8 mp -142.39 3.68 0.41 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.139 -0.482 . . . . 73.13 111.127 179.913 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 17' ' ' SER . . . . . 0.798 ' C ' ' HD2' ' A' ' 19' ' ' PRO . 0.5 OUTLIER -99.9 -68.78 0.04 OUTLIER Pre-proline 0 C--N 1.329 -0.287 0 CA-C-O 121.678 0.751 . . . . 61.21 110.831 -179.906 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 18' ' ' PRO . . . . . 0.926 ' N ' ' HD2' ' A' ' 19' ' ' PRO . 54.0 Cg_endo -69.78 -27.88 25.86 Favored 'Trans proline' 0 C--O 1.232 0.182 0 C-N-CA 122.664 2.243 . . . . 41.33 112.361 179.982 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 19' ' ' PRO . . . . . 0.926 ' HD2' ' N ' ' A' ' 18' ' ' PRO . 53.6 Cg_endo -69.82 -16.38 37.3 Favored 'Trans proline' 0 C--N 1.341 0.155 0 C-N-CA 122.713 2.275 . . . . 72.13 112.322 179.964 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -82.01 -19.85 39.63 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.248 -0.433 . . . . 75.32 110.868 -179.977 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -58.66 -34.36 71.14 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.12 -0.491 . . . . 74.44 110.832 -179.88 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.45 -0.367 0 C-N-CA 120.696 -0.764 . . . . 45.24 112.529 -179.97 . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 1' ' ' TRP . . . . . . . . . . . . . 54.4 m0 . . . . . 0 C--O 1.231 0.122 0 CA-C-O 120.73 0.3 . . . . 74.23 110.959 . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -87.45 160.55 47.81 Favored Pre-proline 0 C--N 1.329 -0.307 0 CA-C-O 121.655 0.741 . . . . 73.34 110.856 -179.964 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.73 120.2 7.03 Favored 'Trans proline' 0 C--N 1.342 0.214 0 C-N-CA 122.677 2.251 . . . . 54.31 112.328 -179.985 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -101.98 -32.57 10.12 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.157 -0.474 . . . . 74.0 110.914 -179.909 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -104.98 -32.72 8.61 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.143 -0.48 . . . . 64.21 110.921 179.953 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -51.86 -43.16 63.12 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.182 -0.463 . . . . 70.43 110.925 179.946 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 12.5 t -85.39 -27.94 25.48 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.196 -0.456 . . . . 55.15 111.142 -179.921 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -68.5 -33.86 74.88 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.197 -0.456 . . . . 74.22 110.923 179.974 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 2.5 t80 -69.41 -36.37 76.65 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.144 -0.48 . . . . 74.51 110.968 -179.918 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 23.3 m-85 -63.27 -30.33 71.49 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.129 -0.487 . . . . 74.31 110.969 -179.952 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 4.7 t70 -56.47 -40.2 74.47 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.124 -0.489 . . . . 73.22 110.88 179.909 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 25.9 t -84.04 -27.9 7.25 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.186 -0.461 . . . . 74.15 111.127 179.996 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 10.5 ttp -102.22 33.93 2.92 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.146 -0.479 . . . . 75.14 110.878 179.959 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 5.7 t -86.7 -3.91 59.11 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.213 -0.449 . . . . 71.11 111.118 -179.897 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 15' ' ' VAL . . . . . 0.683 ' C ' ' HG3' ' A' ' 19' ' ' PRO . 25.1 t -93.06 3.48 8.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.233 -0.44 . . . . 71.15 111.171 179.884 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 16' ' ' ILE . . . . . 0.462 ' O ' HG22 ' A' ' 16' ' ' ILE . 2.8 mp -142.36 3.63 0.41 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.108 -0.497 . . . . 63.32 111.128 179.912 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 17' ' ' SER . . . . . 0.79 ' C ' ' HD2' ' A' ' 19' ' ' PRO . 0.5 OUTLIER -99.89 -68.8 0.04 OUTLIER Pre-proline 0 C--N 1.329 -0.287 0 CA-C-O 121.631 0.729 . . . . 71.22 110.874 -179.914 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 18' ' ' PRO . . . . . 0.918 ' N ' ' HD2' ' A' ' 19' ' ' PRO . 53.9 Cg_endo -69.75 -27.88 25.99 Favored 'Trans proline' 0 C--N 1.341 0.175 0 C-N-CA 122.672 2.248 . . . . 73.51 112.387 179.952 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 19' ' ' PRO . . . . . 0.918 ' HD2' ' N ' ' A' ' 18' ' ' PRO . 53.4 Cg_endo -69.79 -16.43 37.44 Favored 'Trans proline' 0 C--N 1.342 0.203 0 C-N-CA 122.686 2.258 . . . . 43.13 112.323 179.97 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -81.95 -19.83 39.85 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.228 -0.442 . . . . 72.14 110.893 -179.991 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -58.65 -32.52 69.15 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.145 -0.479 . . . . 74.22 110.904 -179.919 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.312 0 C-N-CA 120.771 -0.728 . . . . 73.25 112.494 -179.94 . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 1' ' ' TRP . . . . . . . . . . . . . 2.5 t90 . . . . . 0 C--O 1.231 0.121 0 CA-C-O 120.752 0.31 . . . . 74.13 110.948 . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 2.0 mpp_? -113.75 73.85 2.3 Favored Pre-proline 0 C--N 1.329 -0.326 0 CA-C-O 121.611 0.72 . . . . 74.33 110.865 -179.924 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.74 -172.18 0.55 Allowed 'Trans proline' 0 C--N 1.341 0.184 0 C-N-CA 122.681 2.254 . . . . 70.01 112.344 179.99 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 4' ' ' TYR . . . . . 0.498 ' C ' HD23 ' A' ' 5' ' ' LEU . 9.9 m-85 66.16 121.23 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.173 -0.467 . . . . 74.11 110.946 -179.901 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 5' ' ' LEU . . . . . 0.498 HD23 ' C ' ' A' ' 4' ' ' TYR . 0.0 OUTLIER -152.69 -41.19 0.1 Allowed 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.141 -0.482 . . . . 75.03 110.923 179.975 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -49.84 -43.79 49.11 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.192 -0.458 . . . . 73.01 110.929 179.935 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 10.2 t -90.39 -30.81 17.16 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.222 -0.445 . . . . 74.13 111.152 -179.958 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 1.6 mm-40 -68.13 -20.53 64.91 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.251 -0.431 . . . . 71.33 110.875 -179.996 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 1.6 t80 -84.29 -38.21 20.72 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.153 -0.476 . . . . 65.5 110.89 -179.823 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 20.9 m-85 -56.82 -34.77 68.05 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.148 -0.478 . . . . 72.31 110.89 -179.879 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 41.0 m-20 -59.84 -47.93 83.74 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.122 -0.49 . . . . 61.11 110.843 179.958 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 39.7 t -77.05 -28.19 16.64 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 116.184 -0.462 . . . . 73.21 111.139 179.972 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 10.4 ttp -102.0 33.98 2.86 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.174 -0.466 . . . . 42.24 110.871 179.939 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 5.8 t -86.64 -3.87 59.09 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.258 -0.428 . . . . 53.44 111.108 -179.896 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 15' ' ' VAL . . . . . 0.683 ' C ' ' HG3' ' A' ' 19' ' ' PRO . 24.7 t -93.77 3.97 8.23 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.23 -0.441 . . . . 75.22 111.141 179.885 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 16' ' ' ILE . . . . . 0.463 HG22 ' O ' ' A' ' 16' ' ' ILE . 2.8 mp -142.52 3.49 0.4 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.183 -0.462 . . . . 73.13 111.099 179.922 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 17' ' ' SER . . . . . 0.794 ' C ' ' HD2' ' A' ' 19' ' ' PRO . 0.5 OUTLIER -100.25 -68.42 0.04 OUTLIER Pre-proline 0 C--N 1.329 -0.305 0 CA-C-O 121.656 0.741 . . . . 64.01 110.85 -179.923 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 18' ' ' PRO . . . . . 0.929 ' N ' ' HD2' ' A' ' 19' ' ' PRO . 53.7 Cg_endo -69.76 -27.81 26.01 Favored 'Trans proline' 0 C--N 1.342 0.199 0 C-N-CA 122.612 2.208 . . . . 61.1 112.363 179.97 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 19' ' ' PRO . . . . . 0.929 ' HD2' ' N ' ' A' ' 18' ' ' PRO . 53.8 Cg_endo -69.74 -16.52 37.68 Favored 'Trans proline' 0 C--N 1.341 0.156 0 C-N-CA 122.699 2.266 . . . . 74.45 112.326 179.948 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 2.1 mt-10 -81.88 -19.94 39.86 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.216 -0.447 . . . . 52.41 110.907 -179.975 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -58.56 -33.13 69.59 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.145 -0.479 . . . . 73.2 110.858 -179.908 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.286 0 C-N-CA 120.725 -0.75 . . . . 15.15 112.489 -179.964 . . . . . . . . 0 0 . 1 . 021 nuclear build full ' A' A ' 1' ' ' TRP . . . . . . . . . . . . . 54.5 m0 . . . . . 0 C--O 1.23 0.071 0 CA-C-O 120.736 0.303 . . . . 70.51 110.925 . . . . . . . . . 0 0 . 1 . 021 nuclear build full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 13.1 mmm180 -121.64 70.89 26.86 Favored Pre-proline 0 C--N 1.329 -0.298 0 CA-C-O 121.658 0.742 . . . . 73.22 110.865 -179.941 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_endo -69.74 172.03 13.37 Favored 'Trans proline' 0 C--N 1.342 0.196 0 C-N-CA 122.704 2.27 . . . . 72.44 112.393 179.969 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 4' ' ' TYR . . . . . 0.604 ' C ' HD23 ' A' ' 5' ' ' LEU . 13.0 p90 -166.74 123.27 1.23 Allowed 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.229 -0.441 . . . . 61.25 110.932 -179.883 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 5' ' ' LEU . . . . . 0.604 HD23 ' C ' ' A' ' 4' ' ' TYR . 0.0 OUTLIER -158.0 -40.84 0.06 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.112 -0.495 . . . . 60.44 110.897 179.967 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -50.37 -47.87 56.02 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.189 -0.459 . . . . 75.14 110.904 179.966 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 14.4 t -76.41 -23.37 54.02 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.189 -0.459 . . . . 73.24 111.176 -179.95 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 11.5 tt0 -79.97 -20.11 46.3 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.192 -0.458 . . . . 74.51 110.884 179.983 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 1.4 t80 -87.13 -30.43 21.08 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.161 -0.472 . . . . 75.04 110.929 -179.88 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 22.5 m-85 -65.35 -32.89 74.76 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.136 -0.484 . . . . 74.34 110.94 -179.941 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -57.94 -36.92 73.21 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.113 -0.494 . . . . 72.42 110.885 179.914 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 56.4 t -77.77 -33.02 18.37 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.146 -0.479 . . . . 73.34 111.146 -179.983 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 10.6 ttp -101.91 33.43 3.03 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.124 -0.489 . . . . 62.23 110.906 179.906 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 5.5 t -86.15 -4.04 59.08 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.178 -0.465 . . . . 52.02 111.099 -179.908 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 15' ' ' VAL . . . . . 0.666 ' C ' ' HG3' ' A' ' 19' ' ' PRO . 25.5 t -92.91 4.11 7.7 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.262 -0.426 . . . . 55.21 111.095 179.948 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 16' ' ' ILE . . . . . 0.449 HG22 ' O ' ' A' ' 16' ' ' ILE . 9.4 mt -143.28 3.37 0.35 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.196 -0.456 . . . . 65.12 111.172 179.913 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 17' ' ' SER . . . . . 0.791 ' C ' ' HD2' ' A' ' 19' ' ' PRO . 0.5 OUTLIER -99.98 -68.78 0.04 OUTLIER Pre-proline 0 C--N 1.33 -0.274 0 CA-C-O 121.633 0.73 . . . . 74.33 110.825 -179.843 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 18' ' ' PRO . . . . . 0.925 ' N ' ' HD2' ' A' ' 19' ' ' PRO . 53.6 Cg_endo -69.79 -27.83 25.87 Favored 'Trans proline' 0 C--O 1.231 0.171 0 C-N-CA 122.72 2.28 . . . . 61.33 112.339 179.96 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 19' ' ' PRO . . . . . 0.925 ' HD2' ' N ' ' A' ' 18' ' ' PRO . 53.9 Cg_endo -69.75 -16.47 37.61 Favored 'Trans proline' 0 C--N 1.341 0.137 0 C-N-CA 122.697 2.265 . . . . 75.23 112.341 179.917 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -82.0 -19.39 40.6 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.249 -0.432 . . . . 73.44 110.866 -179.952 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -59.69 -25.7 64.98 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.168 -0.469 . . . . 74.31 110.866 -179.936 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.315 0 C-N-CA 120.718 -0.753 . . . . 53.24 112.502 -179.983 . . . . . . . . 0 0 . 1 . 022 nuclear build full ' A' A ' 1' ' ' TRP . . . . . . . . . . . . . 37.1 m0 . . . . . 0 C--O 1.231 0.124 0 CA-C-O 120.772 0.32 . . . . 72.42 110.936 . . . . . . . . . 0 0 . 1 . 022 nuclear build full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 6.1 mtt85 54.31 73.3 0.92 Allowed Pre-proline 0 C--N 1.329 -0.283 0 CA-C-O 121.606 0.717 . . . . 71.14 110.919 -179.924 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_endo -69.74 -172.59 0.59 Allowed 'Trans proline' 0 C--N 1.341 0.167 0 C-N-CA 122.712 2.274 . . . . 44.34 112.322 -179.948 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 4' ' ' TYR . . . . . 0.495 ' C ' HD23 ' A' ' 5' ' ' LEU . 84.7 m-85 -151.78 119.77 6.23 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.207 -0.451 . . . . 72.13 110.939 -179.917 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 5' ' ' LEU . . . . . 0.495 HD23 ' C ' ' A' ' 4' ' ' TYR . 0.0 OUTLIER -151.53 -40.88 0.12 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.155 -0.475 . . . . 71.31 110.932 179.964 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -49.52 -43.91 45.98 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.174 -0.466 . . . . 71.1 110.954 179.895 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 7' ' ' THR . . . . . 0.477 HG23 ' OE1' ' A' ' 8' ' ' GLU . 9.9 t -90.49 -31.0 16.96 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.19 -0.459 . . . . 71.21 111.178 -179.984 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 8' ' ' GLU . . . . . 0.477 ' OE1' HG23 ' A' ' 7' ' ' THR . 0.4 OUTLIER -68.08 -19.55 64.87 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.22 -0.445 . . . . 64.12 110.888 179.977 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 1.7 t80 -85.46 -38.21 18.88 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.148 -0.478 . . . . 73.11 110.899 -179.843 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 20.8 m-85 -56.65 -30.82 63.76 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.138 -0.483 . . . . 61.13 110.927 -179.925 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 37.4 m-20 -63.58 -46.15 87.17 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.163 -0.472 . . . . 73.41 110.854 179.913 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 37.7 t -79.61 -26.92 12.59 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-N 116.193 -0.458 . . . . 60.32 111.145 179.999 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 10.4 ttp -102.11 33.91 2.9 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.186 -0.461 . . . . 70.13 110.868 179.944 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 5.6 t -86.65 -3.94 59.11 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.224 -0.443 . . . . 71.25 111.156 -179.922 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 15' ' ' VAL . . . . . 0.678 ' C ' ' HG3' ' A' ' 19' ' ' PRO . 25.2 t -93.01 3.45 8.18 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-N 116.206 -0.452 . . . . 72.41 111.147 179.912 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 16' ' ' ILE . . . . . 0.464 HG22 ' O ' ' A' ' 16' ' ' ILE . 2.8 mp -142.35 3.61 0.41 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.161 -0.472 . . . . 73.31 111.159 179.964 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 17' ' ' SER . . . . . 0.781 ' C ' ' HD2' ' A' ' 19' ' ' PRO . 0.5 OUTLIER -99.92 -68.74 0.04 OUTLIER Pre-proline 0 C--N 1.329 -0.302 0 CA-C-O 121.673 0.749 . . . . 52.11 110.885 -179.882 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 18' ' ' PRO . . . . . 0.929 ' N ' ' HD2' ' A' ' 19' ' ' PRO . 53.4 Cg_endo -69.85 -27.88 25.51 Favored 'Trans proline' 0 C--O 1.232 0.188 0 C-N-CA 122.681 2.254 . . . . 73.31 112.345 179.965 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 19' ' ' PRO . . . . . 0.929 ' HD2' ' N ' ' A' ' 18' ' ' PRO . 54.1 Cg_endo -69.68 -16.47 37.91 Favored 'Trans proline' 0 C--N 1.341 0.169 0 C-N-CA 122.693 2.262 . . . . 74.53 112.377 179.871 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -82.03 -19.45 40.36 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.215 -0.448 . . . . 50.01 110.907 -179.957 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -59.63 -25.74 64.92 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.182 -0.463 . . . . 72.23 110.892 -179.988 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.307 0 C-N-CA 120.75 -0.738 . . . . 65.42 112.486 -179.932 . . . . . . . . 0 0 . 1 . 023 nuclear build full ' A' A ' 1' ' ' TRP . . . . . . . . . . . . . 2.2 t90 . . . . . 0 C--O 1.231 0.118 0 CA-C-O 120.775 0.321 . . . . 74.23 110.945 . . . . . . . . . 0 0 . 1 . 023 nuclear build full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 12.4 tpt180 53.22 73.6 0.91 Allowed Pre-proline 0 C--N 1.329 -0.291 0 CA-C-O 121.558 0.694 . . . . 74.2 110.866 -179.925 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.82 -17.01 37.54 Favored 'Trans proline' 0 C--N 1.341 0.158 0 C-N-CA 122.654 2.236 . . . . 71.14 112.356 179.983 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 4' ' ' TYR . . . . . 0.419 ' C ' HD23 ' A' ' 5' ' ' LEU . 20.7 m-85 66.52 125.52 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.217 -0.447 . . . . 61.21 110.94 -179.953 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 5' ' ' LEU . . . . . 0.419 HD23 ' C ' ' A' ' 4' ' ' TYR . 0.0 OUTLIER -151.37 -41.98 0.12 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.118 -0.492 . . . . 72.41 110.908 179.972 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 4.0 tt0 -51.27 -48.06 62.32 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.182 -0.463 . . . . 75.23 110.907 179.912 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 14.4 t -76.94 -23.98 52.4 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.202 -0.453 . . . . 74.12 111.089 -179.881 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 14.4 tt0 -79.15 -19.92 49.81 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.255 -0.43 . . . . 72.51 110.9 179.989 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 1.2 t80 -87.27 -31.09 20.42 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.181 -0.463 . . . . 72.51 110.92 -179.844 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 22.7 m-85 -64.61 -29.33 70.35 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.141 -0.481 . . . . 72.51 110.899 -179.904 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 16.1 m-20 -61.12 -38.49 86.54 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.091 -0.504 . . . . 61.44 110.889 179.901 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 41.9 t -77.08 -31.39 18.48 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.181 -0.463 . . . . 75.21 111.141 179.986 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 10.5 ttp -101.95 33.39 3.06 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.185 -0.461 . . . . 72.43 110.91 179.873 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 5.5 t -86.17 -4.02 59.08 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.214 -0.448 . . . . 65.2 111.139 -179.925 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 15' ' ' VAL . . . . . 0.665 ' C ' ' HG3' ' A' ' 19' ' ' PRO . 25.4 t -92.85 4.15 7.63 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.208 -0.451 . . . . 71.31 111.167 179.87 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 16' ' ' ILE . . . . . 0.456 HG22 ' O ' ' A' ' 16' ' ' ILE . 9.4 mt -143.33 3.32 0.35 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.18 -0.463 . . . . 71.22 111.121 179.927 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 17' ' ' SER . . . . . 0.8 ' C ' ' HD2' ' A' ' 19' ' ' PRO . 0.5 OUTLIER -99.89 -68.72 0.04 OUTLIER Pre-proline 0 C--N 1.329 -0.31 0 CA-C-O 121.624 0.726 . . . . 62.53 110.882 -179.943 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 18' ' ' PRO . . . . . 0.93 ' N ' ' HD2' ' A' ' 19' ' ' PRO . 53.2 Cg_endo -69.8 -27.86 25.76 Favored 'Trans proline' 0 C--O 1.232 0.178 0 C-N-CA 122.681 2.254 . . . . 75.15 112.32 -179.996 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 19' ' ' PRO . . . . . 0.93 ' HD2' ' N ' ' A' ' 18' ' ' PRO . 54.1 Cg_endo -69.73 -16.49 37.71 Favored 'Trans proline' 0 C--N 1.342 0.203 0 C-N-CA 122.732 2.288 . . . . 40.33 112.346 179.964 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -81.87 -19.92 39.94 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.195 -0.457 . . . . 55.32 110.902 -179.97 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -58.52 -33.37 69.77 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.129 -0.487 . . . . 63.43 110.871 -179.913 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.337 0 C-N-CA 120.782 -0.723 . . . . 72.22 112.49 -179.943 . . . . . . . . 0 0 . 1 . 024 nuclear build full ' A' A ' 1' ' ' TRP . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.231 0.124 0 CA-C-O 120.734 0.302 . . . . 75.31 110.93 . . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 2' ' ' ARG . . . . . 0.791 ' HB2' HD21 ' A' ' 5' ' ' LEU . 0.0 OUTLIER -159.22 68.04 3.17 Favored Pre-proline 0 C--N 1.328 -0.349 0 CA-C-O 121.652 0.739 . . . . 65.21 110.926 -179.967 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.8 -32.7 17.88 Favored 'Trans proline' 0 C--N 1.342 0.196 0 C-N-CA 122.706 2.271 . . . . 64.41 112.353 -179.972 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 4' ' ' TYR . . . . . 0.622 ' C ' HD23 ' A' ' 5' ' ' LEU . 15.3 p90 -162.64 124.1 2.58 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.183 -0.462 . . . . 73.25 110.941 -179.93 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 5' ' ' LEU . . . . . 0.791 HD21 ' HB2' ' A' ' 2' ' ' ARG . 0.0 OUTLIER -157.2 -40.66 0.07 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.102 -0.499 . . . . 70.44 110.893 179.969 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -50.21 -43.01 52.47 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.162 -0.472 . . . . 71.12 110.957 179.911 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 9.8 t -91.36 -30.57 16.47 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.19 -0.459 . . . . 71.24 111.116 -179.89 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 4.4 mm-40 -68.47 -21.2 64.64 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.208 -0.451 . . . . 71.32 110.921 179.981 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 1.6 t80 -83.22 -38.48 22.2 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.146 -0.479 . . . . 75.12 110.909 -179.869 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 20.4 m-85 -56.09 -30.72 62.44 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.168 -0.469 . . . . 71.02 110.955 -179.952 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -65.07 -40.16 94.28 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.146 -0.479 . . . . 73.4 110.864 179.904 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 38.4 t -82.47 -28.24 8.8 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.24 -0.436 . . . . 63.33 111.163 179.99 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 10.4 ttp -102.0 33.84 2.9 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.18 -0.464 . . . . 74.34 110.861 179.902 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 5.8 t -86.52 -3.89 59.09 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.225 -0.443 . . . . 73.12 111.211 -179.986 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 15' ' ' VAL . . . . . 0.675 ' C ' ' HG3' ' A' ' 19' ' ' PRO . 24.1 t -93.85 4.04 8.24 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.183 -0.462 . . . . 70.12 111.1 179.933 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 16' ' ' ILE . . . . . 0.46 HG22 ' O ' ' A' ' 16' ' ' ILE . 2.8 mp -142.52 3.43 0.4 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-N 116.168 -0.469 . . . . 75.22 111.153 179.94 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 17' ' ' SER . . . . . 0.791 ' C ' ' HD2' ' A' ' 19' ' ' PRO . 0.5 OUTLIER -100.19 -68.42 0.04 OUTLIER Pre-proline 0 C--N 1.329 -0.307 0 CA-C-O 121.615 0.721 . . . . 53.4 110.85 -179.951 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 18' ' ' PRO . . . . . 0.919 ' N ' ' HD2' ' A' ' 19' ' ' PRO . 53.9 Cg_endo -69.77 -27.81 25.97 Favored 'Trans proline' 0 C--O 1.232 0.19 0 C-N-CA 122.624 2.216 . . . . 45.0 112.352 179.975 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 19' ' ' PRO . . . . . 0.919 ' HD2' ' N ' ' A' ' 18' ' ' PRO . 53.8 Cg_endo -69.77 -16.49 37.54 Favored 'Trans proline' 0 C--N 1.341 0.166 0 C-N-CA 122.714 2.276 . . . . 71.31 112.334 179.975 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -81.88 -19.9 39.97 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.203 -0.453 . . . . 70.43 110.889 -179.987 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -58.67 -34.71 71.54 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.168 -0.469 . . . . 74.05 110.855 -179.875 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.302 0 C-N-CA 120.696 -0.764 . . . . 62.42 112.485 179.984 . . . . . . . . 0 0 . 1 . 025 nuclear build full ' A' A ' 1' ' ' TRP . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.231 0.113 0 CA-C-O 120.744 0.307 . . . . 63.34 110.944 . . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -53.58 160.56 1.9 Allowed Pre-proline 0 C--N 1.328 -0.337 0 CA-C-O 121.612 0.72 . . . . 75.32 110.877 -179.942 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.74 106.71 1.71 Allowed 'Trans proline' 0 C--N 1.341 0.163 0 C-N-CA 122.676 2.251 . . . . 61.43 112.332 -179.983 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -179.45 -34.76 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.227 -0.442 . . . . 75.25 110.943 -179.884 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -103.56 -33.53 8.98 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.111 -0.495 . . . . 70.42 110.89 179.958 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -51.83 -43.43 63.16 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.208 -0.451 . . . . 73.14 110.893 179.941 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 13.5 t -84.51 -27.4 27.43 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.253 -0.43 . . . . 63.32 111.119 -179.916 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -69.27 -33.89 73.91 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.191 -0.459 . . . . 62.23 110.916 -179.978 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 2.4 t80 -69.56 -35.84 75.78 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.138 -0.483 . . . . 65.41 110.946 -179.887 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 23.1 m-85 -63.72 -30.71 71.78 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.142 -0.481 . . . . 71.51 110.899 -179.926 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -67.04 -35.07 79.06 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.097 -0.501 . . . . 64.12 110.86 179.948 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 36.1 t -85.78 -29.56 6.27 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.2 -0.455 . . . . 72.33 111.128 179.985 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 10.5 ttp -102.46 33.89 2.98 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.187 -0.461 . . . . 64.11 110.862 179.916 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 5.6 t -86.68 -3.97 59.11 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.262 -0.426 . . . . 73.34 111.145 -179.925 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 15' ' ' VAL . . . . . 0.685 ' C ' ' HG3' ' A' ' 19' ' ' PRO . 25.1 t -93.03 3.47 8.18 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-N 116.221 -0.445 . . . . 75.31 111.122 179.895 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 16' ' ' ILE . . . . . 0.463 ' O ' HG22 ' A' ' 16' ' ' ILE . 2.8 mp -142.36 3.72 0.41 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.184 -0.462 . . . . 72.32 111.132 179.865 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 17' ' ' SER . . . . . 0.801 ' C ' ' HD2' ' A' ' 19' ' ' PRO . 0.5 OUTLIER -99.93 -68.82 0.04 OUTLIER Pre-proline 0 C--N 1.329 -0.294 0 CA-C-O 121.697 0.761 . . . . 73.45 110.83 -179.897 . . . . . . . . 3 3 . 1 . 025 nuclear build full ' A' A ' 18' ' ' PRO . . . . . 0.924 ' N ' ' HD2' ' A' ' 19' ' ' PRO . 54.2 Cg_endo -69.7 -27.94 26.14 Favored 'Trans proline' 0 C--O 1.232 0.181 0 C-N-CA 122.7 2.267 . . . . 73.14 112.358 179.954 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 19' ' ' PRO . . . . . 0.924 ' HD2' ' N ' ' A' ' 18' ' ' PRO . 53.5 Cg_endo -69.77 -16.43 37.51 Favored 'Trans proline' 0 C--N 1.342 0.213 0 C-N-CA 122.664 2.243 . . . . 73.21 112.38 179.961 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -81.93 -19.86 39.87 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.171 -0.468 . . . . 74.13 110.911 179.977 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -58.6 -33.16 69.68 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.131 -0.486 . . . . 74.34 110.876 -179.92 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.279 0 C-N-CA 120.74 -0.743 . . . . 72.12 112.46 -179.947 . . . . . . . . 0 0 . 1 . 026 nuclear build full ' A' A ' 1' ' ' TRP . . . . . . . . . . . . . 37.9 m0 . . . . . 0 C--O 1.231 0.131 0 CA-C-O 120.712 0.292 . . . . 72.12 110.931 . . . . . . . . . 0 0 . 1 . 026 nuclear build full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 1.2 mmt-85 52.71 70.04 2.06 Favored Pre-proline 0 C--N 1.328 -0.334 0 CA-C-O 121.615 0.721 . . . . 70.32 110.858 -179.977 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_endo -69.82 89.25 0.53 Allowed 'Trans proline' 0 C--O 1.232 0.189 0 C-N-CA 122.656 2.237 . . . . 74.55 112.32 -179.935 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 4' ' ' TYR . . . . . 0.482 ' C ' HD23 ' A' ' 5' ' ' LEU . 84.5 m-85 -151.8 119.78 6.23 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.236 -0.438 . . . . 75.34 110.916 -179.911 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 5' ' ' LEU . . . . . 0.482 HD23 ' C ' ' A' ' 4' ' ' TYR . 0.0 OUTLIER -151.24 -40.83 0.12 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.118 -0.492 . . . . 71.43 110.882 179.926 . . . . . . . . 3 3 . 1 . 026 nuclear build full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 5.8 tp-100 -49.53 -43.9 46.06 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.234 -0.439 . . . . 74.41 110.925 179.949 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 9.9 t -90.56 -31.02 16.88 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.167 -0.469 . . . . 70.51 111.104 -179.905 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -68.03 -19.65 64.92 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.264 -0.425 . . . . 75.2 110.896 179.998 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 1.7 t80 -85.43 -38.22 18.91 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.149 -0.478 . . . . 64.41 110.911 -179.821 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 20.8 m-85 -56.49 -31.47 64.09 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.167 -0.47 . . . . 73.11 110.878 -179.935 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -56.61 -31.69 64.55 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.114 -0.494 . . . . 64.51 110.899 179.976 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 61.5 t -90.88 -28.54 4.85 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.158 -0.474 . . . . 73.4 111.115 -179.985 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 10.6 ttp -102.06 33.4 3.07 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.152 -0.476 . . . . 72.44 110.862 179.932 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 5.6 t -86.17 -3.99 59.08 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.23 -0.441 . . . . 71.42 111.148 -179.937 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 15' ' ' VAL . . . . . 0.666 ' C ' ' HG3' ' A' ' 19' ' ' PRO . 25.3 t -92.89 4.12 7.68 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-N 116.221 -0.445 . . . . 63.42 111.158 179.853 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 16' ' ' ILE . . . . . 0.454 HG22 ' O ' ' A' ' 16' ' ' ILE . 9.6 mt -143.29 3.34 0.35 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.206 -0.452 . . . . 74.11 111.153 179.898 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 17' ' ' SER . . . . . 0.79 ' C ' ' HD2' ' A' ' 19' ' ' PRO . 0.5 OUTLIER -99.82 -68.77 0.04 OUTLIER Pre-proline 0 C--N 1.33 -0.277 0 CA-C-O 121.694 0.759 . . . . 72.3 110.849 -179.929 . . . . . . . . 3 3 . 1 . 026 nuclear build full ' A' A ' 18' ' ' PRO . . . . . 0.909 ' N ' ' HD2' ' A' ' 19' ' ' PRO . 53.7 Cg_endo -69.77 -27.93 25.82 Favored 'Trans proline' 0 C--N 1.342 0.185 0 C-N-CA 122.66 2.24 . . . . 55.44 112.337 -179.992 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 19' ' ' PRO . . . . . 0.909 ' HD2' ' N ' ' A' ' 18' ' ' PRO . 54.1 Cg_endo -69.75 -16.8 37.77 Favored 'Trans proline' 0 C--N 1.341 0.184 0 C-N-CA 122.643 2.229 . . . . 74.52 112.354 179.937 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 21.3 tt0 -82.5 -21.29 35.53 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.222 -0.445 . . . . 72.5 110.903 179.981 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -58.27 -33.21 69.17 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.201 -0.454 . . . . 74.55 110.854 -179.913 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.317 0 C-N-CA 120.693 -0.765 . . . . 72.22 112.527 -179.953 . . . . . . . . 0 0 . 1 . 027 nuclear build full ' A' A ' 1' ' ' TRP . . . . . . . . . . . . . 45.8 m0 . . . . . 0 C--O 1.231 0.09 0 CA-C-O 120.742 0.306 . . . . 71.45 110.915 . . . . . . . . . 0 0 . 1 . 027 nuclear build full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 3.0 mmt85 -119.13 73.35 13.25 Favored Pre-proline 0 C--N 1.329 -0.321 0 CA-C-O 121.583 0.706 . . . . 75.32 110.909 -179.955 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.75 114.27 3.65 Favored 'Trans proline' 0 C--N 1.342 0.216 0 C-N-CA 122.665 2.244 . . . . 54.32 112.346 -179.97 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 38.2 m-85 -135.92 -70.37 0.48 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.218 -0.446 . . . . 72.43 110.862 -179.881 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 5' ' ' LEU . . . . . 0.528 ' O ' HD12 ' A' ' 5' ' ' LEU . 0.4 OUTLIER -77.2 -16.65 58.99 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.129 -0.487 . . . . 71.32 110.898 -179.977 . . . . . . . . 3 3 . 1 . 027 nuclear build full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 3.0 pp0? -56.17 -48.8 75.61 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.188 -0.46 . . . . 63.33 110.917 179.924 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 3.5 t -65.31 -31.22 72.25 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.244 -0.435 . . . . 42.02 111.131 -179.923 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 2.0 tt0 -52.94 -41.26 64.32 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.216 -0.447 . . . . 44.45 110.854 -179.962 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -69.37 -42.13 75.61 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.181 -0.463 . . . . 75.14 110.891 -179.814 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 15.4 m-85 -68.56 -25.27 64.82 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.181 -0.463 . . . . 52.21 110.88 -179.878 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -60.64 -32.2 71.37 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.126 -0.488 . . . . 71.21 110.875 179.895 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 58.8 t -90.28 -27.65 5.07 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.19 -0.459 . . . . 75.32 111.139 -179.984 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 9.4 ttp -102.26 32.83 3.34 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.162 -0.472 . . . . 64.43 110.851 179.927 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 5.9 t -86.82 -3.74 59.1 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.212 -0.449 . . . . 64.32 111.149 -179.974 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 15' ' ' VAL . . . . . 0.683 ' C ' ' HG3' ' A' ' 19' ' ' PRO . 23.0 t -94.26 4.65 8.09 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.228 -0.442 . . . . 63.33 111.12 179.867 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 16' ' ' ILE . . . . . 0.452 HG22 ' O ' ' A' ' 16' ' ' ILE . 2.8 mp -142.54 3.36 0.4 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.326 0 CA-C-N 116.173 -0.467 . . . . 74.24 111.122 179.894 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 17' ' ' SER . . . . . 0.799 ' C ' ' HD2' ' A' ' 19' ' ' PRO . 0.5 OUTLIER -100.32 -68.38 0.04 OUTLIER Pre-proline 0 C--N 1.329 -0.323 0 CA-C-O 121.739 0.78 . . . . 73.22 110.836 -179.911 . . . . . . . . 3 3 . 1 . 027 nuclear build full ' A' A ' 18' ' ' PRO . . . . . 0.916 ' N ' ' HD2' ' A' ' 19' ' ' PRO . 54.2 Cg_endo -69.69 -27.87 26.29 Favored 'Trans proline' 0 C--N 1.342 0.214 0 C-N-CA 122.686 2.258 . . . . 62.35 112.349 179.989 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 19' ' ' PRO . . . . . 0.916 ' HD2' ' N ' ' A' ' 18' ' ' PRO . 53.7 Cg_endo -69.79 -16.47 37.46 Favored 'Trans proline' 0 C--N 1.342 0.192 0 C-N-CA 122.637 2.225 . . . . 71.31 112.341 179.989 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -81.87 -19.88 40.01 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.22 -0.446 . . . . 75.54 110.903 -179.994 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -58.66 -34.05 70.79 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.185 -0.461 . . . . 74.52 110.868 -179.947 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.303 0 C-N-CA 120.724 -0.751 . . . . 74.23 112.503 -179.977 . . . . . . . . 0 0 . 1 . 028 nuclear build full ' A' A ' 1' ' ' TRP . . . . . . . . . . . . . 52.5 m0 . . . . . 0 C--O 1.232 0.132 0 CA-C-O 120.777 0.322 . . . . 74.52 110.908 . . . . . . . . . 0 0 . 1 . 028 nuclear build full ' A' A ' 2' ' ' ARG . . . . . 0.55 ' HB3' HD21 ' A' ' 5' ' ' LEU . 0.9 OUTLIER -119.86 70.52 14.21 Favored Pre-proline 0 C--N 1.329 -0.29 0 CA-C-O 121.628 0.728 . . . . 74.32 110.862 -179.944 . . . . . . . . 3 3 . 1 . 028 nuclear build full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.76 -48.46 0.71 Allowed 'Trans proline' 0 C--N 1.342 0.186 0 C-N-CA 122.688 2.259 . . . . 75.2 112.331 -179.995 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 4' ' ' TYR . . . . . 0.438 ' C ' HD23 ' A' ' 5' ' ' LEU . 34.3 m-85 -154.76 121.76 5.54 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.203 -0.453 . . . . 65.41 110.954 -179.913 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 5' ' ' LEU . . . . . 0.55 HD21 ' HB3' ' A' ' 2' ' ' ARG . 0.0 OUTLIER -148.81 -40.94 0.15 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.143 -0.48 . . . . 75.31 110.947 179.987 . . . . . . . . 3 3 . 1 . 028 nuclear build full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 37.7 tt0 -49.76 -43.54 48.09 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.153 -0.476 . . . . 75.1 110.913 179.93 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 10.2 t -90.88 -30.97 16.62 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.185 -0.461 . . . . 62.24 111.102 -179.899 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 3.2 mt-10 -68.05 -20.35 64.96 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.24 -0.436 . . . . 72.4 110.906 -179.991 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 1.6 t80 -84.42 -38.47 20.17 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.119 -0.491 . . . . 75.24 110.87 -179.831 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 20.6 m-85 -56.24 -38.63 71.36 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.141 -0.481 . . . . 72.03 110.954 -179.9 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 71.9 m-20 -56.52 -35.76 68.44 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.113 -0.494 . . . . 64.1 110.869 179.916 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 23.7 t -89.15 -27.49 5.3 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.169 -0.469 . . . . 70.04 111.16 179.949 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 10.6 ttp -101.86 33.4 3.03 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.154 -0.475 . . . . 44.21 110.851 179.968 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 5.5 t -86.18 -4.0 59.08 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.217 -0.447 . . . . 72.21 111.106 -179.923 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 15' ' ' VAL . . . . . 0.668 ' C ' ' HG3' ' A' ' 19' ' ' PRO . 25.3 t -92.93 4.15 7.68 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.24 -0.436 . . . . 72.54 111.132 179.911 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 16' ' ' ILE . . . . . 0.455 HG22 ' O ' ' A' ' 16' ' ' ILE . 9.4 mt -143.32 3.39 0.35 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.215 -0.448 . . . . 75.31 111.141 179.888 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 17' ' ' SER . . . . . 0.799 ' C ' ' HD2' ' A' ' 19' ' ' PRO . 0.5 OUTLIER -99.86 -68.8 0.04 OUTLIER Pre-proline 0 C--N 1.329 -0.301 0 CA-C-O 121.686 0.755 . . . . 65.22 110.863 -179.941 . . . . . . . . 3 3 . 1 . 028 nuclear build full ' A' A ' 18' ' ' PRO . . . . . 0.913 ' N ' ' HD2' ' A' ' 19' ' ' PRO . 54.2 Cg_endo -69.73 -27.89 26.05 Favored 'Trans proline' 0 C--N 1.342 0.203 0 C-N-CA 122.702 2.268 . . . . 73.3 112.361 179.953 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 19' ' ' PRO . . . . . 0.913 ' HD2' ' N ' ' A' ' 18' ' ' PRO . 53.7 Cg_endo -69.8 -16.75 37.52 Favored 'Trans proline' 0 C--N 1.341 0.171 0 C-N-CA 122.64 2.227 . . . . 54.03 112.312 179.956 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 15.1 tp10 -82.51 -21.35 35.49 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.264 -0.425 . . . . 70.22 110.883 -179.986 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -58.14 -34.48 70.31 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.139 -0.482 . . . . 62.43 110.876 -179.903 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.348 0 C-N-CA 120.722 -0.751 . . . . 73.43 112.529 -179.932 . . . . . . . . 0 0 . 1 . 029 nuclear build full ' A' A ' 1' ' ' TRP . . . . . . . . . . . . . 48.8 m0 . . . . . 0 C--O 1.23 0.059 0 CA-C-O 120.774 0.321 . . . . 75.31 110.914 . . . . . . . . . 0 0 . 1 . 029 nuclear build full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER 55.47 70.51 1.54 Allowed Pre-proline 0 C--N 1.33 -0.275 0 CA-C-O 121.61 0.719 . . . . 73.41 110.897 -179.951 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_endo -69.83 106.97 1.77 Allowed 'Trans proline' 0 C--N 1.341 0.176 0 C-N-CA 122.63 2.22 . . . . 74.05 112.35 -179.96 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -92.39 -32.42 14.95 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.207 -0.451 . . . . 72.25 110.892 -179.886 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -105.09 -32.6 8.62 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.173 -0.467 . . . . 74.34 110.94 179.98 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -51.87 -43.18 63.16 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.16 -0.473 . . . . 72.31 110.934 179.915 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 12.3 t -85.42 -27.86 25.48 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.211 -0.45 . . . . 70.02 111.122 -179.922 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 2.5 mt-10 -68.83 -32.52 72.28 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.197 -0.456 . . . . 71.53 110.885 -179.979 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 2.5 t80 -71.05 -36.11 72.19 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.165 -0.47 . . . . 73.12 110.948 -179.861 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 23.4 m-85 -63.15 -28.34 70.0 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.124 -0.489 . . . . 75.23 110.884 -179.939 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -56.78 -44.1 81.5 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.136 -0.484 . . . . 71.3 110.87 179.934 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 21.8 t -82.78 -29.08 8.41 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.203 -0.453 . . . . 75.3 111.131 179.997 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 10.4 ttp -101.29 33.82 2.77 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.141 -0.481 . . . . 71.14 110.907 179.927 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 5.6 t -86.67 -3.91 59.1 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.21 -0.45 . . . . 74.55 111.167 -179.897 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 15' ' ' VAL . . . . . 0.685 ' C ' ' HG3' ' A' ' 19' ' ' PRO . 25.0 t -93.07 3.49 8.19 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-N 116.149 -0.478 . . . . 54.35 111.114 179.932 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 16' ' ' ILE . . . . . 0.447 ' O ' HG22 ' A' ' 16' ' ' ILE . 2.8 mp -142.34 3.63 0.41 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.212 -0.449 . . . . 71.23 111.155 179.924 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 17' ' ' SER . . . . . 0.786 ' C ' ' HD2' ' A' ' 19' ' ' PRO . 0.5 OUTLIER -99.89 -68.77 0.04 OUTLIER Pre-proline 0 C--N 1.329 -0.319 0 CA-C-O 121.674 0.75 . . . . 72.21 110.844 -179.879 . . . . . . . . 3 3 . 1 . 029 nuclear build full ' A' A ' 18' ' ' PRO . . . . . 0.912 ' N ' ' HD2' ' A' ' 19' ' ' PRO . 53.5 Cg_endo -69.83 -27.9 25.58 Favored 'Trans proline' 0 C--N 1.342 0.191 0 C-N-CA 122.645 2.23 . . . . 55.45 112.325 -179.982 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 19' ' ' PRO . . . . . 0.912 ' HD2' ' N ' ' A' ' 18' ' ' PRO . 54.2 Cg_endo -69.74 -16.81 37.81 Favored 'Trans proline' 0 C--N 1.342 0.195 0 C-N-CA 122.72 2.28 . . . . 72.43 112.346 179.903 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 25.6 tt0 -82.59 -21.24 35.28 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.205 -0.452 . . . . 74.13 110.867 -179.94 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -58.1 -32.86 68.49 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.154 -0.476 . . . . 74.12 110.872 -179.913 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.303 0 C-N-CA 120.72 -0.752 . . . . 70.21 112.462 179.978 . . . . . . . . 0 0 . 1 . 030 nuclear build full ' A' A ' 1' ' ' TRP . . . . . . . . . . . . . 36.2 m0 . . . . . 0 C--O 1.231 0.114 0 CA-C-O 120.777 0.322 . . . . 72.32 110.911 . . . . . . . . . 0 0 . 1 . 030 nuclear build full ' A' A ' 2' ' ' ARG . . . . . 0.541 ' HB3' HD22 ' A' ' 5' ' ' LEU . 25.5 mmt180 56.2 73.66 0.8 Allowed Pre-proline 0 C--N 1.329 -0.29 0 CA-C-O 121.624 0.726 . . . . 74.1 110.891 -179.952 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.77 -8.37 23.43 Favored 'Trans proline' 0 C--N 1.341 0.175 0 C-N-CA 122.663 2.242 . . . . 70.32 112.32 -179.962 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 12.7 m-85 -158.27 125.29 4.93 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.21 -0.45 . . . . 70.55 110.925 -179.884 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 5' ' ' LEU . . . . . 0.541 HD22 ' HB3' ' A' ' 2' ' ' ARG . 0.0 OUTLIER -143.8 -41.08 0.28 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.095 -0.502 . . . . 75.3 110.929 179.953 . . . . . . . . 3 3 . 1 . 030 nuclear build full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -50.31 -42.53 52.76 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.203 -0.453 . . . . 74.53 110.943 179.884 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 8.9 t -91.97 -30.6 16.0 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.188 -0.46 . . . . 71.34 111.1 -179.92 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -68.46 -21.94 64.6 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.239 -0.437 . . . . 62.34 110.92 -179.995 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 1.6 t80 -82.11 -39.21 23.67 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.106 -0.497 . . . . 74.33 110.939 -179.858 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 20.0 m-85 -55.17 -32.55 62.24 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.082 -0.508 . . . . 64.12 110.926 -179.959 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -53.13 -36.6 60.97 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.145 -0.48 . . . . 51.01 110.892 179.91 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 57.7 t -82.4 -30.84 9.54 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.18 -0.464 . . . . 60.11 111.115 179.971 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 10.6 ttp -101.97 33.38 3.06 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.182 -0.463 . . . . 72.32 110.83 179.962 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 5.5 t -86.18 -4.0 59.08 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.261 -0.427 . . . . 64.33 111.139 -179.941 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 15' ' ' VAL . . . . . 0.678 ' C ' ' HG3' ' A' ' 19' ' ' PRO . 25.4 t -92.95 4.18 7.67 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.22 -0.446 . . . . 73.44 111.134 179.904 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 16' ' ' ILE . . . . . 0.459 HG22 ' O ' ' A' ' 16' ' ' ILE . 9.5 mt -143.3 3.31 0.35 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.186 -0.461 . . . . 72.01 111.164 179.926 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 17' ' ' SER . . . . . 0.809 ' C ' ' HD2' ' A' ' 19' ' ' PRO . 0.5 OUTLIER -99.9 -68.73 0.04 OUTLIER Pre-proline 0 C--N 1.33 -0.278 0 CA-C-O 121.612 0.72 . . . . 61.45 110.866 -179.919 . . . . . . . . 3 3 . 1 . 030 nuclear build full ' A' A ' 18' ' ' PRO . . . . . 0.913 ' N ' ' HD2' ' A' ' 19' ' ' PRO . 53.5 Cg_endo -69.75 -27.97 25.88 Favored 'Trans proline' 0 C--N 1.341 0.157 0 C-N-CA 122.721 2.281 . . . . 44.24 112.32 179.988 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 19' ' ' PRO . . . . . 0.913 ' HD2' ' N ' ' A' ' 18' ' ' PRO . 53.8 Cg_endo -69.72 -16.75 37.87 Favored 'Trans proline' 0 C--N 1.342 0.201 0 C-N-CA 122.684 2.256 . . . . 64.43 112.389 179.935 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 57.6 tt0 -82.53 -21.34 35.43 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.197 -0.456 . . . . 72.54 110.936 179.988 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -58.17 -34.42 70.29 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.103 -0.499 . . . . 73.32 110.926 -179.934 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.342 0 C-N-CA 120.727 -0.749 . . . . 73.2 112.478 179.988 . . . . . . . . 0 0 . 1 . 031 nuclear build full ' A' A ' 1' ' ' TRP . . . . . . . . . . . . . 54.9 m0 . . . . . 0 C--O 1.231 0.113 0 CA-C-O 120.747 0.308 . . . . 71.54 110.901 . . . . . . . . . 0 0 . 1 . 031 nuclear build full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 6.7 ptt180 -140.15 157.59 68.69 Favored Pre-proline 0 C--N 1.329 -0.299 0 CA-C-O 121.598 0.713 . . . . 72.34 110.856 -179.977 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.72 -171.82 0.51 Allowed 'Trans proline' 0 C--N 1.341 0.171 0 C-N-CA 122.693 2.262 . . . . 73.15 112.3 -179.963 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 35.2 m-85 -120.48 8.19 10.72 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.195 -0.457 . . . . 72.54 110.903 -179.889 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -101.45 -7.88 22.48 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.144 -0.48 . . . . 33.24 110.929 179.961 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -50.44 -42.4 54.01 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.204 -0.453 . . . . 74.33 110.88 179.944 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 7.9 t -77.92 -29.4 50.01 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.235 -0.439 . . . . 75.35 111.143 -179.913 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -61.2 -38.67 87.38 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.223 -0.444 . . . . 75.32 110.875 -180.0 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 1.1 t80 -66.88 -37.85 85.19 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.179 -0.464 . . . . 70.31 110.91 -179.87 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 18.1 m-85 -71.13 -28.67 64.46 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.129 -0.487 . . . . 63.51 110.917 -179.907 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -67.02 -45.55 77.16 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.13 -0.487 . . . . 64.3 110.844 179.937 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 60.6 t -81.72 -25.7 9.77 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.211 -0.449 . . . . 65.51 111.118 -179.958 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 10.6 ttp -101.97 33.38 3.06 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.182 -0.463 . . . . 72.33 110.876 179.929 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 5.5 t -86.11 -4.03 59.08 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.215 -0.448 . . . . 73.42 111.137 -179.921 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 15' ' ' VAL . . . . . 0.675 ' C ' ' HG3' ' A' ' 19' ' ' PRO . 25.4 t -92.91 4.14 7.68 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.183 -0.462 . . . . 74.02 111.122 179.937 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 16' ' ' ILE . . . . . 0.456 ' O ' HG22 ' A' ' 16' ' ' ILE . 9.5 mt -143.28 3.34 0.35 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.178 -0.465 . . . . 72.13 111.169 179.911 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 17' ' ' SER . . . . . 0.792 ' C ' ' HD2' ' A' ' 19' ' ' PRO . 0.5 OUTLIER -99.86 -68.81 0.04 OUTLIER Pre-proline 0 C--N 1.329 -0.297 0 CA-C-O 121.696 0.76 . . . . 63.43 110.895 -179.92 . . . . . . . . 3 3 . 1 . 031 nuclear build full ' A' A ' 18' ' ' PRO . . . . . 0.919 ' N ' ' HD2' ' A' ' 19' ' ' PRO . 54.0 Cg_endo -69.75 -27.88 25.99 Favored 'Trans proline' 0 C--N 1.342 0.213 0 C-N-CA 122.684 2.256 . . . . 75.1 112.329 179.971 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 19' ' ' PRO . . . . . 0.919 ' HD2' ' N ' ' A' ' 18' ' ' PRO . 53.9 Cg_endo -69.72 -16.49 37.73 Favored 'Trans proline' 0 C--N 1.341 0.153 0 C-N-CA 122.69 2.26 . . . . 73.02 112.315 179.966 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -81.92 -19.44 40.77 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.261 -0.427 . . . . 72.11 110.909 -179.966 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -59.7 -25.74 65.02 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.13 -0.486 . . . . 74.31 110.852 -179.902 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.325 0 C-N-CA 120.699 -0.762 . . . . 54.41 112.51 -179.993 . . . . . . . . 0 0 . 1 . 032 nuclear build full ' A' A ' 1' ' ' TRP . . . . . . . . . . . . . 3.6 t90 . . . . . 0 C--O 1.231 0.112 0 CA-C-O 120.741 0.305 . . . . 64.34 110.947 . . . . . . . . . 0 0 . 1 . 032 nuclear build full ' A' A ' 2' ' ' ARG . . . . . 0.544 ' HB2' HD22 ' A' ' 5' ' ' LEU . 0.6 OUTLIER -57.18 160.65 6.24 Favored Pre-proline 0 C--N 1.329 -0.31 0 CA-C-O 121.571 0.7 . . . . 74.01 110.898 -179.975 . . . . . . . . 3 3 . 1 . 032 nuclear build full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.74 -19.44 36.23 Favored 'Trans proline' 0 C--O 1.231 0.164 0 C-N-CA 122.704 2.269 . . . . 75.51 112.346 179.977 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 17.0 m-85 -159.54 125.24 4.24 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.18 -0.464 . . . . 75.24 110.892 -179.885 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 5' ' ' LEU . . . . . 0.544 HD22 ' HB2' ' A' ' 2' ' ' ARG . 0.0 OUTLIER -146.55 -41.28 0.2 Allowed 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.112 -0.495 . . . . 73.22 110.927 179.937 . . . . . . . . 3 3 . 1 . 032 nuclear build full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 6.3 tt0 -50.25 -42.76 52.55 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.226 -0.443 . . . . 44.53 110.938 179.898 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 8.8 t -91.61 -30.53 16.3 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.17 -0.468 . . . . 54.33 111.131 -179.941 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 3.8 mt-10 -68.51 -21.6 64.58 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.22 -0.445 . . . . 71.02 110.918 179.994 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 1.6 t80 -82.56 -38.84 23.14 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.146 -0.479 . . . . 64.13 110.926 -179.86 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 20.1 m-85 -55.83 -32.09 63.28 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.076 -0.511 . . . . 74.2 110.922 -179.89 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 14.9 t70 -65.74 -44.93 84.47 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.155 -0.475 . . . . 64.34 110.906 179.86 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 58.3 t -76.66 -29.34 18.11 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.178 -0.464 . . . . 75.02 111.109 179.982 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 10.4 ttp -102.49 33.9 2.98 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.181 -0.463 . . . . 72.23 110.895 179.954 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 5.6 t -86.65 -3.96 59.11 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.199 -0.455 . . . . 51.14 111.182 -179.973 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 15' ' ' VAL . . . . . 0.685 ' C ' ' HG3' ' A' ' 19' ' ' PRO . 24.9 t -93.0 3.49 8.15 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.203 -0.453 . . . . 72.3 111.129 179.879 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 16' ' ' ILE . . . . . 0.465 HG22 ' O ' ' A' ' 16' ' ' ILE . 2.8 mp -142.38 3.61 0.41 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.19 -0.459 . . . . 72.25 111.146 179.918 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 17' ' ' SER . . . . . 0.797 ' C ' ' HD2' ' A' ' 19' ' ' PRO . 0.5 OUTLIER -99.85 -68.79 0.04 OUTLIER Pre-proline 0 C--N 1.329 -0.284 0 CA-C-O 121.674 0.75 . . . . 74.53 110.868 -179.94 . . . . . . . . 3 3 . 1 . 032 nuclear build full ' A' A ' 18' ' ' PRO . . . . . 0.924 ' N ' ' HD2' ' A' ' 19' ' ' PRO . 53.7 Cg_endo -69.73 -27.99 25.94 Favored 'Trans proline' 0 C--O 1.231 0.171 0 C-N-CA 122.718 2.278 . . . . 74.34 112.313 179.994 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 19' ' ' PRO . . . . . 0.924 ' HD2' ' N ' ' A' ' 18' ' ' PRO . 53.9 Cg_endo -69.74 -16.71 37.77 Favored 'Trans proline' 0 C--N 1.341 0.179 0 C-N-CA 122.669 2.246 . . . . 75.42 112.359 179.939 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 17.6 tp10 -82.61 -21.36 35.16 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.252 -0.431 . . . . 75.41 110.875 -179.978 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -58.14 -34.11 69.91 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.167 -0.469 . . . . 74.25 110.864 -179.894 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.291 0 C-N-CA 120.719 -0.753 . . . . 63.41 112.485 -179.993 . . . . . . . . 0 0 . 1 . 033 nuclear build full ' A' A ' 1' ' ' TRP . . . . . . . . . . . . . 4.1 t90 . . . . . 0 C--O 1.231 0.101 0 CA-C-O 120.765 0.316 . . . . 54.34 110.915 . . . . . . . . . 0 0 . 1 . 033 nuclear build full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 5.4 mpt_? -84.97 160.67 54.83 Favored Pre-proline 0 C--N 1.329 -0.316 0 CA-C-O 121.635 0.731 . . . . 75.0 110.871 -179.948 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.71 156.3 63.85 Favored 'Trans proline' 0 C--O 1.231 0.165 0 C-N-CA 122.702 2.268 . . . . 64.41 112.358 -179.982 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 42.2 m-85 -132.25 -65.83 0.72 Allowed 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.246 -0.434 . . . . 71.24 110.963 -179.939 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 5' ' ' LEU . . . . . 0.444 ' O ' HD12 ' A' ' 5' ' ' LEU . 0.3 OUTLIER -79.27 -24.29 43.06 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.118 -0.492 . . . . 62.25 110.91 179.934 . . . . . . . . 3 3 . 1 . 033 nuclear build full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 12.7 mt-30 -53.7 -54.45 37.83 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.209 -0.451 . . . . 71.24 110.917 179.942 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 9.8 t -60.94 -31.67 71.21 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.171 -0.468 . . . . 60.24 111.155 -179.927 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 8' ' ' GLU . . . . . 0.523 ' O ' HG23 ' A' ' 12' ' ' VAL . 1.1 mt-10 -59.18 -24.48 63.11 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.213 -0.449 . . . . 61.13 110.921 179.98 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 1.2 m-85 -94.93 -39.7 10.07 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.125 -0.489 . . . . 73.43 110.939 -179.86 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 23.3 m-85 -61.76 -49.34 76.77 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.103 -0.499 . . . . 62.22 110.894 -179.905 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 22.4 t0 -54.55 -32.49 58.44 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.19 -0.459 . . . . 71.1 110.85 179.93 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 12' ' ' VAL . . . . . 0.523 HG23 ' O ' ' A' ' 8' ' ' GLU . 93.6 t -64.77 -22.75 31.97 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.231 -0.441 . . . . 52.23 111.146 179.981 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 2.8 ttp -113.61 -2.45 13.8 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.159 -0.473 . . . . 42.43 110.886 179.922 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 14' ' ' THR . . . . . 0.486 HG22 ' O ' ' A' ' 14' ' ' THR . 25.7 m -76.55 -4.92 45.32 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.211 -0.449 . . . . 74.13 111.135 -179.967 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' A' A ' 15' ' ' VAL . . . . . 0.684 ' C ' ' HG3' ' A' ' 19' ' ' PRO . 23.5 t -97.88 10.97 5.93 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.269 -0.423 . . . . 54.32 111.176 179.861 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' A' A ' 16' ' ' ILE . . . . . 0.462 HG22 ' O ' ' A' ' 16' ' ' ILE . 3.0 mp -142.37 2.56 0.41 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.189 -0.46 . . . . 64.45 111.14 179.924 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' A' A ' 17' ' ' SER . . . . . 0.798 ' C ' ' HD2' ' A' ' 19' ' ' PRO . 0.6 OUTLIER -101.74 -66.2 0.05 OUTLIER Pre-proline 0 C--N 1.33 -0.273 0 CA-C-O 121.622 0.725 . . . . 72.22 110.88 -179.935 . . . . . . . . 3 3 . 1 . 033 nuclear build full ' A' A ' 18' ' ' PRO . . . . . 0.92 ' N ' ' HD2' ' A' ' 19' ' ' PRO . 53.7 Cg_endo -69.8 -27.66 26.02 Favored 'Trans proline' 0 C--N 1.342 0.189 0 C-N-CA 122.664 2.243 . . . . 63.12 112.374 179.953 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' A' A ' 19' ' ' PRO . . . . . 0.92 ' HD2' ' N ' ' A' ' 18' ' ' PRO . 53.2 Cg_endo -69.81 -16.2 37.25 Favored 'Trans proline' 0 C--N 1.341 0.145 0 C-N-CA 122.664 2.243 . . . . 73.31 112.329 179.946 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 5.8 tm-20 -83.02 -21.25 33.9 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.2 -0.455 . . . . 74.22 110.855 -179.968 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -57.55 -32.78 67.44 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.166 -0.47 . . . . 75.02 110.896 -179.932 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.366 0 C-N-CA 120.754 -0.736 . . . . 33.43 112.508 -179.95 . . . . . . . . 0 0 . 1 . 034 nuclear build full ' A' A ' 1' ' ' TRP . . . . . . . . . . . . . 53.9 m0 . . . . . 0 C--O 1.231 0.117 0 CA-C-O 120.711 0.291 . . . . 74.51 110.938 . . . . . . . . . 0 0 . 1 . 034 nuclear build full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 2.1 mtt-85 57.81 73.33 0.77 Allowed Pre-proline 0 C--N 1.329 -0.297 0 CA-C-O 121.628 0.728 . . . . 62.15 110.881 -179.955 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.78 78.77 0.99 Allowed 'Trans proline' 0 C--O 1.232 0.194 0 C-N-CA 122.664 2.242 . . . . 74.21 112.327 -179.981 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -134.67 -65.24 0.64 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.217 -0.447 . . . . 71.24 110.917 -179.908 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 5' ' ' LEU . . . . . 0.426 ' O ' HD12 ' A' ' 5' ' ' LEU . 0.3 OUTLIER -80.36 -24.58 39.72 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.131 -0.486 . . . . 72.14 110.926 179.936 . . . . . . . . 3 3 . 1 . 034 nuclear build full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 87.7 mm-40 -51.85 -49.89 61.99 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.189 -0.46 . . . . 62.33 110.905 179.918 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 11.2 t -68.0 -31.63 71.46 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.236 -0.438 . . . . 64.0 111.198 -179.945 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 1.2 mt-10 -55.77 -31.7 62.83 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.18 -0.464 . . . . 72.35 110.856 179.992 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -76.77 -44.58 32.37 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.201 -0.454 . . . . 75.12 110.883 -179.814 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 14.4 m-85 -64.66 -26.72 68.5 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.122 -0.49 . . . . 74.13 110.908 -179.917 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 11' ' ' ASP . . . . . 0.453 ' O ' HG22 ' A' ' 14' ' ' THR . 11.7 t70 -67.98 -27.85 66.93 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.121 -0.49 . . . . 73.13 110.862 179.958 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 55.7 t -83.2 -24.2 8.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.204 -0.453 . . . . 45.15 111.091 -179.962 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 10.1 ttp -105.76 6.26 31.63 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.144 -0.48 . . . . 44.43 110.913 179.92 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 14' ' ' THR . . . . . 0.453 HG22 ' O ' ' A' ' 11' ' ' ASP . 6.0 t -70.18 -6.34 33.68 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.221 -0.445 . . . . 53.41 111.104 -179.922 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 15' ' ' VAL . . . . . 0.663 HG12 ' O ' ' A' ' 15' ' ' VAL . 40.3 t -96.27 9.83 5.85 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.242 -0.436 . . . . 64.52 111.177 179.922 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 16' ' ' ILE . . . . . 0.457 HG22 ' O ' ' A' ' 16' ' ' ILE . 10.6 mt -143.96 2.11 0.3 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.092 -0.504 . . . . 71.43 111.102 179.963 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 17' ' ' SER . . . . . 0.815 ' C ' ' HD2' ' A' ' 19' ' ' PRO . 0.0 OUTLIER -99.74 -65.89 0.06 OUTLIER Pre-proline 0 C--N 1.329 -0.288 0 CA-C-O 121.65 0.738 . . . . 73.12 110.818 -179.898 . . . . . . . . 3 3 . 1 . 034 nuclear build full ' A' A ' 18' ' ' PRO . . . . . 0.922 ' N ' ' HD2' ' A' ' 19' ' ' PRO . 53.7 Cg_endo -69.77 -27.38 26.5 Favored 'Trans proline' 0 C--O 1.231 0.156 0 C-N-CA 122.649 2.232 . . . . 74.21 112.331 -179.976 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 19' ' ' PRO . . . . . 0.922 ' HD2' ' N ' ' A' ' 18' ' ' PRO . 53.6 Cg_endo -69.74 -16.98 37.91 Favored 'Trans proline' 0 C--N 1.341 0.177 0 C-N-CA 122.651 2.234 . . . . 51.14 112.336 179.952 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 1.9 mt-10 -82.79 -19.99 36.66 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.228 -0.442 . . . . 73.3 110.879 -179.967 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -58.59 -33.35 69.88 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.21 -0.45 . . . . 73.51 110.894 -179.945 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.302 0 C-N-CA 120.7 -0.762 . . . . 54.23 112.461 179.998 . . . . . . . . 0 0 . 1 . 035 nuclear build full ' A' A ' 1' ' ' TRP . . . . . . . . . . . . . 3.1 t90 . . . . . 0 C--O 1.231 0.11 0 CA-C-O 120.775 0.321 . . . . 73.11 110.927 . . . . . . . . . 0 0 . 1 . 035 nuclear build full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 2.3 mtm180 -59.7 160.64 13.81 Favored Pre-proline 0 C--N 1.329 -0.287 0 CA-C-O 121.614 0.721 . . . . 44.44 110.866 -179.936 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.8 -48.93 0.61 Allowed 'Trans proline' 0 C--O 1.231 0.159 0 C-N-CA 122.677 2.251 . . . . 74.35 112.35 -179.991 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 6.5 p90 179.49 133.3 0.09 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.253 -0.43 . . . . 53.22 110.917 -179.941 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -142.49 -41.26 0.33 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.095 -0.502 . . . . 71.11 110.913 179.986 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 6.4 mm-40 -54.73 -46.97 74.32 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.179 -0.464 . . . . 73.41 110.914 179.912 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 13.5 t -81.25 -25.24 36.77 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.207 -0.451 . . . . 63.52 111.161 -179.942 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 33.0 tp10 -77.72 -19.75 54.69 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.218 -0.446 . . . . 75.24 110.926 179.948 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 1.4 t80 -86.21 -34.07 20.58 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.151 -0.477 . . . . 62.11 110.925 -179.844 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 22.1 m-85 -59.71 -26.66 65.79 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.109 -0.496 . . . . 74.23 110.927 -179.93 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -64.32 -44.66 90.88 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.139 -0.482 . . . . 64.22 110.891 179.9 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 50.8 t -75.3 -30.01 22.14 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.219 -0.446 . . . . 73.04 111.159 179.96 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 10.4 ttp -102.3 33.93 2.93 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.191 -0.459 . . . . 73.14 110.884 179.884 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 5.6 t -86.74 -3.92 59.11 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.212 -0.449 . . . . 71.23 111.138 -179.92 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 15' ' ' VAL . . . . . 0.687 ' C ' ' HG3' ' A' ' 19' ' ' PRO . 25.1 t -93.04 3.45 8.2 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.222 -0.445 . . . . 71.32 111.125 179.895 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' A' A ' 16' ' ' ILE . . . . . 0.462 ' O ' HG22 ' A' ' 16' ' ' ILE . 2.8 mp -142.33 3.6 0.41 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.144 -0.48 . . . . 53.34 111.156 179.949 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' A' A ' 17' ' ' SER . . . . . 0.79 ' C ' ' HD2' ' A' ' 19' ' ' PRO . 0.5 OUTLIER -99.86 -68.78 0.04 OUTLIER Pre-proline 0 C--N 1.33 -0.271 0 CA-C-O 121.671 0.748 . . . . 75.04 110.855 -179.879 . . . . . . . . 3 3 . 1 . 035 nuclear build full ' A' A ' 18' ' ' PRO . . . . . 0.911 ' N ' ' HD2' ' A' ' 19' ' ' PRO . 53.6 Cg_endo -69.77 -27.99 25.74 Favored 'Trans proline' 0 C--N 1.341 0.172 0 C-N-CA 122.651 2.234 . . . . 53.55 112.323 179.981 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' A' A ' 19' ' ' PRO . . . . . 0.911 ' HD2' ' N ' ' A' ' 18' ' ' PRO . 54.1 Cg_endo -69.7 -16.76 37.97 Favored 'Trans proline' 0 C--N 1.341 0.149 0 C-N-CA 122.702 2.268 . . . . 72.34 112.366 179.942 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 28.4 tt0 -82.64 -21.24 35.13 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.191 -0.459 . . . . 73.33 110.888 -179.975 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -59.13 -25.39 63.82 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.113 -0.494 . . . . 63.41 110.875 -179.878 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.339 0 C-N-CA 120.746 -0.74 . . . . 75.23 112.516 -179.987 . . . . . . . . 0 0 . 1 . 036 nuclear build full ' A' A ' 1' ' ' TRP . . . . . . . . . . . . . 37.0 m0 . . . . . 0 C--O 1.231 0.124 0 CA-C-O 120.769 0.319 . . . . 71.51 110.945 . . . . . . . . . 0 0 . 1 . 036 nuclear build full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 3.1 mpp_? -128.39 73.29 80.27 Favored Pre-proline 0 C--N 1.329 -0.319 0 CA-C-O 121.6 0.714 . . . . 74.51 110.866 -179.93 . . . . . . . . 1 1 . 1 . 036 nuclear build full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.75 133.14 24.87 Favored 'Trans proline' 0 C--O 1.232 0.193 0 C-N-CA 122.688 2.259 . . . . 61.32 112.359 -179.997 . . . . . . . . 1 1 . 1 . 036 nuclear build full ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 6.1 t80 -134.66 -65.98 0.61 Allowed 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.272 -0.422 . . . . 75.34 110.959 -179.943 . . . . . . . . 1 1 . 1 . 036 nuclear build full ' A' A ' 5' ' ' LEU . . . . . 0.457 ' O ' HD12 ' A' ' 5' ' ' LEU . 0.3 OUTLIER -78.98 -22.63 45.32 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.127 -0.488 . . . . 71.33 110.932 179.936 . . . . . . . . 3 3 . 1 . 036 nuclear build full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 22.0 mt-30 -51.58 -51.0 59.05 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.194 -0.457 . . . . 63.31 110.892 179.954 . . . . . . . . 1 1 . 1 . 036 nuclear build full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 8.9 t -71.12 -33.36 70.04 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.226 -0.443 . . . . 71.04 111.191 -179.96 . . . . . . . . 1 1 . 1 . 036 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 2.4 tt0 -56.07 -26.38 49.21 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.2 -0.455 . . . . 72.12 110.888 179.949 . . . . . . . . 1 1 . 1 . 036 nuclear build full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 20.9 t80 -82.78 -43.6 16.54 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.162 -0.472 . . . . 73.31 110.877 -179.819 . . . . . . . . 1 1 . 1 . 036 nuclear build full ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 22.4 m-85 -62.15 -26.78 68.52 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.128 -0.487 . . . . 53.23 110.909 -179.912 . . . . . . . . 1 1 . 1 . 036 nuclear build full ' A' A ' 11' ' ' ASP . . . . . 0.509 ' O ' HG22 ' A' ' 14' ' ' THR . 3.2 t0 -64.49 -24.83 67.75 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.119 -0.491 . . . . 64.25 110.848 179.93 . . . . . . . . 2 2 . 1 . 036 nuclear build full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 47.8 t -82.95 -24.05 8.4 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.232 -0.44 . . . . 73.45 111.147 -179.976 . . . . . . . . 1 1 . 1 . 036 nuclear build full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 9.0 ttp -105.58 2.98 28.77 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.134 -0.485 . . . . 54.15 110.852 179.918 . . . . . . . . 1 1 . 1 . 036 nuclear build full ' A' A ' 14' ' ' THR . . . . . 0.509 HG22 ' O ' ' A' ' 11' ' ' ASP . 5.6 t -70.28 -5.93 31.3 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.272 -0.422 . . . . 75.34 111.162 -179.98 . . . . . . . . 2 2 . 1 . 036 nuclear build full ' A' A ' 15' ' ' VAL . . . . . 0.655 HG12 ' O ' ' A' ' 15' ' ' VAL . 40.0 t -96.18 9.84 5.79 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.229 -0.442 . . . . 71.32 111.171 179.872 . . . . . . . . 2 2 . 1 . 036 nuclear build full ' A' A ' 16' ' ' ILE . . . . . 0.449 HG22 ' O ' ' A' ' 16' ' ' ILE . 10.4 mt -143.86 2.05 0.31 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.176 -0.466 . . . . 70.33 111.16 179.945 . . . . . . . . 2 2 . 1 . 036 nuclear build full ' A' A ' 17' ' ' SER . . . . . 0.815 ' C ' ' HD2' ' A' ' 19' ' ' PRO . 0.0 OUTLIER -99.73 -65.79 0.06 OUTLIER Pre-proline 0 C--N 1.33 -0.252 0 CA-C-O 121.673 0.749 . . . . 61.52 110.864 -179.922 . . . . . . . . 3 3 . 1 . 036 nuclear build full ' A' A ' 18' ' ' PRO . . . . . 0.911 ' N ' ' HD2' ' A' ' 19' ' ' PRO . 53.6 Cg_endo -69.74 -27.4 26.61 Favored 'Trans proline' 0 C--N 1.341 0.175 0 C-N-CA 122.713 2.276 . . . . 62.33 112.36 179.978 . . . . . . . . 2 2 . 1 . 036 nuclear build full ' A' A ' 19' ' ' PRO . . . . . 0.911 ' HD2' ' N ' ' A' ' 18' ' ' PRO . 53.5 Cg_endo -69.82 -16.95 37.55 Favored 'Trans proline' 0 C--N 1.342 0.217 0 C-N-CA 122.673 2.249 . . . . 71.34 112.318 179.981 . . . . . . . . 2 2 . 1 . 036 nuclear build full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 1.2 mt-10 -82.81 -20.23 36.15 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.232 -0.44 . . . . 74.32 110.836 -179.969 . . . . . . . . 1 1 . 1 . 036 nuclear build full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -58.41 -32.8 68.98 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.188 -0.46 . . . . 75.42 110.903 -179.91 . . . . . . . . 2 2 . 1 . 036 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.288 0 C-N-CA 120.735 -0.745 . . . . 63.23 112.475 -179.999 . . . . . . . . 0 0 . 1 . 037 nuclear build full ' A' A ' 1' ' ' TRP . . . . . . . . . . . . . 2.5 t90 . . . . . 0 C--O 1.231 0.082 0 CA-C-O 120.771 0.32 . . . . 70.34 110.904 . . . . . . . . . 0 0 . 1 . 037 nuclear build full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 8.3 mtt-85 -53.67 160.61 1.94 Allowed Pre-proline 0 C--N 1.329 -0.283 0 CA-C-O 121.592 0.71 . . . . 75.12 110.85 -179.931 . . . . . . . . 1 1 . 1 . 037 nuclear build full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.79 105.0 1.41 Allowed 'Trans proline' 0 C--N 1.341 0.164 0 C-N-CA 122.665 2.243 . . . . 72.2 112.36 -179.997 . . . . . . . . 1 1 . 1 . 037 nuclear build full ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 12.6 t80 -135.84 -68.16 0.51 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.207 -0.451 . . . . 74.33 110.946 -179.896 . . . . . . . . 1 1 . 1 . 037 nuclear build full ' A' A ' 5' ' ' LEU . . . . . 0.426 ' O ' HD12 ' A' ' 5' ' ' LEU . 0.3 OUTLIER -74.93 -24.73 58.54 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.12 -0.491 . . . . 75.54 110.867 179.964 . . . . . . . . 3 3 . 1 . 037 nuclear build full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -51.62 -58.03 7.5 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.201 -0.454 . . . . 62.23 110.917 179.952 . . . . . . . . 2 2 . 1 . 037 nuclear build full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 13.4 t -58.87 -28.27 65.97 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.178 -0.465 . . . . 70.23 111.148 -179.901 . . . . . . . . 1 1 . 1 . 037 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -70.16 -21.83 63.03 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.227 -0.442 . . . . 74.22 110.908 179.948 . . . . . . . . 2 2 . 1 . 037 nuclear build full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -82.37 -27.6 32.02 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.189 -0.46 . . . . 73.21 110.906 -179.876 . . . . . . . . 2 2 . 1 . 037 nuclear build full ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 15.9 m-85 -52.1 -37.52 54.34 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.122 -0.49 . . . . 75.42 110.936 -179.932 . . . . . . . . 1 1 . 1 . 037 nuclear build full ' A' A ' 11' ' ' ASP . . . . . 0.543 ' O ' HG22 ' A' ' 14' ' ' THR . 11.1 m-20 -56.86 -31.46 64.82 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.095 -0.502 . . . . 70.44 110.879 179.911 . . . . . . . . 2 2 . 1 . 037 nuclear build full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 39.7 t -78.21 -23.03 13.53 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-N 116.207 -0.451 . . . . 73.12 111.159 179.992 . . . . . . . . 1 1 . 1 . 037 nuclear build full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 9.7 ttp -104.36 6.37 35.11 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.138 -0.483 . . . . 64.23 110.872 179.9 . . . . . . . . 1 1 . 1 . 037 nuclear build full ' A' A ' 14' ' ' THR . . . . . 0.543 HG22 ' O ' ' A' ' 11' ' ' ASP . 5.8 t -70.04 -6.34 32.92 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.257 -0.429 . . . . 61.12 111.183 -179.955 . . . . . . . . 2 2 . 1 . 037 nuclear build full ' A' A ' 15' ' ' VAL . . . . . 0.647 HG12 ' O ' ' A' ' 15' ' ' VAL . 40.7 t -96.28 9.87 5.83 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.207 -0.451 . . . . 74.4 111.137 179.907 . . . . . . . . 2 2 . 1 . 037 nuclear build full ' A' A ' 16' ' ' ILE . . . . . 0.447 HG22 ' O ' ' A' ' 16' ' ' ILE . 10.8 mt -143.96 1.98 0.3 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.193 -0.458 . . . . 75.41 111.132 179.942 . . . . . . . . 2 2 . 1 . 037 nuclear build full ' A' A ' 17' ' ' SER . . . . . 0.812 ' C ' ' HD2' ' A' ' 19' ' ' PRO . 0.0 OUTLIER -99.66 -65.88 0.06 OUTLIER Pre-proline 0 C--N 1.329 -0.307 0 CA-C-O 121.707 0.765 . . . . 65.11 110.863 -179.895 . . . . . . . . 3 3 . 1 . 037 nuclear build full ' A' A ' 18' ' ' PRO . . . . . 0.91 ' N ' ' HD2' ' A' ' 19' ' ' PRO . 53.8 Cg_endo -69.77 -27.42 26.43 Favored 'Trans proline' 0 C--N 1.342 0.205 0 C-N-CA 122.739 2.292 . . . . 75.52 112.321 179.999 . . . . . . . . 2 2 . 1 . 037 nuclear build full ' A' A ' 19' ' ' PRO . . . . . 0.91 ' HD2' ' N ' ' A' ' 18' ' ' PRO . 54.1 Cg_endo -69.74 -17.02 37.9 Favored 'Trans proline' 0 C--N 1.341 0.176 0 C-N-CA 122.657 2.238 . . . . 75.34 112.392 179.922 . . . . . . . . 2 2 . 1 . 037 nuclear build full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 1.3 mt-10 -82.73 -19.88 37.07 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.208 -0.451 . . . . 74.24 110.92 179.989 . . . . . . . . 1 1 . 1 . 037 nuclear build full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -58.62 -33.72 70.35 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.111 -0.495 . . . . 73.44 110.903 -179.943 . . . . . . . . 2 2 . 1 . 037 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.309 0 C-N-CA 120.715 -0.755 . . . . 64.32 112.469 -179.953 . . . . . . . . 0 0 . 1 . 038 nuclear build full ' A' A ' 1' ' ' TRP . . . . . . . . . . . . . 46.3 m0 . . . . . 0 C--O 1.231 0.128 0 CA-C-O 120.786 0.327 . . . . 71.42 110.944 . . . . . . . . . 0 0 . 1 . 038 nuclear build full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER 52.94 72.77 1.07 Allowed Pre-proline 0 C--N 1.329 -0.319 0 CA-C-O 121.631 0.729 . . . . 65.44 110.868 -179.928 . . . . . . . . 2 2 . 1 . 038 nuclear build full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -69.78 141.18 44.46 Favored 'Trans proline' 0 C--N 1.342 0.205 0 C-N-CA 122.705 2.27 . . . . 62.1 112.362 179.98 . . . . . . . . 1 1 . 1 . 038 nuclear build full ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 5.9 t80 -134.43 -65.43 0.64 Allowed 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.197 -0.456 . . . . 71.14 110.989 -179.917 . . . . . . . . 1 1 . 1 . 038 nuclear build full ' A' A ' 5' ' ' LEU . . . . . 0.438 ' O ' HD12 ' A' ' 5' ' ' LEU . 0.3 OUTLIER -79.88 -24.43 41.2 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.122 -0.49 . . . . 72.24 110.911 179.926 . . . . . . . . 3 3 . 1 . 038 nuclear build full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -51.92 -51.18 58.75 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.241 -0.436 . . . . 53.51 110.942 179.904 . . . . . . . . 2 2 . 1 . 038 nuclear build full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 10.4 t -66.63 -31.97 72.99 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.178 -0.465 . . . . 70.25 111.143 -179.935 . . . . . . . . 1 1 . 1 . 038 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -56.95 -26.29 59.33 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.191 -0.459 . . . . 73.3 110.905 -179.983 . . . . . . . . 2 2 . 1 . 038 nuclear build full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -81.86 -44.56 16.71 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.151 -0.477 . . . . 75.11 110.934 -179.879 . . . . . . . . 2 2 . 1 . 038 nuclear build full ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 20.9 m-85 -61.11 -27.88 68.7 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.101 -0.499 . . . . 73.23 110.926 -179.898 . . . . . . . . 1 1 . 1 . 038 nuclear build full ' A' A ' 11' ' ' ASP . . . . . 0.408 ' O ' HG22 ' A' ' 14' ' ' THR . 2.1 m-20 -68.46 -27.28 66.02 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.131 -0.486 . . . . 51.54 110.92 179.879 . . . . . . . . 2 2 . 1 . 038 nuclear build full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 46.3 t -84.43 -24.45 7.4 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.125 -0.489 . . . . 72.51 111.109 179.98 . . . . . . . . 1 1 . 1 . 038 nuclear build full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 9.7 ttp -105.4 6.37 32.5 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.229 -0.442 . . . . 72.44 110.876 179.939 . . . . . . . . 1 1 . 1 . 038 nuclear build full ' A' A ' 14' ' ' THR . . . . . 0.408 HG22 ' O ' ' A' ' 11' ' ' ASP . 6.0 t -70.02 -6.32 32.68 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.186 -0.461 . . . . 55.54 111.177 -179.981 . . . . . . . . 2 2 . 1 . 038 nuclear build full ' A' A ' 15' ' ' VAL . . . . . 0.662 HG12 ' O ' ' A' ' 15' ' ' VAL . 40.5 t -96.33 9.94 5.81 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.195 -0.457 . . . . 51.2 111.127 179.93 . . . . . . . . 2 2 . 1 . 038 nuclear build full ' A' A ' 16' ' ' ILE . . . . . 0.449 HG22 ' O ' ' A' ' 16' ' ' ILE . 10.6 mt -143.96 1.96 0.3 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.159 -0.473 . . . . 73.22 111.117 179.952 . . . . . . . . 2 2 . 1 . 038 nuclear build full ' A' A ' 17' ' ' SER . . . . . 0.817 ' C ' ' HD2' ' A' ' 19' ' ' PRO . 0.0 OUTLIER -99.64 -65.88 0.06 OUTLIER Pre-proline 0 C--N 1.329 -0.301 0 CA-C-O 121.688 0.756 . . . . 63.42 110.859 -179.934 . . . . . . . . 3 3 . 1 . 038 nuclear build full ' A' A ' 18' ' ' PRO . . . . . 0.923 ' N ' ' HD2' ' A' ' 19' ' ' PRO . 53.7 Cg_endo -69.73 -27.41 26.67 Favored 'Trans proline' 0 C--N 1.342 0.199 0 C-N-CA 122.691 2.261 . . . . 75.24 112.324 -179.999 . . . . . . . . 2 2 . 1 . 038 nuclear build full ' A' A ' 19' ' ' PRO . . . . . 0.923 ' HD2' ' N ' ' A' ' 18' ' ' PRO . 53.4 Cg_endo -69.82 -17.34 37.36 Favored 'Trans proline' 0 C--N 1.342 0.191 0 C-N-CA 122.691 2.26 . . . . 71.31 112.348 179.979 . . . . . . . . 2 2 . 1 . 038 nuclear build full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 6.2 tm-20 -83.06 -20.74 34.39 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.204 -0.453 . . . . 43.15 110.898 179.993 . . . . . . . . 1 1 . 1 . 038 nuclear build full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -58.64 -32.63 69.23 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.151 -0.477 . . . . 74.12 110.888 -179.916 . . . . . . . . 2 2 . 1 . 038 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.321 0 C-N-CA 120.761 -0.733 . . . . 52.31 112.506 -179.99 . . . . . . . . 0 0 . 1 . 039 nuclear build full ' A' A ' 1' ' ' TRP . . . . . . . . . . . . . 51.3 m0 . . . . . 0 C--O 1.231 0.097 0 CA-C-O 120.811 0.338 . . . . 75.14 110.89 . . . . . . . . . 0 0 . 1 . 039 nuclear build full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 3.5 ptt180 -51.64 156.86 2.09 Favored Pre-proline 0 C--N 1.329 -0.292 0 CA-C-O 121.604 0.716 . . . . 71.15 110.849 -179.952 . . . . . . . . 1 1 . 1 . 039 nuclear build full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_endo -69.73 153.57 68.91 Favored 'Trans proline' 0 C--N 1.342 0.204 0 C-N-CA 122.667 2.245 . . . . 34.13 112.373 179.945 . . . . . . . . 1 1 . 1 . 039 nuclear build full ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 5.5 t80 -134.57 -65.24 0.65 Allowed 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.24 -0.436 . . . . 61.11 110.896 -179.91 . . . . . . . . 1 1 . 1 . 039 nuclear build full ' A' A ' 5' ' ' LEU . . . . . 0.432 ' O ' HD12 ' A' ' 5' ' ' LEU . 0.3 OUTLIER -80.46 -24.5 39.48 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.12 -0.491 . . . . 72.03 110.924 179.961 . . . . . . . . 3 3 . 1 . 039 nuclear build full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 4.3 mm-40 -51.95 -49.81 62.43 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.179 -0.464 . . . . 61.22 110.907 179.924 . . . . . . . . 1 1 . 1 . 039 nuclear build full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 11.0 t -68.13 -31.8 71.64 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.219 -0.446 . . . . 62.15 111.102 -179.902 . . . . . . . . 1 1 . 1 . 039 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -55.73 -27.74 52.14 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.232 -0.44 . . . . 65.23 110.9 -179.986 . . . . . . . . 2 2 . 1 . 039 nuclear build full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -81.76 -44.65 16.72 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.154 -0.476 . . . . 75.3 110.943 -179.869 . . . . . . . . 2 2 . 1 . 039 nuclear build full ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 16.7 m-85 -63.13 -27.83 69.65 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.113 -0.494 . . . . 74.52 110.959 -179.938 . . . . . . . . 1 1 . 1 . 039 nuclear build full ' A' A ' 11' ' ' ASP . . . . . 0.471 ' O ' HG22 ' A' ' 14' ' ' THR . 3.3 t70 -67.98 -28.78 67.74 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.111 -0.495 . . . . 71.12 110.883 179.897 . . . . . . . . 2 2 . 1 . 039 nuclear build full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 59.0 t -82.55 -24.41 8.81 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.166 -0.47 . . . . 61.23 111.12 -179.979 . . . . . . . . 1 1 . 1 . 039 nuclear build full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 9.7 ttp -105.47 6.38 32.37 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.185 -0.461 . . . . 64.22 110.901 179.86 . . . . . . . . 1 1 . 1 . 039 nuclear build full ' A' A ' 14' ' ' THR . . . . . 0.471 HG22 ' O ' ' A' ' 11' ' ' ASP . 6.1 t -70.11 -6.37 33.56 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.235 -0.439 . . . . 73.42 111.193 -179.991 . . . . . . . . 2 2 . 1 . 039 nuclear build full ' A' A ' 15' ' ' VAL . . . . . 0.644 HG12 ' O ' ' A' ' 15' ' ' VAL . 40.5 t -96.26 9.91 5.79 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.164 -0.471 . . . . 75.41 111.119 179.891 . . . . . . . . 2 2 . 1 . 039 nuclear build full ' A' A ' 16' ' ' ILE . . . . . 0.455 HG22 ' O ' ' A' ' 16' ' ' ILE . 10.8 mt -143.93 2.04 0.31 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.192 -0.458 . . . . 75.21 111.121 179.899 . . . . . . . . 2 2 . 1 . 039 nuclear build full ' A' A ' 17' ' ' SER . . . . . 0.804 ' C ' ' HD2' ' A' ' 19' ' ' PRO . 0.0 OUTLIER -99.67 -65.89 0.06 OUTLIER Pre-proline 0 C--N 1.329 -0.303 0 CA-C-O 121.678 0.752 . . . . 62.13 110.861 -179.916 . . . . . . . . 3 3 . 1 . 039 nuclear build full ' A' A ' 18' ' ' PRO . . . . . 0.907 ' N ' ' HD2' ' A' ' 19' ' ' PRO . 53.7 Cg_endo -69.74 -27.44 26.55 Favored 'Trans proline' 0 C--N 1.341 0.168 0 C-N-CA 122.716 2.277 . . . . 61.23 112.341 179.995 . . . . . . . . 2 2 . 1 . 039 nuclear build full ' A' A ' 19' ' ' PRO . . . . . 0.907 ' HD2' ' N ' ' A' ' 18' ' ' PRO . 53.7 Cg_endo -69.81 -16.87 37.55 Favored 'Trans proline' 0 C--N 1.342 0.203 0 C-N-CA 122.65 2.234 . . . . 75.4 112.336 179.991 . . . . . . . . 2 2 . 1 . 039 nuclear build full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 1.1 mt-10 -82.83 -19.49 37.51 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.221 -0.445 . . . . 55.31 110.933 179.975 . . . . . . . . 1 1 . 1 . 039 nuclear build full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -59.68 -25.82 65.05 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.122 -0.49 . . . . 73.21 110.881 -179.965 . . . . . . . . 2 2 . 1 . 039 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.313 0 C-N-CA 120.73 -0.747 . . . . 52.34 112.483 -179.955 . . . . . . . . 0 0 . 1 . 040 nuclear build full ' A' A ' 1' ' ' TRP . . . . . . . . . . . . . 1.7 t90 . . . . . 0 C--O 1.23 0.076 0 CA-C-O 120.801 0.334 . . . . 65.32 110.962 . . . . . . . . . 0 0 . 1 . 040 nuclear build full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -117.41 72.36 7.16 Favored Pre-proline 0 C--N 1.329 -0.294 0 CA-C-O 121.573 0.702 . . . . 72.3 110.836 -179.913 . . . . . . . . 2 2 . 1 . 040 nuclear build full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.78 -172.27 0.56 Allowed 'Trans proline' 0 C--N 1.341 0.173 0 C-N-CA 122.661 2.241 . . . . 75.02 112.345 179.982 . . . . . . . . 1 1 . 1 . 040 nuclear build full ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 45.1 m-85 -134.12 -65.56 0.65 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.22 -0.445 . . . . 74.53 110.931 -179.896 . . . . . . . . 1 1 . 1 . 040 nuclear build full ' A' A ' 5' ' ' LEU . . . . . 0.424 ' O ' HD12 ' A' ' 5' ' ' LEU . 0.3 OUTLIER -79.77 -24.54 41.45 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.13 -0.486 . . . . 74.55 110.896 179.936 . . . . . . . . 3 3 . 1 . 040 nuclear build full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -54.38 -54.13 44.73 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.204 -0.453 . . . . 74.52 110.926 179.97 . . . . . . . . 2 2 . 1 . 040 nuclear build full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 12.3 t -59.33 -31.19 68.95 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.187 -0.46 . . . . 75.14 111.16 -179.956 . . . . . . . . 1 1 . 1 . 040 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -55.71 -26.1 43.5 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.196 -0.456 . . . . 64.4 110.856 -179.985 . . . . . . . . 2 2 . 1 . 040 nuclear build full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -88.93 -45.44 9.68 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.174 -0.466 . . . . 74.24 110.961 -179.834 . . . . . . . . 2 2 . 1 . 040 nuclear build full ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 16.4 m-85 -60.91 -26.5 67.51 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.11 -0.495 . . . . 71.44 110.932 -179.963 . . . . . . . . 1 1 . 1 . 040 nuclear build full ' A' A ' 11' ' ' ASP . . . . . 0.565 ' O ' HG22 ' A' ' 14' ' ' THR . 0.4 OUTLIER -63.21 -25.57 68.4 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.111 -0.495 . . . . 72.54 110.883 179.919 . . . . . . . . 3 3 . 1 . 040 nuclear build full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 48.5 t -81.03 -24.26 10.68 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 116.181 -0.463 . . . . 62.43 111.154 -179.989 . . . . . . . . 1 1 . 1 . 040 nuclear build full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 8.5 ttp -106.05 3.25 27.99 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.135 -0.484 . . . . 64.14 110.86 179.921 . . . . . . . . 1 1 . 1 . 040 nuclear build full ' A' A ' 14' ' ' THR . . . . . 0.565 HG22 ' O ' ' A' ' 11' ' ' ASP . 5.6 t -70.8 -5.72 32.36 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.217 -0.447 . . . . 72.33 111.142 -179.927 . . . . . . . . 2 2 . 1 . 040 nuclear build full ' A' A ' 15' ' ' VAL . . . . . 0.654 HG12 ' O ' ' A' ' 15' ' ' VAL . 40.3 t -96.33 9.09 6.37 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.18 -0.464 . . . . 44.0 111.163 179.88 . . . . . . . . 2 2 . 1 . 040 nuclear build full ' A' A ' 16' ' ' ILE . . . . . 0.452 HG22 ' O ' ' A' ' 16' ' ' ILE . 2.9 mp -142.78 2.26 0.38 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.136 -0.484 . . . . 72.41 111.128 179.934 . . . . . . . . 2 2 . 1 . 040 nuclear build full ' A' A ' 17' ' ' SER . . . . . 0.827 ' C ' ' HD2' ' A' ' 19' ' ' PRO . 0.0 OUTLIER -99.65 -65.79 0.06 OUTLIER Pre-proline 0 C--N 1.33 -0.281 0 CA-C-O 121.657 0.741 . . . . 61.45 110.844 -179.924 . . . . . . . . 3 3 . 1 . 040 nuclear build full ' A' A ' 18' ' ' PRO . . . . . 0.93 ' N ' ' HD2' ' A' ' 19' ' ' PRO . 53.4 Cg_endo -69.76 -27.33 26.62 Favored 'Trans proline' 0 C--N 1.342 0.195 0 C-N-CA 122.651 2.234 . . . . 75.22 112.315 -179.979 . . . . . . . . 2 2 . 1 . 040 nuclear build full ' A' A ' 19' ' ' PRO . . . . . 0.93 ' HD2' ' N ' ' A' ' 18' ' ' PRO . 53.3 Cg_endo -69.75 -17.09 37.82 Favored 'Trans proline' 0 C--N 1.341 0.18 0 C-N-CA 122.705 2.27 . . . . 75.54 112.321 179.986 . . . . . . . . 2 2 . 1 . 040 nuclear build full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -82.65 -19.72 37.68 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.184 -0.462 . . . . 72.5 110.857 -179.946 . . . . . . . . 2 2 . 1 . 040 nuclear build full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -59.57 -25.83 64.9 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.153 -0.476 . . . . 54.4 110.89 -179.913 . . . . . . . . 2 2 . 1 . 040 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.304 0 C-N-CA 120.739 -0.743 . . . . 50.43 112.476 -179.953 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 58.0 t . . . . . 0 N--CA 1.457 -0.086 0 CA-C-O 120.817 0.341 . . . . 71.4 111.163 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 10.5 ttp -101.73 33.23 3.06 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.172 -0.467 . . . . 72.34 110.879 179.899 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 5.7 t -85.96 -3.95 59.05 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.245 -0.434 . . . . 72.24 111.182 -179.985 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . 0.672 ' C ' ' HG3' ' A' ' 19' ' ' PRO . 24.5 t -93.78 4.75 7.77 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.228 -0.442 . . . . 74.12 111.119 179.927 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . 0.46 ' O ' HG22 ' A' ' 16' ' ' ILE . 9.5 mt -143.47 3.19 0.34 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.184 -0.462 . . . . 64.51 111.16 179.922 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 17' ' ' SER . . . . . 0.796 ' C ' ' HD2' ' A' ' 19' ' ' PRO . 0.5 OUTLIER -100.26 -68.44 0.04 OUTLIER Pre-proline 0 C--N 1.329 -0.294 0 CA-C-O 121.643 0.735 . . . . 74.02 110.836 -179.895 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 18' ' ' PRO . . . . . 0.918 ' N ' ' HD2' ' A' ' 19' ' ' PRO . 54.2 Cg_endo -69.71 -27.89 26.14 Favored 'Trans proline' 0 C--O 1.231 0.154 0 C-N-CA 122.664 2.243 . . . . 70.15 112.391 179.953 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 19' ' ' PRO . . . . . 0.918 ' HD2' ' N ' ' A' ' 18' ' ' PRO . 54.0 Cg_endo -69.68 -16.52 37.93 Favored 'Trans proline' 0 C--N 1.342 0.189 0 C-N-CA 122.704 2.269 . . . . 70.05 112.352 179.934 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 2.8 mt-10 -81.93 -19.4 40.83 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.248 -0.433 . . . . 73.01 110.906 -179.982 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -59.62 -25.74 64.9 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.175 -0.466 . . . . 72.43 110.864 -179.954 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.302 0 C-N-CA 120.688 -0.768 . . . . 60.12 112.484 -179.934 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 48.1 t . . . . . 0 C--O 1.231 0.116 0 CA-C-O 120.795 0.331 . . . . 63.33 111.174 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 10.5 ttp -101.97 33.34 3.08 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.153 -0.476 . . . . 75.13 110.847 179.926 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 5.5 t -86.09 -4.03 59.08 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.242 -0.435 . . . . 65.2 111.171 -179.957 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . 0.664 ' C ' ' HG3' ' A' ' 19' ' ' PRO . 25.4 t -92.9 4.12 7.69 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.212 -0.449 . . . . 71.53 111.087 179.965 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . 0.459 ' O ' HG22 ' A' ' 16' ' ' ILE . 9.5 mt -143.34 3.37 0.35 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.164 -0.471 . . . . 74.12 111.089 179.928 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 17' ' ' SER . . . . . 0.807 ' C ' ' HD2' ' A' ' 19' ' ' PRO . 0.5 OUTLIER -99.91 -68.73 0.04 OUTLIER Pre-proline 0 C--N 1.33 -0.28 0 CA-C-O 121.688 0.756 . . . . 71.02 110.876 -179.92 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 18' ' ' PRO . . . . . 0.908 ' N ' ' HD2' ' A' ' 19' ' ' PRO . 53.9 Cg_endo -69.77 -27.89 25.86 Favored 'Trans proline' 0 C--N 1.342 0.211 0 C-N-CA 122.683 2.256 . . . . 72.31 112.324 179.977 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 19' ' ' PRO . . . . . 0.908 ' HD2' ' N ' ' A' ' 18' ' ' PRO . 54.2 Cg_endo -69.7 -16.47 37.83 Favored 'Trans proline' 0 C--N 1.342 0.202 0 C-N-CA 122.702 2.268 . . . . 55.2 112.358 179.949 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 2.8 mt-10 -81.94 -19.89 39.76 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.207 -0.451 . . . . 74.43 110.89 -179.964 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -58.64 -34.73 71.52 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.129 -0.487 . . . . 70.42 110.842 -179.911 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.303 0 C-N-CA 120.697 -0.763 . . . . 60.42 112.491 -179.975 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 48.1 t . . . . . 0 C--O 1.231 0.108 0 CA-C-O 120.857 0.36 . . . . 73.51 111.168 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 10.5 ttp -102.06 33.36 3.09 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.182 -0.463 . . . . 65.41 110.899 179.908 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 5.5 t -86.16 -3.94 59.06 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.183 -0.462 . . . . 55.1 111.153 -179.935 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . 0.668 ' C ' ' HG3' ' A' ' 19' ' ' PRO . 25.4 t -92.94 4.13 7.7 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.219 -0.446 . . . . 73.55 111.124 179.898 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . 0.457 ' O ' HG22 ' A' ' 16' ' ' ILE . 9.5 mt -143.27 3.3 0.35 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 116.152 -0.476 . . . . 72.22 111.123 179.914 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 17' ' ' SER . . . . . 0.811 ' C ' ' HD2' ' A' ' 19' ' ' PRO . 0.5 OUTLIER -99.84 -68.78 0.04 OUTLIER Pre-proline 0 C--N 1.329 -0.313 0 CA-C-O 121.676 0.75 . . . . 70.14 110.893 -179.917 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 18' ' ' PRO . . . . . 0.92 ' N ' ' HD2' ' A' ' 19' ' ' PRO . 53.7 Cg_endo -69.77 -27.86 25.92 Favored 'Trans proline' 0 C--N 1.341 0.165 0 C-N-CA 122.673 2.249 . . . . 64.3 112.36 179.952 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 19' ' ' PRO . . . . . 0.92 ' HD2' ' N ' ' A' ' 18' ' ' PRO . 53.2 Cg_endo -69.77 -16.42 37.51 Favored 'Trans proline' 0 C--N 1.341 0.176 0 C-N-CA 122.668 2.246 . . . . 65.14 112.329 179.96 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 1.5 mt-10 -81.91 -19.52 40.65 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.207 -0.451 . . . . 62.23 110.871 -179.995 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -59.56 -25.71 64.79 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.178 -0.465 . . . . 71.02 110.911 -179.918 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.342 0 C-N-CA 120.752 -0.737 . . . . 53.33 112.469 -179.963 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 50.4 t . . . . . 0 C--O 1.23 0.074 0 CA-C-O 120.862 0.363 . . . . 72.53 111.141 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 10.4 ttp -102.26 33.7 3.01 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.13 -0.486 . . . . 65.14 110.884 179.926 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 5.8 t -86.47 -3.94 59.09 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.264 -0.425 . . . . 73.35 111.143 -179.912 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . 0.68 ' C ' ' HG3' ' A' ' 19' ' ' PRO . 24.3 t -93.87 4.1 8.21 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.208 -0.451 . . . . 72.42 111.155 179.911 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . 0.458 HG22 ' O ' ' A' ' 16' ' ' ILE . 2.8 mp -142.5 3.46 0.4 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.194 -0.457 . . . . 54.51 111.144 179.893 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 17' ' ' SER . . . . . 0.794 ' C ' ' HD2' ' A' ' 19' ' ' PRO . 0.5 OUTLIER -100.19 -68.43 0.04 OUTLIER Pre-proline 0 C--N 1.329 -0.296 0 CA-C-O 121.675 0.75 . . . . 74.34 110.895 -179.962 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 18' ' ' PRO . . . . . 0.919 ' N ' ' HD2' ' A' ' 19' ' ' PRO . 53.1 Cg_endo -69.73 -27.94 26.02 Favored 'Trans proline' 0 C--N 1.341 0.144 0 C-N-CA 122.73 2.286 . . . . 64.14 112.319 179.973 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 19' ' ' PRO . . . . . 0.919 ' HD2' ' N ' ' A' ' 18' ' ' PRO . 53.9 Cg_endo -69.71 -16.42 37.74 Favored 'Trans proline' 0 C--N 1.342 0.213 0 C-N-CA 122.651 2.234 . . . . 74.14 112.366 179.952 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -81.93 -19.76 40.08 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.207 -0.451 . . . . 75.41 110.863 -179.979 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -58.63 -32.93 69.5 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.151 -0.477 . . . . 62.44 110.896 -179.891 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.45 -0.372 0 C-N-CA 120.764 -0.732 . . . . 75.22 112.502 179.979 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 61.5 t . . . . . 0 C--O 1.231 0.101 0 CA-C-O 120.833 0.349 . . . . 70.02 111.132 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 10.4 ttp -102.05 33.84 2.91 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.159 -0.473 . . . . 53.14 110.882 179.955 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 5.8 t -86.59 -3.84 59.09 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.212 -0.449 . . . . 64.14 111.193 -179.949 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . 0.684 ' C ' ' HG3' ' A' ' 19' ' ' PRO . 24.2 t -93.94 4.07 8.27 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.191 -0.459 . . . . 71.13 111.132 179.904 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . 0.465 ' O ' HG22 ' A' ' 16' ' ' ILE . 2.8 mp -142.45 3.45 0.4 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.138 -0.483 . . . . 50.25 111.127 179.872 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 17' ' ' SER . . . . . 0.798 ' C ' ' HD2' ' A' ' 19' ' ' PRO . 0.5 OUTLIER -100.18 -68.41 0.04 OUTLIER Pre-proline 0 C--N 1.329 -0.291 0 CA-C-O 121.661 0.743 . . . . 72.23 110.884 -179.952 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 18' ' ' PRO . . . . . 0.919 ' N ' ' HD2' ' A' ' 19' ' ' PRO . 53.6 Cg_endo -69.75 -27.84 26.03 Favored 'Trans proline' 0 N--CA 1.465 -0.159 0 C-N-CA 122.716 2.277 . . . . 71.32 112.37 179.961 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 19' ' ' PRO . . . . . 0.919 ' HD2' ' N ' ' A' ' 18' ' ' PRO . 54.1 Cg_endo -69.77 -16.41 37.5 Favored 'Trans proline' 0 C--N 1.342 0.203 0 C-N-CA 122.624 2.216 . . . . 72.33 112.361 179.932 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -81.95 -19.85 39.84 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.206 -0.452 . . . . 72.5 110.879 -179.949 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -58.65 -34.54 71.31 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.125 -0.488 . . . . 71.52 110.864 -179.907 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.279 0 C-N-CA 120.748 -0.739 . . . . 52.33 112.427 -179.979 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 42.4 t . . . . . 0 C--O 1.23 0.07 0 CA-C-O 120.84 0.352 . . . . 75.03 111.124 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 10.3 ttp -102.02 33.77 2.93 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.183 -0.462 . . . . 74.11 110.884 179.928 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 5.8 t -86.5 -3.91 59.09 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.214 -0.448 . . . . 64.34 111.172 -179.978 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . 0.679 ' C ' ' HG3' ' A' ' 19' ' ' PRO . 24.1 t -93.86 4.07 8.22 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.243 -0.435 . . . . 62.11 111.107 179.933 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . 0.463 ' O ' HG22 ' A' ' 16' ' ' ILE . 2.8 mp -142.48 3.45 0.4 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.197 -0.456 . . . . 64.31 111.124 179.916 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 17' ' ' SER . . . . . 0.811 ' C ' ' HD2' ' A' ' 19' ' ' PRO . 0.5 OUTLIER -100.23 -68.42 0.04 OUTLIER Pre-proline 0 C--N 1.329 -0.293 0 CA-C-O 121.629 0.728 . . . . 72.12 110.838 -179.936 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 18' ' ' PRO . . . . . 0.911 ' N ' ' HD2' ' A' ' 19' ' ' PRO . 54.0 Cg_endo -69.72 -27.93 26.07 Favored 'Trans proline' 0 C--N 1.341 0.153 0 C-N-CA 122.726 2.284 . . . . 71.12 112.338 179.995 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 19' ' ' PRO . . . . . 0.911 ' HD2' ' N ' ' A' ' 18' ' ' PRO . 54.1 Cg_endo -69.69 -16.44 37.84 Favored 'Trans proline' 0 C--N 1.341 0.172 0 C-N-CA 122.704 2.27 . . . . 53.24 112.365 179.958 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -81.99 -19.51 40.39 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.184 -0.462 . . . . 74.42 110.852 -179.953 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -59.54 -25.72 64.75 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.139 -0.482 . . . . 72.51 110.912 -179.954 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.347 0 C-N-CA 120.795 -0.717 . . . . 71.24 112.496 -179.968 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 41.4 t . . . . . 0 C--O 1.231 0.116 0 CA-C-O 120.82 0.343 . . . . 53.13 111.121 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 9.4 ttp -102.24 32.78 3.36 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.212 -0.449 . . . . 73.03 110.872 179.928 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 5.9 t -86.78 -3.76 59.09 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.209 -0.45 . . . . 74.42 111.143 -179.899 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . 0.69 ' C ' ' HG3' ' A' ' 19' ' ' PRO . 23.2 t -94.25 4.58 8.13 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.187 -0.461 . . . . 64.42 111.122 179.904 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . 0.461 ' O ' HG22 ' A' ' 16' ' ' ILE . 2.8 mp -142.46 3.28 0.4 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.157 -0.474 . . . . 74.01 111.149 179.892 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 17' ' ' SER . . . . . 0.791 ' C ' ' HD2' ' A' ' 19' ' ' PRO . 0.5 OUTLIER -100.27 -68.24 0.05 OUTLIER Pre-proline 0 C--N 1.33 -0.272 0 CA-C-O 121.688 0.756 . . . . 75.3 110.926 -179.965 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 18' ' ' PRO . . . . . 0.929 ' N ' ' HD2' ' A' ' 19' ' ' PRO . 53.8 Cg_endo -69.79 -27.8 25.88 Favored 'Trans proline' 0 C--N 1.342 0.206 0 C-N-CA 122.681 2.254 . . . . 73.13 112.362 179.946 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 19' ' ' PRO . . . . . 0.929 ' HD2' ' N ' ' A' ' 18' ' ' PRO . 53.5 Cg_endo -69.77 -16.46 37.54 Favored 'Trans proline' 0 C--N 1.342 0.205 0 C-N-CA 122.717 2.278 . . . . 55.15 112.32 179.949 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -81.94 -19.91 39.72 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.249 -0.432 . . . . 73.02 110.909 -179.954 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -58.57 -34.34 70.96 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.136 -0.484 . . . . 72.45 110.866 -179.934 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.296 0 C-N-CA 120.775 -0.726 . . . . 64.11 112.488 -179.906 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 64.1 t . . . . . 0 C--O 1.231 0.091 0 CA-C-O 120.822 0.344 . . . . 75.12 111.152 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 10.4 ttp -101.74 33.28 3.05 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.188 -0.46 . . . . 72.33 110.863 179.897 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 5.7 t -86.02 -3.97 59.06 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.219 -0.446 . . . . 61.13 111.162 -179.956 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . 0.669 ' C ' ' HG3' ' A' ' 19' ' ' PRO . 24.4 t -93.84 4.85 7.74 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.191 -0.459 . . . . 53.24 111.11 179.95 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . 0.459 ' O ' HG22 ' A' ' 16' ' ' ILE . 9.6 mt -143.47 3.04 0.34 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 116.177 -0.465 . . . . 72.3 111.121 179.943 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 17' ' ' SER . . . . . 0.805 ' C ' ' HD2' ' A' ' 19' ' ' PRO . 0.5 OUTLIER -100.18 -68.39 0.04 OUTLIER Pre-proline 0 C--N 1.329 -0.295 0 CA-C-O 121.613 0.72 . . . . 75.4 110.837 -179.911 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 18' ' ' PRO . . . . . 0.909 ' N ' ' HD2' ' A' ' 19' ' ' PRO . 54.0 Cg_endo -69.74 -27.89 26.01 Favored 'Trans proline' 0 C--O 1.232 0.203 0 C-N-CA 122.657 2.238 . . . . 72.31 112.339 179.983 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 19' ' ' PRO . . . . . 0.909 ' HD2' ' N ' ' A' ' 18' ' ' PRO . 54.1 Cg_endo -69.71 -16.78 37.91 Favored 'Trans proline' 0 C--N 1.341 0.155 0 C-N-CA 122.725 2.284 . . . . 63.0 112.383 179.921 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 24.4 tt0 -82.55 -21.26 35.41 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.177 -0.465 . . . . 64.21 110.906 179.991 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -58.22 -34.16 70.11 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.173 -0.467 . . . . 74.12 110.864 -179.92 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.292 0 C-N-CA 120.755 -0.736 . . . . 73.32 112.475 -179.957 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 58.5 t . . . . . 0 C--O 1.23 0.066 0 CA-C-O 120.833 0.349 . . . . 72.32 111.142 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 10.5 ttp -102.08 33.88 2.9 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.167 -0.469 . . . . 63.24 110.906 179.878 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 5.6 t -86.67 -3.92 59.1 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.198 -0.455 . . . . 73.42 111.186 -179.944 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . 0.686 ' C ' ' HG3' ' A' ' 19' ' ' PRO . 25.0 t -93.07 3.49 8.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.17 -0.468 . . . . 44.13 111.094 179.937 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . 0.458 ' O ' HG22 ' A' ' 16' ' ' ILE . 2.8 mp -142.45 3.71 0.4 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.171 -0.468 . . . . 62.21 111.121 179.929 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 17' ' ' SER . . . . . 0.805 ' C ' ' HD2' ' A' ' 19' ' ' PRO . 0.5 OUTLIER -99.92 -68.77 0.04 OUTLIER Pre-proline 0 C--N 1.329 -0.303 0 CA-C-O 121.681 0.753 . . . . 44.1 110.904 -179.951 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 18' ' ' PRO . . . . . 0.92 ' N ' ' HD2' ' A' ' 19' ' ' PRO . 53.7 Cg_endo -69.82 -27.86 25.69 Favored 'Trans proline' 0 C--O 1.231 0.174 0 C-N-CA 122.675 2.25 . . . . 71.51 112.334 179.963 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 19' ' ' PRO . . . . . 0.92 ' HD2' ' N ' ' A' ' 18' ' ' PRO . 53.7 Cg_endo -69.78 -16.48 37.51 Favored 'Trans proline' 0 C--N 1.341 0.145 0 C-N-CA 122.701 2.267 . . . . 74.04 112.372 179.938 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 1.5 mt-10 -81.94 -19.89 39.75 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.193 -0.458 . . . . 71.42 110.911 -179.984 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -58.59 -34.43 71.08 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.119 -0.491 . . . . 75.54 110.848 -179.91 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.289 0 C-N-CA 120.715 -0.755 . . . . 73.35 112.529 -179.929 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 23.5 t . . . . . 0 N--CA 1.457 -0.081 0 CA-C-O 120.831 0.348 . . . . 62.51 111.152 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 10.5 ttp -102.12 33.97 2.88 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.112 -0.494 . . . . 75.22 110.878 179.937 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 5.7 t -86.68 -4.0 59.12 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.247 -0.433 . . . . 70.32 111.158 -179.927 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . 0.679 ' C ' ' HG3' ' A' ' 19' ' ' PRO . 25.0 t -92.98 3.43 8.18 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 116.198 -0.455 . . . . 63.14 111.129 179.932 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . 0.452 ' O ' HG22 ' A' ' 16' ' ' ILE . 2.8 mp -142.37 3.68 0.41 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.175 -0.466 . . . . 74.44 111.178 179.95 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 17' ' ' SER . . . . . 0.809 ' C ' ' HD2' ' A' ' 19' ' ' PRO . 0.5 OUTLIER -99.95 -68.81 0.04 OUTLIER Pre-proline 0 C--N 1.33 -0.268 0 CA-C-O 121.615 0.721 . . . . 73.44 110.846 -179.942 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 18' ' ' PRO . . . . . 0.927 ' N ' ' HD2' ' A' ' 19' ' ' PRO . 54.5 Cg_endo -69.68 -27.88 26.3 Favored 'Trans proline' 0 C--N 1.341 0.166 0 C-N-CA 122.681 2.254 . . . . 52.45 112.379 179.939 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 19' ' ' PRO . . . . . 0.927 ' HD2' ' N ' ' A' ' 18' ' ' PRO . 53.9 Cg_endo -69.75 -16.57 37.65 Favored 'Trans proline' 0 C--N 1.341 0.151 0 C-N-CA 122.689 2.259 . . . . 62.32 112.378 179.922 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -81.85 -19.91 40.04 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.186 -0.461 . . . . 74.02 110.906 -179.982 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -58.54 -33.4 69.85 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.14 -0.482 . . . . 73.54 110.883 -179.933 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.314 0 C-N-CA 120.715 -0.755 . . . . 72.44 112.516 -179.929 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 61.9 t . . . . . 0 C--O 1.231 0.106 0 CA-C-O 120.801 0.334 . . . . 75.03 111.102 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 10.3 ttp -101.94 33.76 2.92 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.191 -0.459 . . . . 73.45 110.906 179.908 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 5.8 t -86.48 -3.93 59.09 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.236 -0.438 . . . . 54.11 111.177 -179.972 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . 0.673 ' C ' ' HG3' ' A' ' 19' ' ' PRO . 24.1 t -93.85 4.07 8.22 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.207 -0.451 . . . . 72.41 111.111 179.924 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . 0.461 ' O ' HG22 ' A' ' 16' ' ' ILE . 2.8 mp -142.49 3.43 0.4 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.225 -0.443 . . . . 74.43 111.128 179.954 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 17' ' ' SER . . . . . 0.811 ' C ' ' HD2' ' A' ' 19' ' ' PRO . 0.5 OUTLIER -100.24 -68.39 0.04 OUTLIER Pre-proline 0 C--N 1.33 -0.239 0 CA-C-O 121.639 0.733 . . . . 55.23 110.832 -179.91 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 18' ' ' PRO . . . . . 0.908 ' N ' ' HD2' ' A' ' 19' ' ' PRO . 53.6 Cg_endo -69.73 -27.89 26.07 Favored 'Trans proline' 0 C--N 1.341 0.179 0 C-N-CA 122.746 2.297 . . . . 72.44 112.298 179.994 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 19' ' ' PRO . . . . . 0.908 ' HD2' ' N ' ' A' ' 18' ' ' PRO . 53.4 Cg_endo -69.76 -16.45 37.58 Favored 'Trans proline' 0 C--N 1.342 0.187 0 C-N-CA 122.687 2.258 . . . . 72.25 112.355 179.972 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -81.9 -19.88 39.92 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.235 -0.439 . . . . 71.24 110.924 179.987 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -58.68 -33.95 70.72 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.123 -0.49 . . . . 73.12 110.874 -179.928 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.326 0 C-N-CA 120.782 -0.723 . . . . 61.31 112.469 -179.962 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 57.6 t . . . . . 0 C--O 1.231 0.084 0 CA-C-O 120.762 0.315 . . . . 72.42 111.122 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 10.3 ttp -102.0 33.75 2.94 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.184 -0.462 . . . . 74.24 110.86 179.898 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 5.8 t -86.52 -3.89 59.09 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.234 -0.439 . . . . 32.45 111.136 -179.948 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . 0.686 ' C ' ' HG3' ' A' ' 19' ' ' PRO . 24.3 t -93.88 4.07 8.23 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.232 -0.44 . . . . 62.43 111.116 179.926 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . 0.453 ' O ' HG22 ' A' ' 16' ' ' ILE . 2.8 mp -142.44 3.4 0.4 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.188 -0.46 . . . . 54.04 111.143 179.911 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 17' ' ' SER . . . . . 0.806 ' C ' ' HD2' ' A' ' 19' ' ' PRO . 0.5 OUTLIER -100.2 -68.36 0.04 OUTLIER Pre-proline 0 C--N 1.329 -0.325 0 CA-C-O 121.642 0.734 . . . . 63.14 110.865 -179.88 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 18' ' ' PRO . . . . . 0.915 ' N ' ' HD2' ' A' ' 19' ' ' PRO . 53.5 Cg_endo -69.82 -27.88 25.62 Favored 'Trans proline' 0 C--N 1.341 0.158 0 C-N-CA 122.678 2.252 . . . . 61.33 112.323 179.985 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 19' ' ' PRO . . . . . 0.915 ' HD2' ' N ' ' A' ' 18' ' ' PRO . 53.9 Cg_endo -69.74 -16.82 37.81 Favored 'Trans proline' 0 C--N 1.341 0.168 0 C-N-CA 122.73 2.287 . . . . 70.44 112.323 179.929 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 29.4 tt0 -82.52 -21.29 35.46 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.243 -0.435 . . . . 74.12 110.887 -179.969 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -58.28 -31.34 67.37 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.144 -0.48 . . . . 61.42 110.842 -179.884 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.325 0 C-N-CA 120.716 -0.754 . . . . 63.13 112.52 -179.945 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 60.8 t . . . . . 0 C--O 1.231 0.083 0 CA-C-O 120.81 0.338 . . . . 70.41 111.077 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 10.4 ttp -102.2 34.27 2.79 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.193 -0.458 . . . . 62.12 110.895 179.923 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 5.6 t -86.85 -4.05 59.13 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.243 -0.435 . . . . 72.14 111.162 -179.964 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . 0.686 ' C ' ' HG3' ' A' ' 19' ' ' PRO . 24.6 t -93.0 3.45 8.18 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.217 -0.447 . . . . 61.23 111.09 179.93 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . 0.463 ' O ' HG22 ' A' ' 16' ' ' ILE . 2.8 mp -142.3 3.63 0.41 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 116.19 -0.459 . . . . 75.3 111.132 179.942 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 17' ' ' SER . . . . . 0.789 ' C ' ' HD2' ' A' ' 19' ' ' PRO . 0.5 OUTLIER -99.91 -68.8 0.04 OUTLIER Pre-proline 0 C--N 1.329 -0.326 0 CA-C-O 121.618 0.723 . . . . 63.12 110.869 -179.89 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 18' ' ' PRO . . . . . 0.918 ' N ' ' HD2' ' A' ' 19' ' ' PRO . 53.3 Cg_endo -69.77 -27.91 25.86 Favored 'Trans proline' 0 C--O 1.231 0.168 0 C-N-CA 122.738 2.292 . . . . 72.41 112.326 179.975 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 19' ' ' PRO . . . . . 0.918 ' HD2' ' N ' ' A' ' 18' ' ' PRO . 54.1 Cg_endo -69.76 -16.24 37.48 Favored 'Trans proline' 0 C--N 1.341 0.181 0 C-N-CA 122.715 2.276 . . . . 64.33 112.335 179.956 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 1.8 mt-10 -82.12 -19.74 39.45 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.221 -0.445 . . . . 72.23 110.891 -179.973 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -59.39 -25.6 64.41 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.167 -0.469 . . . . 75.2 110.88 -179.891 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.45 -0.368 0 C-N-CA 120.771 -0.728 . . . . 62.51 112.513 -179.985 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 47.5 t . . . . . 0 N--CA 1.457 -0.077 0 CA-C-O 120.835 0.35 . . . . 62.32 111.092 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 10.4 ttp -102.01 33.9 2.89 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.163 -0.471 . . . . 73.14 110.92 179.903 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 5.6 t -86.71 -3.91 59.11 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.206 -0.452 . . . . 73.35 111.175 -179.913 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . 0.673 ' C ' ' HG3' ' A' ' 19' ' ' PRO . 24.7 t -93.04 3.44 8.21 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.194 -0.457 . . . . 74.1 111.155 179.866 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . 0.457 ' O ' HG22 ' A' ' 16' ' ' ILE . 2.8 mp -142.31 3.67 0.41 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.17 -0.468 . . . . 53.34 111.138 179.89 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 17' ' ' SER . . . . . 0.795 ' C ' ' HD2' ' A' ' 19' ' ' PRO . 0.5 OUTLIER -99.91 -68.78 0.04 OUTLIER Pre-proline 0 C--N 1.33 -0.274 0 CA-C-O 121.664 0.745 . . . . 74.22 110.848 -179.889 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 18' ' ' PRO . . . . . 0.913 ' N ' ' HD2' ' A' ' 19' ' ' PRO . 53.6 Cg_endo -69.75 -27.95 25.91 Favored 'Trans proline' 0 C--N 1.341 0.167 0 C-N-CA 122.752 2.301 . . . . 62.54 112.335 179.974 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 19' ' ' PRO . . . . . 0.913 ' HD2' ' N ' ' A' ' 18' ' ' PRO . 53.7 Cg_endo -69.81 -16.71 37.48 Favored 'Trans proline' 0 C--N 1.342 0.188 0 C-N-CA 122.66 2.24 . . . . 72.23 112.361 179.939 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 60.2 tt0 -82.63 -21.28 35.13 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.216 -0.447 . . . . 74.11 110.854 179.994 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -58.19 -34.24 70.15 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.223 -0.444 . . . . 74.45 110.83 -179.876 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.271 0 C-N-CA 120.754 -0.736 . . . . 61.42 112.465 -179.953 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 53.4 t . . . . . 0 C--O 1.23 0.064 0 CA-C-O 120.825 0.345 . . . . 51.0 111.135 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 10.5 ttp -101.68 33.22 3.06 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.171 -0.468 . . . . 72.25 110.9 179.887 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 5.7 t -85.92 -4.01 59.06 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.223 -0.444 . . . . 71.15 111.14 -179.94 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . 0.68 ' C ' ' HG3' ' A' ' 19' ' ' PRO . 24.5 t -93.78 4.77 7.76 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.229 -0.441 . . . . 73.12 111.13 179.966 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . 0.447 ' O ' HG22 ' A' ' 16' ' ' ILE . 9.7 mt -143.49 3.2 0.34 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.156 -0.474 . . . . 71.1 111.097 179.927 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 17' ' ' SER . . . . . 0.791 ' C ' ' HD2' ' A' ' 19' ' ' PRO . 0.5 OUTLIER -100.27 -68.42 0.04 OUTLIER Pre-proline 0 C--N 1.329 -0.291 0 CA-C-O 121.674 0.749 . . . . 73.35 110.839 -179.911 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 18' ' ' PRO . . . . . 0.912 ' N ' ' HD2' ' A' ' 19' ' ' PRO . 54.4 Cg_endo -69.71 -27.88 26.17 Favored 'Trans proline' 0 C--O 1.232 0.184 0 C-N-CA 122.683 2.255 . . . . 73.44 112.373 179.933 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 19' ' ' PRO . . . . . 0.912 ' HD2' ' N ' ' A' ' 18' ' ' PRO . 54.4 Cg_endo -69.72 -16.43 37.74 Favored 'Trans proline' 0 C--N 1.341 0.149 0 C-N-CA 122.693 2.262 . . . . 64.41 112.38 179.906 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 2.9 mt-10 -81.91 -19.92 39.83 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.194 -0.457 . . . . 74.31 110.901 -179.998 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -58.61 -34.4 71.09 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.127 -0.488 . . . . 73.23 110.914 -179.916 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.266 0 C-N-CA 120.766 -0.731 . . . . 45.15 112.472 -179.981 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 26.0 t . . . . . 0 C--O 1.231 0.117 0 CA-C-O 120.767 0.318 . . . . 53.12 111.086 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 10.6 ttp -101.93 33.43 3.04 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.215 -0.448 . . . . 64.31 110.894 179.901 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 5.5 t -86.12 -4.04 59.08 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.194 -0.457 . . . . 74.53 111.139 -179.94 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . 0.664 ' C ' ' HG3' ' A' ' 19' ' ' PRO . 25.8 t -92.89 4.15 7.66 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-N 116.228 -0.442 . . . . 52.3 111.113 179.901 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . 0.458 ' O ' HG22 ' A' ' 16' ' ' ILE . 9.3 mt -143.34 3.4 0.35 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.195 -0.457 . . . . 61.35 111.102 179.901 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 17' ' ' SER . . . . . 0.792 ' C ' ' HD2' ' A' ' 19' ' ' PRO . 0.5 OUTLIER -99.9 -68.75 0.04 OUTLIER Pre-proline 0 C--N 1.329 -0.295 0 CA-C-O 121.683 0.754 . . . . 73.44 110.882 -179.94 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 18' ' ' PRO . . . . . 0.93 ' N ' ' HD2' ' A' ' 19' ' ' PRO . 53.3 Cg_endo -69.83 -27.79 25.72 Favored 'Trans proline' 0 C--N 1.341 0.168 0 C-N-CA 122.673 2.248 . . . . 74.23 112.333 179.994 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 19' ' ' PRO . . . . . 0.93 ' HD2' ' N ' ' A' ' 18' ' ' PRO . 53.3 Cg_endo -69.82 -16.43 37.3 Favored 'Trans proline' 0 C--N 1.342 0.193 0 C-N-CA 122.683 2.255 . . . . 62.31 112.301 179.957 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -81.91 -19.55 40.57 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.267 -0.424 . . . . 73.51 110.872 -179.965 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -59.78 -25.77 65.18 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.144 -0.48 . . . . 71.52 110.827 -179.887 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.299 0 C-N-CA 120.75 -0.738 . . . . 55.11 112.527 -179.991 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 56.4 t . . . . . 0 C--O 1.23 0.051 0 CA-C-O 120.826 0.346 . . . . 74.35 111.154 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 10.4 ttp -102.23 33.7 3.0 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.117 -0.492 . . . . 74.12 110.883 179.931 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 5.8 t -86.49 -3.89 59.08 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.203 -0.453 . . . . 63.11 111.153 -179.912 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . 0.688 ' C ' ' HG3' ' A' ' 19' ' ' PRO . 24.0 t -93.88 4.07 8.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.186 -0.461 . . . . 64.22 111.131 179.928 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . 0.45 ' O ' HG22 ' A' ' 16' ' ' ILE . 2.8 mp -142.47 3.41 0.4 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.172 -0.467 . . . . 70.22 111.176 179.898 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 17' ' ' SER . . . . . 0.797 ' C ' ' HD2' ' A' ' 19' ' ' PRO . 0.5 OUTLIER -100.16 -68.48 0.04 OUTLIER Pre-proline 0 C--N 1.328 -0.33 0 CA-C-O 121.654 0.74 . . . . 73.21 110.877 -179.941 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 18' ' ' PRO . . . . . 0.914 ' N ' ' HD2' ' A' ' 19' ' ' PRO . 53.6 Cg_endo -69.74 -27.84 26.09 Favored 'Trans proline' 0 C--N 1.341 0.178 0 C-N-CA 122.701 2.268 . . . . 74.11 112.344 179.987 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 19' ' ' PRO . . . . . 0.914 ' HD2' ' N ' ' A' ' 18' ' ' PRO . 53.5 Cg_endo -69.77 -16.5 37.55 Favored 'Trans proline' 0 C--N 1.342 0.216 0 C-N-CA 122.685 2.257 . . . . 71.01 112.339 179.943 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -81.85 -19.85 40.16 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.222 -0.444 . . . . 71.34 110.908 179.999 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -58.65 -34.52 71.29 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.172 -0.467 . . . . 72.33 110.832 -179.9 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.352 0 C-N-CA 120.744 -0.741 . . . . 70.11 112.506 -179.946 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 21.9 t . . . . . 0 N--CA 1.457 -0.086 0 CA-C-O 120.823 0.344 . . . . 53.04 111.149 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 10.5 ttp -102.21 33.85 2.94 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.182 -0.463 . . . . 41.34 110.856 179.939 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 5.6 t -86.62 -3.98 59.11 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.23 -0.441 . . . . 71.2 111.145 -179.939 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . 0.68 ' C ' ' HG3' ' A' ' 19' ' ' PRO . 25.3 t -93.01 3.47 8.17 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.201 -0.454 . . . . 41.41 111.143 179.912 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . 0.464 ' O ' HG22 ' A' ' 16' ' ' ILE . 2.8 mp -142.39 3.68 0.41 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.139 -0.482 . . . . 73.13 111.127 179.913 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 17' ' ' SER . . . . . 0.798 ' C ' ' HD2' ' A' ' 19' ' ' PRO . 0.5 OUTLIER -99.9 -68.78 0.04 OUTLIER Pre-proline 0 C--N 1.329 -0.287 0 CA-C-O 121.678 0.751 . . . . 61.21 110.831 -179.906 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 18' ' ' PRO . . . . . 0.926 ' N ' ' HD2' ' A' ' 19' ' ' PRO . 54.0 Cg_endo -69.78 -27.88 25.86 Favored 'Trans proline' 0 C--O 1.232 0.182 0 C-N-CA 122.664 2.243 . . . . 41.33 112.361 179.982 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 19' ' ' PRO . . . . . 0.926 ' HD2' ' N ' ' A' ' 18' ' ' PRO . 53.6 Cg_endo -69.82 -16.38 37.3 Favored 'Trans proline' 0 C--N 1.341 0.155 0 C-N-CA 122.713 2.275 . . . . 72.13 112.322 179.964 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -82.01 -19.85 39.63 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.248 -0.433 . . . . 75.32 110.868 -179.977 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -58.66 -34.36 71.14 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.12 -0.491 . . . . 74.44 110.832 -179.88 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.45 -0.367 0 C-N-CA 120.696 -0.764 . . . . 45.24 112.529 -179.97 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 25.9 t . . . . . 0 C--O 1.23 0.056 0 CA-C-O 120.862 0.363 . . . . 74.15 111.127 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 10.5 ttp -102.22 33.93 2.92 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.146 -0.479 . . . . 75.14 110.878 179.959 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 5.7 t -86.7 -3.91 59.11 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.213 -0.449 . . . . 71.11 111.118 -179.897 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . 0.683 ' C ' ' HG3' ' A' ' 19' ' ' PRO . 25.1 t -93.06 3.48 8.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.233 -0.44 . . . . 71.15 111.171 179.884 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . 0.462 ' O ' HG22 ' A' ' 16' ' ' ILE . 2.8 mp -142.36 3.63 0.41 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.108 -0.497 . . . . 63.32 111.128 179.912 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 17' ' ' SER . . . . . 0.79 ' C ' ' HD2' ' A' ' 19' ' ' PRO . 0.5 OUTLIER -99.89 -68.8 0.04 OUTLIER Pre-proline 0 C--N 1.329 -0.287 0 CA-C-O 121.631 0.729 . . . . 71.22 110.874 -179.914 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 18' ' ' PRO . . . . . 0.918 ' N ' ' HD2' ' A' ' 19' ' ' PRO . 53.9 Cg_endo -69.75 -27.88 25.99 Favored 'Trans proline' 0 C--N 1.341 0.175 0 C-N-CA 122.672 2.248 . . . . 73.51 112.387 179.952 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 19' ' ' PRO . . . . . 0.918 ' HD2' ' N ' ' A' ' 18' ' ' PRO . 53.4 Cg_endo -69.79 -16.43 37.44 Favored 'Trans proline' 0 C--N 1.342 0.203 0 C-N-CA 122.686 2.258 . . . . 43.13 112.323 179.97 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -81.95 -19.83 39.85 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.228 -0.442 . . . . 72.14 110.893 -179.991 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -58.65 -32.52 69.15 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.145 -0.479 . . . . 74.22 110.904 -179.919 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.312 0 C-N-CA 120.771 -0.728 . . . . 73.25 112.494 -179.94 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 39.7 t . . . . . 0 C--O 1.231 0.08 0 CA-C-O 120.812 0.339 . . . . 73.21 111.139 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 10.4 ttp -102.0 33.98 2.86 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.174 -0.466 . . . . 42.24 110.871 179.939 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 5.8 t -86.64 -3.87 59.09 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.258 -0.428 . . . . 53.44 111.108 -179.896 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . 0.683 ' C ' ' HG3' ' A' ' 19' ' ' PRO . 24.7 t -93.77 3.97 8.23 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.23 -0.441 . . . . 75.22 111.141 179.885 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . 0.463 HG22 ' O ' ' A' ' 16' ' ' ILE . 2.8 mp -142.52 3.49 0.4 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.183 -0.462 . . . . 73.13 111.099 179.922 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 17' ' ' SER . . . . . 0.794 ' C ' ' HD2' ' A' ' 19' ' ' PRO . 0.5 OUTLIER -100.25 -68.42 0.04 OUTLIER Pre-proline 0 C--N 1.329 -0.305 0 CA-C-O 121.656 0.741 . . . . 64.01 110.85 -179.923 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 18' ' ' PRO . . . . . 0.929 ' N ' ' HD2' ' A' ' 19' ' ' PRO . 53.7 Cg_endo -69.76 -27.81 26.01 Favored 'Trans proline' 0 C--N 1.342 0.199 0 C-N-CA 122.612 2.208 . . . . 61.1 112.363 179.97 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 19' ' ' PRO . . . . . 0.929 ' HD2' ' N ' ' A' ' 18' ' ' PRO . 53.8 Cg_endo -69.74 -16.52 37.68 Favored 'Trans proline' 0 C--N 1.341 0.156 0 C-N-CA 122.699 2.266 . . . . 74.45 112.326 179.948 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 2.1 mt-10 -81.88 -19.94 39.86 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.216 -0.447 . . . . 52.41 110.907 -179.975 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -58.56 -33.13 69.59 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.145 -0.479 . . . . 73.2 110.858 -179.908 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.286 0 C-N-CA 120.725 -0.75 . . . . 15.15 112.489 -179.964 . . . . . . . . 0 0 . 1 . 021 nuclear nobuild core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 56.4 t . . . . . 0 C--O 1.231 0.091 0 CA-C-O 120.84 0.352 . . . . 73.34 111.146 . . . . . . . . . 0 0 . 1 . 021 nuclear nobuild core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 10.6 ttp -101.91 33.43 3.03 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.124 -0.489 . . . . 62.23 110.906 179.906 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 5.5 t -86.15 -4.04 59.08 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.178 -0.465 . . . . 52.02 111.099 -179.908 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . 0.666 ' C ' ' HG3' ' A' ' 19' ' ' PRO . 25.5 t -92.91 4.11 7.7 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.262 -0.426 . . . . 55.21 111.095 179.948 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . 0.449 ' O ' HG22 ' A' ' 16' ' ' ILE . 9.4 mt -143.28 3.37 0.35 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.196 -0.456 . . . . 65.12 111.172 179.913 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 17' ' ' SER . . . . . 0.791 ' C ' ' HD2' ' A' ' 19' ' ' PRO . 0.5 OUTLIER -99.98 -68.78 0.04 OUTLIER Pre-proline 0 C--N 1.33 -0.274 0 CA-C-O 121.633 0.73 . . . . 74.33 110.825 -179.843 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' A' A ' 18' ' ' PRO . . . . . 0.925 ' N ' ' HD2' ' A' ' 19' ' ' PRO . 53.6 Cg_endo -69.79 -27.83 25.87 Favored 'Trans proline' 0 C--O 1.231 0.171 0 C-N-CA 122.72 2.28 . . . . 61.33 112.339 179.96 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 19' ' ' PRO . . . . . 0.925 ' HD2' ' N ' ' A' ' 18' ' ' PRO . 53.9 Cg_endo -69.75 -16.47 37.61 Favored 'Trans proline' 0 C--N 1.341 0.137 0 C-N-CA 122.697 2.265 . . . . 75.23 112.341 179.917 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -82.0 -19.39 40.6 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.249 -0.432 . . . . 73.44 110.866 -179.952 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -59.69 -25.7 64.98 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.168 -0.469 . . . . 74.31 110.866 -179.936 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.315 0 C-N-CA 120.718 -0.753 . . . . 53.24 112.502 -179.983 . . . . . . . . 0 0 . 1 . 022 nuclear nobuild core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 37.7 t . . . . . 0 C--O 1.231 0.096 0 CA-C-O 120.816 0.341 . . . . 60.32 111.145 . . . . . . . . . 0 0 . 1 . 022 nuclear nobuild core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 10.4 ttp -102.11 33.91 2.9 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.186 -0.461 . . . . 70.13 110.868 179.944 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 5.6 t -86.65 -3.94 59.11 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.224 -0.443 . . . . 71.25 111.156 -179.922 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . 0.678 ' C ' ' HG3' ' A' ' 19' ' ' PRO . 25.2 t -93.01 3.45 8.18 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-N 116.206 -0.452 . . . . 72.41 111.147 179.912 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . 0.464 ' O ' HG22 ' A' ' 16' ' ' ILE . 2.8 mp -142.35 3.61 0.41 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.161 -0.472 . . . . 73.31 111.159 179.964 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 17' ' ' SER . . . . . 0.781 ' C ' ' HD2' ' A' ' 19' ' ' PRO . 0.5 OUTLIER -99.92 -68.74 0.04 OUTLIER Pre-proline 0 C--N 1.329 -0.302 0 CA-C-O 121.673 0.749 . . . . 52.11 110.885 -179.882 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild core ' A' A ' 18' ' ' PRO . . . . . 0.929 ' N ' ' HD2' ' A' ' 19' ' ' PRO . 53.4 Cg_endo -69.85 -27.88 25.51 Favored 'Trans proline' 0 C--O 1.232 0.188 0 C-N-CA 122.681 2.254 . . . . 73.31 112.345 179.965 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 19' ' ' PRO . . . . . 0.929 ' HD2' ' N ' ' A' ' 18' ' ' PRO . 54.1 Cg_endo -69.68 -16.47 37.91 Favored 'Trans proline' 0 C--N 1.341 0.169 0 C-N-CA 122.693 2.262 . . . . 74.53 112.377 179.871 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -82.03 -19.45 40.36 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.215 -0.448 . . . . 50.01 110.907 -179.957 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -59.63 -25.74 64.92 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.182 -0.463 . . . . 72.23 110.892 -179.988 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.307 0 C-N-CA 120.75 -0.738 . . . . 65.42 112.486 -179.932 . . . . . . . . 0 0 . 1 . 023 nuclear nobuild core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 41.9 t . . . . . 0 C--O 1.231 0.117 0 CA-C-O 120.848 0.356 . . . . 75.21 111.141 . . . . . . . . . 0 0 . 1 . 023 nuclear nobuild core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 10.5 ttp -101.95 33.39 3.06 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.185 -0.461 . . . . 72.43 110.91 179.873 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 5.5 t -86.17 -4.02 59.08 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.214 -0.448 . . . . 65.2 111.139 -179.925 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . 0.665 ' C ' ' HG3' ' A' ' 19' ' ' PRO . 25.4 t -92.85 4.15 7.63 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.208 -0.451 . . . . 71.31 111.167 179.87 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . 0.456 ' O ' HG22 ' A' ' 16' ' ' ILE . 9.4 mt -143.33 3.32 0.35 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.18 -0.463 . . . . 71.22 111.121 179.927 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 17' ' ' SER . . . . . 0.8 ' C ' ' HD2' ' A' ' 19' ' ' PRO . 0.5 OUTLIER -99.89 -68.72 0.04 OUTLIER Pre-proline 0 C--N 1.329 -0.31 0 CA-C-O 121.624 0.726 . . . . 62.53 110.882 -179.943 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild core ' A' A ' 18' ' ' PRO . . . . . 0.93 ' N ' ' HD2' ' A' ' 19' ' ' PRO . 53.2 Cg_endo -69.8 -27.86 25.76 Favored 'Trans proline' 0 C--O 1.232 0.178 0 C-N-CA 122.681 2.254 . . . . 75.15 112.32 -179.996 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 19' ' ' PRO . . . . . 0.93 ' HD2' ' N ' ' A' ' 18' ' ' PRO . 54.1 Cg_endo -69.73 -16.49 37.71 Favored 'Trans proline' 0 C--N 1.342 0.203 0 C-N-CA 122.732 2.288 . . . . 40.33 112.346 179.964 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -81.87 -19.92 39.94 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.195 -0.457 . . . . 55.32 110.902 -179.97 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -58.52 -33.37 69.77 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.129 -0.487 . . . . 63.43 110.871 -179.913 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.337 0 C-N-CA 120.782 -0.723 . . . . 72.22 112.49 -179.943 . . . . . . . . 0 0 . 1 . 024 nuclear nobuild core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 38.4 t . . . . . 0 C--O 1.231 0.106 0 CA-C-O 120.852 0.358 . . . . 63.33 111.163 . . . . . . . . . 0 0 . 1 . 024 nuclear nobuild core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 10.4 ttp -102.0 33.84 2.9 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.18 -0.464 . . . . 74.34 110.861 179.902 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 5.8 t -86.52 -3.89 59.09 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.225 -0.443 . . . . 73.12 111.211 -179.986 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . 0.675 ' C ' ' HG3' ' A' ' 19' ' ' PRO . 24.1 t -93.85 4.04 8.24 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.183 -0.462 . . . . 70.12 111.1 179.933 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . 0.46 ' O ' HG22 ' A' ' 16' ' ' ILE . 2.8 mp -142.52 3.43 0.4 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-N 116.168 -0.469 . . . . 75.22 111.153 179.94 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 17' ' ' SER . . . . . 0.791 ' C ' ' HD2' ' A' ' 19' ' ' PRO . 0.5 OUTLIER -100.19 -68.42 0.04 OUTLIER Pre-proline 0 C--N 1.329 -0.307 0 CA-C-O 121.615 0.721 . . . . 53.4 110.85 -179.951 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild core ' A' A ' 18' ' ' PRO . . . . . 0.919 ' N ' ' HD2' ' A' ' 19' ' ' PRO . 53.9 Cg_endo -69.77 -27.81 25.97 Favored 'Trans proline' 0 C--O 1.232 0.19 0 C-N-CA 122.624 2.216 . . . . 45.0 112.352 179.975 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 19' ' ' PRO . . . . . 0.919 ' HD2' ' N ' ' A' ' 18' ' ' PRO . 53.8 Cg_endo -69.77 -16.49 37.54 Favored 'Trans proline' 0 C--N 1.341 0.166 0 C-N-CA 122.714 2.276 . . . . 71.31 112.334 179.975 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -81.88 -19.9 39.97 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.203 -0.453 . . . . 70.43 110.889 -179.987 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -58.67 -34.71 71.54 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.168 -0.469 . . . . 74.05 110.855 -179.875 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.302 0 C-N-CA 120.696 -0.764 . . . . 62.42 112.485 179.984 . . . . . . . . 0 0 . 1 . 025 nuclear nobuild core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 36.1 t . . . . . 0 C--O 1.231 0.114 0 CA-C-O 120.804 0.335 . . . . 72.33 111.128 . . . . . . . . . 0 0 . 1 . 025 nuclear nobuild core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 10.5 ttp -102.46 33.89 2.98 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.187 -0.461 . . . . 64.11 110.862 179.916 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 5.6 t -86.68 -3.97 59.11 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.262 -0.426 . . . . 73.34 111.145 -179.925 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . 0.685 ' C ' ' HG3' ' A' ' 19' ' ' PRO . 25.1 t -93.03 3.47 8.18 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-N 116.221 -0.445 . . . . 75.31 111.122 179.895 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . 0.463 ' O ' HG22 ' A' ' 16' ' ' ILE . 2.8 mp -142.36 3.72 0.41 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.184 -0.462 . . . . 72.32 111.132 179.865 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 17' ' ' SER . . . . . 0.801 ' C ' ' HD2' ' A' ' 19' ' ' PRO . 0.5 OUTLIER -99.93 -68.82 0.04 OUTLIER Pre-proline 0 C--N 1.329 -0.294 0 CA-C-O 121.697 0.761 . . . . 73.45 110.83 -179.897 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild core ' A' A ' 18' ' ' PRO . . . . . 0.924 ' N ' ' HD2' ' A' ' 19' ' ' PRO . 54.2 Cg_endo -69.7 -27.94 26.14 Favored 'Trans proline' 0 C--O 1.232 0.181 0 C-N-CA 122.7 2.267 . . . . 73.14 112.358 179.954 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 19' ' ' PRO . . . . . 0.924 ' HD2' ' N ' ' A' ' 18' ' ' PRO . 53.5 Cg_endo -69.77 -16.43 37.51 Favored 'Trans proline' 0 C--N 1.342 0.213 0 C-N-CA 122.664 2.243 . . . . 73.21 112.38 179.961 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -81.93 -19.86 39.87 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.171 -0.468 . . . . 74.13 110.911 179.977 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -58.6 -33.16 69.68 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.131 -0.486 . . . . 74.34 110.876 -179.92 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.279 0 C-N-CA 120.74 -0.743 . . . . 72.12 112.46 -179.947 . . . . . . . . 0 0 . 1 . 026 nuclear nobuild core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 61.5 t . . . . . 0 C--O 1.231 0.113 0 CA-C-O 120.84 0.352 . . . . 73.4 111.115 . . . . . . . . . 0 0 . 1 . 026 nuclear nobuild core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 10.6 ttp -102.06 33.4 3.07 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.152 -0.476 . . . . 72.44 110.862 179.932 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 5.6 t -86.17 -3.99 59.08 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.23 -0.441 . . . . 71.42 111.148 -179.937 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . 0.666 ' C ' ' HG3' ' A' ' 19' ' ' PRO . 25.3 t -92.89 4.12 7.68 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-N 116.221 -0.445 . . . . 63.42 111.158 179.853 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . 0.454 ' O ' HG22 ' A' ' 16' ' ' ILE . 9.6 mt -143.29 3.34 0.35 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.206 -0.452 . . . . 74.11 111.153 179.898 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 17' ' ' SER . . . . . 0.79 ' C ' ' HD2' ' A' ' 19' ' ' PRO . 0.5 OUTLIER -99.82 -68.77 0.04 OUTLIER Pre-proline 0 C--N 1.33 -0.277 0 CA-C-O 121.694 0.759 . . . . 72.3 110.849 -179.929 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild core ' A' A ' 18' ' ' PRO . . . . . 0.909 ' N ' ' HD2' ' A' ' 19' ' ' PRO . 53.7 Cg_endo -69.77 -27.93 25.82 Favored 'Trans proline' 0 C--N 1.342 0.185 0 C-N-CA 122.66 2.24 . . . . 55.44 112.337 -179.992 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 19' ' ' PRO . . . . . 0.909 ' HD2' ' N ' ' A' ' 18' ' ' PRO . 54.1 Cg_endo -69.75 -16.8 37.77 Favored 'Trans proline' 0 C--N 1.341 0.184 0 C-N-CA 122.643 2.229 . . . . 74.52 112.354 179.937 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 21.3 tt0 -82.5 -21.29 35.53 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.222 -0.445 . . . . 72.5 110.903 179.981 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -58.27 -33.21 69.17 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.201 -0.454 . . . . 74.55 110.854 -179.913 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.317 0 C-N-CA 120.693 -0.765 . . . . 72.22 112.527 -179.953 . . . . . . . . 0 0 . 1 . 027 nuclear nobuild core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 58.8 t . . . . . 0 N--CA 1.458 -0.058 0 CA-C-O 120.828 0.347 . . . . 75.32 111.139 . . . . . . . . . 0 0 . 1 . 027 nuclear nobuild core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 9.4 ttp -102.26 32.83 3.34 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.162 -0.472 . . . . 64.43 110.851 179.927 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 5.9 t -86.82 -3.74 59.1 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.212 -0.449 . . . . 64.32 111.149 -179.974 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . 0.683 ' C ' ' HG3' ' A' ' 19' ' ' PRO . 23.0 t -94.26 4.65 8.09 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.228 -0.442 . . . . 63.33 111.12 179.867 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . 0.452 ' O ' HG22 ' A' ' 16' ' ' ILE . 2.8 mp -142.54 3.36 0.4 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.326 0 CA-C-N 116.173 -0.467 . . . . 74.24 111.122 179.894 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 17' ' ' SER . . . . . 0.799 ' C ' ' HD2' ' A' ' 19' ' ' PRO . 0.5 OUTLIER -100.32 -68.38 0.04 OUTLIER Pre-proline 0 C--N 1.329 -0.323 0 CA-C-O 121.739 0.78 . . . . 73.22 110.836 -179.911 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild core ' A' A ' 18' ' ' PRO . . . . . 0.916 ' N ' ' HD2' ' A' ' 19' ' ' PRO . 54.2 Cg_endo -69.69 -27.87 26.29 Favored 'Trans proline' 0 C--N 1.342 0.214 0 C-N-CA 122.686 2.258 . . . . 62.35 112.349 179.989 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 19' ' ' PRO . . . . . 0.916 ' HD2' ' N ' ' A' ' 18' ' ' PRO . 53.7 Cg_endo -69.79 -16.47 37.46 Favored 'Trans proline' 0 C--N 1.342 0.192 0 C-N-CA 122.637 2.225 . . . . 71.31 112.341 179.989 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -81.87 -19.88 40.01 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.22 -0.446 . . . . 75.54 110.903 -179.994 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -58.66 -34.05 70.79 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.185 -0.461 . . . . 74.52 110.868 -179.947 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.303 0 C-N-CA 120.724 -0.751 . . . . 74.23 112.503 -179.977 . . . . . . . . 0 0 . 1 . 028 nuclear nobuild core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 23.7 t . . . . . 0 C--O 1.23 0.067 0 CA-C-O 120.851 0.358 . . . . 70.04 111.16 . . . . . . . . . 0 0 . 1 . 028 nuclear nobuild core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 10.6 ttp -101.86 33.4 3.03 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.154 -0.475 . . . . 44.21 110.851 179.968 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 5.5 t -86.18 -4.0 59.08 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.217 -0.447 . . . . 72.21 111.106 -179.923 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . 0.668 ' C ' ' HG3' ' A' ' 19' ' ' PRO . 25.3 t -92.93 4.15 7.68 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.24 -0.436 . . . . 72.54 111.132 179.911 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . 0.455 ' O ' HG22 ' A' ' 16' ' ' ILE . 9.4 mt -143.32 3.39 0.35 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.215 -0.448 . . . . 75.31 111.141 179.888 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 17' ' ' SER . . . . . 0.799 ' C ' ' HD2' ' A' ' 19' ' ' PRO . 0.5 OUTLIER -99.86 -68.8 0.04 OUTLIER Pre-proline 0 C--N 1.329 -0.301 0 CA-C-O 121.686 0.755 . . . . 65.22 110.863 -179.941 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild core ' A' A ' 18' ' ' PRO . . . . . 0.913 ' N ' ' HD2' ' A' ' 19' ' ' PRO . 54.2 Cg_endo -69.73 -27.89 26.05 Favored 'Trans proline' 0 C--N 1.342 0.203 0 C-N-CA 122.702 2.268 . . . . 73.3 112.361 179.953 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 19' ' ' PRO . . . . . 0.913 ' HD2' ' N ' ' A' ' 18' ' ' PRO . 53.7 Cg_endo -69.8 -16.75 37.52 Favored 'Trans proline' 0 C--N 1.341 0.171 0 C-N-CA 122.64 2.227 . . . . 54.03 112.312 179.956 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 15.1 tp10 -82.51 -21.35 35.49 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.264 -0.425 . . . . 70.22 110.883 -179.986 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -58.14 -34.48 70.31 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.139 -0.482 . . . . 62.43 110.876 -179.903 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.348 0 C-N-CA 120.722 -0.751 . . . . 73.43 112.529 -179.932 . . . . . . . . 0 0 . 1 . 029 nuclear nobuild core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 21.8 t . . . . . 0 C--O 1.231 0.097 0 CA-C-O 120.85 0.357 . . . . 75.3 111.131 . . . . . . . . . 0 0 . 1 . 029 nuclear nobuild core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 10.4 ttp -101.29 33.82 2.77 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.141 -0.481 . . . . 71.14 110.907 179.927 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 5.6 t -86.67 -3.91 59.1 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.21 -0.45 . . . . 74.55 111.167 -179.897 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . 0.685 ' C ' ' HG3' ' A' ' 19' ' ' PRO . 25.0 t -93.07 3.49 8.19 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-N 116.149 -0.478 . . . . 54.35 111.114 179.932 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . 0.447 ' O ' HG22 ' A' ' 16' ' ' ILE . 2.8 mp -142.34 3.63 0.41 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.212 -0.449 . . . . 71.23 111.155 179.924 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 17' ' ' SER . . . . . 0.786 ' C ' ' HD2' ' A' ' 19' ' ' PRO . 0.5 OUTLIER -99.89 -68.77 0.04 OUTLIER Pre-proline 0 C--N 1.329 -0.319 0 CA-C-O 121.674 0.75 . . . . 72.21 110.844 -179.879 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild core ' A' A ' 18' ' ' PRO . . . . . 0.912 ' N ' ' HD2' ' A' ' 19' ' ' PRO . 53.5 Cg_endo -69.83 -27.9 25.58 Favored 'Trans proline' 0 C--N 1.342 0.191 0 C-N-CA 122.645 2.23 . . . . 55.45 112.325 -179.982 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 19' ' ' PRO . . . . . 0.912 ' HD2' ' N ' ' A' ' 18' ' ' PRO . 54.2 Cg_endo -69.74 -16.81 37.81 Favored 'Trans proline' 0 C--N 1.342 0.195 0 C-N-CA 122.72 2.28 . . . . 72.43 112.346 179.903 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 25.6 tt0 -82.59 -21.24 35.28 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.205 -0.452 . . . . 74.13 110.867 -179.94 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -58.1 -32.86 68.49 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.154 -0.476 . . . . 74.12 110.872 -179.913 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.303 0 C-N-CA 120.72 -0.752 . . . . 70.21 112.462 179.978 . . . . . . . . 0 0 . 1 . 030 nuclear nobuild core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 57.7 t . . . . . 0 C--O 1.231 0.092 0 CA-C-O 120.8 0.333 . . . . 60.11 111.115 . . . . . . . . . 0 0 . 1 . 030 nuclear nobuild core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 10.6 ttp -101.97 33.38 3.06 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.182 -0.463 . . . . 72.32 110.83 179.962 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 5.5 t -86.18 -4.0 59.08 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.261 -0.427 . . . . 64.33 111.139 -179.941 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . 0.678 ' C ' ' HG3' ' A' ' 19' ' ' PRO . 25.4 t -92.95 4.18 7.67 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.22 -0.446 . . . . 73.44 111.134 179.904 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . 0.459 ' O ' HG22 ' A' ' 16' ' ' ILE . 9.5 mt -143.3 3.31 0.35 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.186 -0.461 . . . . 72.01 111.164 179.926 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 17' ' ' SER . . . . . 0.809 ' C ' ' HD2' ' A' ' 19' ' ' PRO . 0.5 OUTLIER -99.9 -68.73 0.04 OUTLIER Pre-proline 0 C--N 1.33 -0.278 0 CA-C-O 121.612 0.72 . . . . 61.45 110.866 -179.919 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild core ' A' A ' 18' ' ' PRO . . . . . 0.913 ' N ' ' HD2' ' A' ' 19' ' ' PRO . 53.5 Cg_endo -69.75 -27.97 25.88 Favored 'Trans proline' 0 C--N 1.341 0.157 0 C-N-CA 122.721 2.281 . . . . 44.24 112.32 179.988 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 19' ' ' PRO . . . . . 0.913 ' HD2' ' N ' ' A' ' 18' ' ' PRO . 53.8 Cg_endo -69.72 -16.75 37.87 Favored 'Trans proline' 0 C--N 1.342 0.201 0 C-N-CA 122.684 2.256 . . . . 64.43 112.389 179.935 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 57.6 tt0 -82.53 -21.34 35.43 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.197 -0.456 . . . . 72.54 110.936 179.988 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -58.17 -34.42 70.29 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.103 -0.499 . . . . 73.32 110.926 -179.934 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.342 0 C-N-CA 120.727 -0.749 . . . . 73.2 112.478 179.988 . . . . . . . . 0 0 . 1 . 031 nuclear nobuild core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 60.6 t . . . . . 0 C--O 1.231 0.102 0 CA-C-O 120.866 0.365 . . . . 65.51 111.118 . . . . . . . . . 0 0 . 1 . 031 nuclear nobuild core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 10.6 ttp -101.97 33.38 3.06 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.182 -0.463 . . . . 72.33 110.876 179.929 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 5.5 t -86.11 -4.03 59.08 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.215 -0.448 . . . . 73.42 111.137 -179.921 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . 0.675 ' C ' ' HG3' ' A' ' 19' ' ' PRO . 25.4 t -92.91 4.14 7.68 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.183 -0.462 . . . . 74.02 111.122 179.937 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . 0.456 ' O ' HG22 ' A' ' 16' ' ' ILE . 9.5 mt -143.28 3.34 0.35 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.178 -0.465 . . . . 72.13 111.169 179.911 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 17' ' ' SER . . . . . 0.792 ' C ' ' HD2' ' A' ' 19' ' ' PRO . 0.5 OUTLIER -99.86 -68.81 0.04 OUTLIER Pre-proline 0 C--N 1.329 -0.297 0 CA-C-O 121.696 0.76 . . . . 63.43 110.895 -179.92 . . . . . . . . 3 3 . 1 . 031 nuclear nobuild core ' A' A ' 18' ' ' PRO . . . . . 0.919 ' N ' ' HD2' ' A' ' 19' ' ' PRO . 54.0 Cg_endo -69.75 -27.88 25.99 Favored 'Trans proline' 0 C--N 1.342 0.213 0 C-N-CA 122.684 2.256 . . . . 75.1 112.329 179.971 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 19' ' ' PRO . . . . . 0.919 ' HD2' ' N ' ' A' ' 18' ' ' PRO . 53.9 Cg_endo -69.72 -16.49 37.73 Favored 'Trans proline' 0 C--N 1.341 0.153 0 C-N-CA 122.69 2.26 . . . . 73.02 112.315 179.966 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -81.92 -19.44 40.77 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.261 -0.427 . . . . 72.11 110.909 -179.966 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -59.7 -25.74 65.02 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.13 -0.486 . . . . 74.31 110.852 -179.902 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.325 0 C-N-CA 120.699 -0.762 . . . . 54.41 112.51 -179.993 . . . . . . . . 0 0 . 1 . 032 nuclear nobuild core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 58.3 t . . . . . 0 C--O 1.231 0.083 0 CA-C-O 120.822 0.344 . . . . 75.02 111.109 . . . . . . . . . 0 0 . 1 . 032 nuclear nobuild core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 10.4 ttp -102.49 33.9 2.98 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.181 -0.463 . . . . 72.23 110.895 179.954 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 5.6 t -86.65 -3.96 59.11 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.199 -0.455 . . . . 51.14 111.182 -179.973 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . 0.685 ' C ' ' HG3' ' A' ' 19' ' ' PRO . 24.9 t -93.0 3.49 8.15 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.203 -0.453 . . . . 72.3 111.129 179.879 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . 0.465 ' O ' HG22 ' A' ' 16' ' ' ILE . 2.8 mp -142.38 3.61 0.41 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.19 -0.459 . . . . 72.25 111.146 179.918 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' A' A ' 17' ' ' SER . . . . . 0.797 ' C ' ' HD2' ' A' ' 19' ' ' PRO . 0.5 OUTLIER -99.85 -68.79 0.04 OUTLIER Pre-proline 0 C--N 1.329 -0.284 0 CA-C-O 121.674 0.75 . . . . 74.53 110.868 -179.94 . . . . . . . . 3 3 . 1 . 032 nuclear nobuild core ' A' A ' 18' ' ' PRO . . . . . 0.924 ' N ' ' HD2' ' A' ' 19' ' ' PRO . 53.7 Cg_endo -69.73 -27.99 25.94 Favored 'Trans proline' 0 C--O 1.231 0.171 0 C-N-CA 122.718 2.278 . . . . 74.34 112.313 179.994 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' A' A ' 19' ' ' PRO . . . . . 0.924 ' HD2' ' N ' ' A' ' 18' ' ' PRO . 53.9 Cg_endo -69.74 -16.71 37.77 Favored 'Trans proline' 0 C--N 1.341 0.179 0 C-N-CA 122.669 2.246 . . . . 75.42 112.359 179.939 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 17.6 tp10 -82.61 -21.36 35.16 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.252 -0.431 . . . . 75.41 110.875 -179.978 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -58.14 -34.11 69.91 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.167 -0.469 . . . . 74.25 110.864 -179.894 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.291 0 C-N-CA 120.719 -0.753 . . . . 63.41 112.485 -179.993 . . . . . . . . 0 0 . 1 . 033 nuclear nobuild core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 93.6 t . . . . . 0 N--CA 1.458 -0.069 0 CA-C-O 120.868 0.366 . . . . 52.23 111.146 . . . . . . . . . 0 0 . 1 . 033 nuclear nobuild core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 2.8 ttp -113.61 -2.45 13.8 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.159 -0.473 . . . . 42.43 110.886 179.922 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 14' ' ' THR . . . . . 0.486 HG22 ' O ' ' A' ' 14' ' ' THR . 25.7 m -76.55 -4.92 45.32 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.211 -0.449 . . . . 74.13 111.135 -179.967 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . 0.684 ' C ' ' HG3' ' A' ' 19' ' ' PRO . 23.5 t -97.88 10.97 5.93 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.269 -0.423 . . . . 54.32 111.176 179.861 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . 0.462 HG22 ' O ' ' A' ' 16' ' ' ILE . 3.0 mp -142.37 2.56 0.41 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.189 -0.46 . . . . 64.45 111.14 179.924 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild core ' A' A ' 17' ' ' SER . . . . . 0.798 ' C ' ' HD2' ' A' ' 19' ' ' PRO . 0.6 OUTLIER -101.74 -66.2 0.05 OUTLIER Pre-proline 0 C--N 1.33 -0.273 0 CA-C-O 121.622 0.725 . . . . 72.22 110.88 -179.935 . . . . . . . . 3 3 . 1 . 033 nuclear nobuild core ' A' A ' 18' ' ' PRO . . . . . 0.92 ' N ' ' HD2' ' A' ' 19' ' ' PRO . 53.7 Cg_endo -69.8 -27.66 26.02 Favored 'Trans proline' 0 C--N 1.342 0.189 0 C-N-CA 122.664 2.243 . . . . 63.12 112.374 179.953 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild core ' A' A ' 19' ' ' PRO . . . . . 0.92 ' HD2' ' N ' ' A' ' 18' ' ' PRO . 53.2 Cg_endo -69.81 -16.2 37.25 Favored 'Trans proline' 0 C--N 1.341 0.145 0 C-N-CA 122.664 2.243 . . . . 73.31 112.329 179.946 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 5.8 tm-20 -83.02 -21.25 33.9 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.2 -0.455 . . . . 74.22 110.855 -179.968 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -57.55 -32.78 67.44 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.166 -0.47 . . . . 75.02 110.896 -179.932 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.366 0 C-N-CA 120.754 -0.736 . . . . 33.43 112.508 -179.95 . . . . . . . . 0 0 . 1 . 034 nuclear nobuild core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 55.7 t . . . . . 0 N--CA 1.458 -0.051 0 CA-C-O 120.835 0.35 . . . . 45.15 111.091 . . . . . . . . . 0 0 . 1 . 034 nuclear nobuild core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 10.1 ttp -105.76 6.26 31.63 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.144 -0.48 . . . . 44.43 110.913 179.92 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 6.0 t -70.18 -6.34 33.68 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.221 -0.445 . . . . 53.41 111.104 -179.922 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . 0.663 HG12 ' O ' ' A' ' 15' ' ' VAL . 40.3 t -96.27 9.83 5.85 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.242 -0.436 . . . . 64.52 111.177 179.922 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . 0.457 ' O ' HG22 ' A' ' 16' ' ' ILE . 10.6 mt -143.96 2.11 0.3 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.092 -0.504 . . . . 71.43 111.102 179.963 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild core ' A' A ' 17' ' ' SER . . . . . 0.815 ' C ' ' HD2' ' A' ' 19' ' ' PRO . 0.0 OUTLIER -99.74 -65.89 0.06 OUTLIER Pre-proline 0 C--N 1.329 -0.288 0 CA-C-O 121.65 0.738 . . . . 73.12 110.818 -179.898 . . . . . . . . 3 3 . 1 . 034 nuclear nobuild core ' A' A ' 18' ' ' PRO . . . . . 0.922 ' N ' ' HD2' ' A' ' 19' ' ' PRO . 53.7 Cg_endo -69.77 -27.38 26.5 Favored 'Trans proline' 0 C--O 1.231 0.156 0 C-N-CA 122.649 2.232 . . . . 74.21 112.331 -179.976 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild core ' A' A ' 19' ' ' PRO . . . . . 0.922 ' HD2' ' N ' ' A' ' 18' ' ' PRO . 53.6 Cg_endo -69.74 -16.98 37.91 Favored 'Trans proline' 0 C--N 1.341 0.177 0 C-N-CA 122.651 2.234 . . . . 51.14 112.336 179.952 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 1.9 mt-10 -82.79 -19.99 36.66 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.228 -0.442 . . . . 73.3 110.879 -179.967 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -58.59 -33.35 69.88 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.21 -0.45 . . . . 73.51 110.894 -179.945 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.302 0 C-N-CA 120.7 -0.762 . . . . 54.23 112.461 179.998 . . . . . . . . 0 0 . 1 . 035 nuclear nobuild core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 50.8 t . . . . . 0 C--O 1.231 0.097 0 CA-C-O 120.864 0.364 . . . . 73.04 111.159 . . . . . . . . . 0 0 . 1 . 035 nuclear nobuild core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 10.4 ttp -102.3 33.93 2.93 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.191 -0.459 . . . . 73.14 110.884 179.884 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 5.6 t -86.74 -3.92 59.11 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.212 -0.449 . . . . 71.23 111.138 -179.92 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . 0.687 ' C ' ' HG3' ' A' ' 19' ' ' PRO . 25.1 t -93.04 3.45 8.2 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.222 -0.445 . . . . 71.32 111.125 179.895 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . 0.462 ' O ' HG22 ' A' ' 16' ' ' ILE . 2.8 mp -142.33 3.6 0.41 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.144 -0.48 . . . . 53.34 111.156 179.949 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild core ' A' A ' 17' ' ' SER . . . . . 0.79 ' C ' ' HD2' ' A' ' 19' ' ' PRO . 0.5 OUTLIER -99.86 -68.78 0.04 OUTLIER Pre-proline 0 C--N 1.33 -0.271 0 CA-C-O 121.671 0.748 . . . . 75.04 110.855 -179.879 . . . . . . . . 3 3 . 1 . 035 nuclear nobuild core ' A' A ' 18' ' ' PRO . . . . . 0.911 ' N ' ' HD2' ' A' ' 19' ' ' PRO . 53.6 Cg_endo -69.77 -27.99 25.74 Favored 'Trans proline' 0 C--N 1.341 0.172 0 C-N-CA 122.651 2.234 . . . . 53.55 112.323 179.981 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild core ' A' A ' 19' ' ' PRO . . . . . 0.911 ' HD2' ' N ' ' A' ' 18' ' ' PRO . 54.1 Cg_endo -69.7 -16.76 37.97 Favored 'Trans proline' 0 C--N 1.341 0.149 0 C-N-CA 122.702 2.268 . . . . 72.34 112.366 179.942 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 28.4 tt0 -82.64 -21.24 35.13 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.191 -0.459 . . . . 73.33 110.888 -179.975 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -59.13 -25.39 63.82 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.113 -0.494 . . . . 63.41 110.875 -179.878 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.339 0 C-N-CA 120.746 -0.74 . . . . 75.23 112.516 -179.987 . . . . . . . . 0 0 . 1 . 036 nuclear nobuild core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 47.8 t . . . . . 0 N--CA 1.457 -0.083 0 CA-C-O 120.857 0.36 . . . . 73.45 111.147 . . . . . . . . . 0 0 . 1 . 036 nuclear nobuild core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 9.0 ttp -105.58 2.98 28.77 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.134 -0.485 . . . . 54.15 110.852 179.918 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 5.6 t -70.28 -5.93 31.3 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.272 -0.422 . . . . 75.34 111.162 -179.98 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . 0.655 HG12 ' O ' ' A' ' 15' ' ' VAL . 40.0 t -96.18 9.84 5.79 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.229 -0.442 . . . . 71.32 111.171 179.872 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . 0.449 ' O ' HG22 ' A' ' 16' ' ' ILE . 10.4 mt -143.86 2.05 0.31 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.176 -0.466 . . . . 70.33 111.16 179.945 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild core ' A' A ' 17' ' ' SER . . . . . 0.815 ' C ' ' HD2' ' A' ' 19' ' ' PRO . 0.0 OUTLIER -99.73 -65.79 0.06 OUTLIER Pre-proline 0 C--N 1.33 -0.252 0 CA-C-O 121.673 0.749 . . . . 61.52 110.864 -179.922 . . . . . . . . 3 3 . 1 . 036 nuclear nobuild core ' A' A ' 18' ' ' PRO . . . . . 0.911 ' N ' ' HD2' ' A' ' 19' ' ' PRO . 53.6 Cg_endo -69.74 -27.4 26.61 Favored 'Trans proline' 0 C--N 1.341 0.175 0 C-N-CA 122.713 2.276 . . . . 62.33 112.36 179.978 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild core ' A' A ' 19' ' ' PRO . . . . . 0.911 ' HD2' ' N ' ' A' ' 18' ' ' PRO . 53.5 Cg_endo -69.82 -16.95 37.55 Favored 'Trans proline' 0 C--N 1.342 0.217 0 C-N-CA 122.673 2.249 . . . . 71.34 112.318 179.981 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 1.2 mt-10 -82.81 -20.23 36.15 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.232 -0.44 . . . . 74.32 110.836 -179.969 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -58.41 -32.8 68.98 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.188 -0.46 . . . . 75.42 110.903 -179.91 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.288 0 C-N-CA 120.735 -0.745 . . . . 63.23 112.475 -179.999 . . . . . . . . 0 0 . 1 . 037 nuclear nobuild core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 39.7 t . . . . . 0 N--CA 1.457 -0.089 0 CA-C-O 120.831 0.348 . . . . 73.12 111.159 . . . . . . . . . 0 0 . 1 . 037 nuclear nobuild core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 9.7 ttp -104.36 6.37 35.11 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.138 -0.483 . . . . 64.23 110.872 179.9 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 5.8 t -70.04 -6.34 32.92 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.257 -0.429 . . . . 61.12 111.183 -179.955 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . 0.647 HG12 ' O ' ' A' ' 15' ' ' VAL . 40.7 t -96.28 9.87 5.83 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.207 -0.451 . . . . 74.4 111.137 179.907 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . 0.447 ' O ' HG22 ' A' ' 16' ' ' ILE . 10.8 mt -143.96 1.98 0.3 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.193 -0.458 . . . . 75.41 111.132 179.942 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild core ' A' A ' 17' ' ' SER . . . . . 0.812 ' C ' ' HD2' ' A' ' 19' ' ' PRO . 0.0 OUTLIER -99.66 -65.88 0.06 OUTLIER Pre-proline 0 C--N 1.329 -0.307 0 CA-C-O 121.707 0.765 . . . . 65.11 110.863 -179.895 . . . . . . . . 3 3 . 1 . 037 nuclear nobuild core ' A' A ' 18' ' ' PRO . . . . . 0.91 ' N ' ' HD2' ' A' ' 19' ' ' PRO . 53.8 Cg_endo -69.77 -27.42 26.43 Favored 'Trans proline' 0 C--N 1.342 0.205 0 C-N-CA 122.739 2.292 . . . . 75.52 112.321 179.999 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild core ' A' A ' 19' ' ' PRO . . . . . 0.91 ' HD2' ' N ' ' A' ' 18' ' ' PRO . 54.1 Cg_endo -69.74 -17.02 37.9 Favored 'Trans proline' 0 C--N 1.341 0.176 0 C-N-CA 122.657 2.238 . . . . 75.34 112.392 179.922 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 1.3 mt-10 -82.73 -19.88 37.07 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.208 -0.451 . . . . 74.24 110.92 179.989 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -58.62 -33.72 70.35 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.111 -0.495 . . . . 73.44 110.903 -179.943 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.309 0 C-N-CA 120.715 -0.755 . . . . 64.32 112.469 -179.953 . . . . . . . . 0 0 . 1 . 038 nuclear nobuild core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 46.3 t . . . . . 0 C--O 1.232 0.132 0 CA-C-O 120.83 0.347 . . . . 72.51 111.109 . . . . . . . . . 0 0 . 1 . 038 nuclear nobuild core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 9.7 ttp -105.4 6.37 32.5 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.229 -0.442 . . . . 72.44 110.876 179.939 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 6.0 t -70.02 -6.32 32.68 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.186 -0.461 . . . . 55.54 111.177 -179.981 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . 0.662 HG12 ' O ' ' A' ' 15' ' ' VAL . 40.5 t -96.33 9.94 5.81 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.195 -0.457 . . . . 51.2 111.127 179.93 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . 0.449 ' O ' HG22 ' A' ' 16' ' ' ILE . 10.6 mt -143.96 1.96 0.3 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.159 -0.473 . . . . 73.22 111.117 179.952 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild core ' A' A ' 17' ' ' SER . . . . . 0.817 ' C ' ' HD2' ' A' ' 19' ' ' PRO . 0.0 OUTLIER -99.64 -65.88 0.06 OUTLIER Pre-proline 0 C--N 1.329 -0.301 0 CA-C-O 121.688 0.756 . . . . 63.42 110.859 -179.934 . . . . . . . . 3 3 . 1 . 038 nuclear nobuild core ' A' A ' 18' ' ' PRO . . . . . 0.923 ' N ' ' HD2' ' A' ' 19' ' ' PRO . 53.7 Cg_endo -69.73 -27.41 26.67 Favored 'Trans proline' 0 C--N 1.342 0.199 0 C-N-CA 122.691 2.261 . . . . 75.24 112.324 -179.999 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild core ' A' A ' 19' ' ' PRO . . . . . 0.923 ' HD2' ' N ' ' A' ' 18' ' ' PRO . 53.4 Cg_endo -69.82 -17.34 37.36 Favored 'Trans proline' 0 C--N 1.342 0.191 0 C-N-CA 122.691 2.26 . . . . 71.31 112.348 179.979 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 6.2 tm-20 -83.06 -20.74 34.39 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.204 -0.453 . . . . 43.15 110.898 179.993 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -58.64 -32.63 69.23 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.151 -0.477 . . . . 74.12 110.888 -179.916 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.321 0 C-N-CA 120.761 -0.733 . . . . 52.31 112.506 -179.99 . . . . . . . . 0 0 . 1 . 039 nuclear nobuild core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 59.0 t . . . . . 0 C--O 1.23 0.055 0 CA-C-O 120.829 0.347 . . . . 61.23 111.12 . . . . . . . . . 0 0 . 1 . 039 nuclear nobuild core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 9.7 ttp -105.47 6.38 32.37 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.185 -0.461 . . . . 64.22 110.901 179.86 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 6.1 t -70.11 -6.37 33.56 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.235 -0.439 . . . . 73.42 111.193 -179.991 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . 0.644 HG12 ' O ' ' A' ' 15' ' ' VAL . 40.5 t -96.26 9.91 5.79 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.164 -0.471 . . . . 75.41 111.119 179.891 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . 0.455 ' O ' HG22 ' A' ' 16' ' ' ILE . 10.8 mt -143.93 2.04 0.31 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.192 -0.458 . . . . 75.21 111.121 179.899 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild core ' A' A ' 17' ' ' SER . . . . . 0.804 ' C ' ' HD2' ' A' ' 19' ' ' PRO . 0.0 OUTLIER -99.67 -65.89 0.06 OUTLIER Pre-proline 0 C--N 1.329 -0.303 0 CA-C-O 121.678 0.752 . . . . 62.13 110.861 -179.916 . . . . . . . . 3 3 . 1 . 039 nuclear nobuild core ' A' A ' 18' ' ' PRO . . . . . 0.907 ' N ' ' HD2' ' A' ' 19' ' ' PRO . 53.7 Cg_endo -69.74 -27.44 26.55 Favored 'Trans proline' 0 C--N 1.341 0.168 0 C-N-CA 122.716 2.277 . . . . 61.23 112.341 179.995 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild core ' A' A ' 19' ' ' PRO . . . . . 0.907 ' HD2' ' N ' ' A' ' 18' ' ' PRO . 53.7 Cg_endo -69.81 -16.87 37.55 Favored 'Trans proline' 0 C--N 1.342 0.203 0 C-N-CA 122.65 2.234 . . . . 75.4 112.336 179.991 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 1.1 mt-10 -82.83 -19.49 37.51 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.221 -0.445 . . . . 55.31 110.933 179.975 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -59.68 -25.82 65.05 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.122 -0.49 . . . . 73.21 110.881 -179.965 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.313 0 C-N-CA 120.73 -0.747 . . . . 52.34 112.483 -179.955 . . . . . . . . 0 0 . 1 . 040 nuclear nobuild core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 48.5 t . . . . . 0 C--O 1.23 0.067 0 CA-C-O 120.85 0.357 . . . . 62.43 111.154 . . . . . . . . . 0 0 . 1 . 040 nuclear nobuild core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 8.5 ttp -106.05 3.25 27.99 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.135 -0.484 . . . . 64.14 110.86 179.921 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 5.6 t -70.8 -5.72 32.36 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.217 -0.447 . . . . 72.33 111.142 -179.927 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . 0.654 HG12 ' O ' ' A' ' 15' ' ' VAL . 40.3 t -96.33 9.09 6.37 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.18 -0.464 . . . . 44.0 111.163 179.88 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . 0.452 ' O ' HG22 ' A' ' 16' ' ' ILE . 2.9 mp -142.78 2.26 0.38 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.136 -0.484 . . . . 72.41 111.128 179.934 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild core ' A' A ' 17' ' ' SER . . . . . 0.827 ' C ' ' HD2' ' A' ' 19' ' ' PRO . 0.0 OUTLIER -99.65 -65.79 0.06 OUTLIER Pre-proline 0 C--N 1.33 -0.281 0 CA-C-O 121.657 0.741 . . . . 61.45 110.844 -179.924 . . . . . . . . 3 3 . 1 . 040 nuclear nobuild core ' A' A ' 18' ' ' PRO . . . . . 0.93 ' N ' ' HD2' ' A' ' 19' ' ' PRO . 53.4 Cg_endo -69.76 -27.33 26.62 Favored 'Trans proline' 0 C--N 1.342 0.195 0 C-N-CA 122.651 2.234 . . . . 75.22 112.315 -179.979 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild core ' A' A ' 19' ' ' PRO . . . . . 0.93 ' HD2' ' N ' ' A' ' 18' ' ' PRO . 53.3 Cg_endo -69.75 -17.09 37.82 Favored 'Trans proline' 0 C--N 1.341 0.18 0 C-N-CA 122.705 2.27 . . . . 75.54 112.321 179.986 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -82.65 -19.72 37.68 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.184 -0.462 . . . . 72.5 110.857 -179.946 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -59.57 -25.83 64.9 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.153 -0.476 . . . . 54.4 110.89 -179.913 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.304 0 C-N-CA 120.739 -0.743 . . . . 50.43 112.476 -179.953 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' TRP . . . . . . . . . . . . . 38.8 m0 . . . . . 0 C--O 1.231 0.126 0 CA-C-O 120.777 0.323 . . . . 63.11 110.943 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -56.48 160.59 5.11 Favored Pre-proline 0 C--N 1.329 -0.323 0 CA-C-O 121.621 0.724 . . . . 74.51 110.857 -179.941 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.78 79.11 0.97 Allowed 'Trans proline' 0 C--N 1.341 0.181 0 C-N-CA 122.652 2.235 . . . . 63.14 112.349 -179.98 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 2.1 t80 -135.37 -65.03 0.62 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.21 -0.45 . . . . 72.02 110.935 -179.916 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . 0.422 ' O ' HD12 ' A' ' 5' ' ' LEU . 0.3 OUTLIER -80.8 -24.4 38.56 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.116 -0.493 . . . . 75.31 110.914 179.976 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 27.6 mt-30 -51.97 -49.09 63.9 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.185 -0.461 . . . . 71.33 110.896 179.927 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 11.6 t -68.86 -31.41 70.34 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.246 -0.434 . . . . 51.52 111.157 -179.93 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -55.08 -29.28 57.24 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.209 -0.45 . . . . 73.52 110.912 179.951 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 0.7 OUTLIER -80.67 -45.45 17.18 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.182 -0.463 . . . . 74.45 110.973 -179.912 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 14.7 m-85 -63.15 -31.75 72.97 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.074 -0.512 . . . . 73.23 110.873 -179.904 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -55.17 -33.38 62.92 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.179 -0.464 . . . . 74.51 110.817 179.951 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 58.0 t -93.19 -29.18 4.38 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.228 -0.442 . . . . 71.4 111.163 179.999 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 10.5 ttp -101.73 33.23 3.06 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.172 -0.467 . . . . 72.34 110.879 179.899 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 5.7 t -85.96 -3.95 59.05 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.245 -0.434 . . . . 72.24 111.182 -179.985 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . 0.672 ' C ' ' HG3' ' A' ' 19' ' ' PRO . 24.5 t -93.78 4.75 7.77 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.228 -0.442 . . . . 74.12 111.119 179.927 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . 0.46 HG22 ' O ' ' A' ' 16' ' ' ILE . 9.5 mt -143.47 3.19 0.34 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.184 -0.462 . . . . 64.51 111.16 179.922 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . 0.796 ' C ' ' HD2' ' A' ' 19' ' ' PRO . 0.5 OUTLIER -100.26 -68.44 0.04 OUTLIER Pre-proline 0 C--N 1.329 -0.294 0 CA-C-O 121.643 0.735 . . . . 74.02 110.836 -179.895 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . 0.918 ' N ' ' HD2' ' A' ' 19' ' ' PRO . 54.2 Cg_endo -69.71 -27.89 26.14 Favored 'Trans proline' 0 C--O 1.231 0.154 0 C-N-CA 122.664 2.243 . . . . 70.15 112.391 179.953 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' PRO . . . . . 0.918 ' HD2' ' N ' ' A' ' 18' ' ' PRO . 54.0 Cg_endo -69.68 -16.52 37.93 Favored 'Trans proline' 0 C--N 1.342 0.189 0 C-N-CA 122.704 2.269 . . . . 70.05 112.352 179.934 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 2.8 mt-10 -81.93 -19.4 40.83 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.248 -0.433 . . . . 73.01 110.906 -179.982 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -59.62 -25.74 64.9 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.175 -0.466 . . . . 72.43 110.864 -179.954 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.302 0 C-N-CA 120.688 -0.768 . . . . 60.12 112.484 -179.934 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' TRP . . . . . . . . . . . . . 46.2 m0 . . . . . 0 C--O 1.231 0.083 0 CA-C-O 120.773 0.321 . . . . 75.44 110.901 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 11.1 ptt180 -119.4 68.93 10.79 Favored Pre-proline 0 C--N 1.329 -0.291 0 CA-C-O 121.611 0.719 . . . . 73.22 110.883 -179.966 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.76 78.74 0.99 Allowed 'Trans proline' 0 C--N 1.341 0.165 0 C-N-CA 122.688 2.259 . . . . 61.35 112.382 -179.998 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 42.1 m-85 -134.95 -64.02 0.67 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.171 -0.468 . . . . 72.34 110.868 -179.872 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . 0.432 ' O ' HD12 ' A' ' 5' ' ' LEU . 0.3 OUTLIER -81.88 -24.45 35.72 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.162 -0.472 . . . . 62.24 110.902 179.989 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -55.2 -52.51 63.1 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.196 -0.456 . . . . 70.31 110.928 179.938 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 8.9 t -61.66 -32.74 72.92 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.195 -0.457 . . . . 71.42 111.137 -179.915 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -53.54 -28.57 32.26 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.247 -0.433 . . . . 54.42 110.901 -179.998 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 2.8 m-85 -94.21 -44.97 7.72 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.126 -0.488 . . . . 74.34 110.93 -179.872 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 23.3 m-85 -56.28 -30.07 61.99 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.111 -0.495 . . . . 75.25 110.915 -179.909 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 13.9 t70 -57.96 -30.63 66.16 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.137 -0.483 . . . . 74.44 110.883 179.896 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 48.1 t -91.99 -29.84 4.64 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.17 -0.468 . . . . 63.33 111.174 179.952 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 10.5 ttp -101.97 33.34 3.08 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.153 -0.476 . . . . 75.13 110.847 179.926 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 5.5 t -86.09 -4.03 59.08 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.242 -0.435 . . . . 65.2 111.171 -179.957 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . 0.664 ' C ' ' HG3' ' A' ' 19' ' ' PRO . 25.4 t -92.9 4.12 7.69 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.212 -0.449 . . . . 71.53 111.087 179.965 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . 0.459 HG22 ' O ' ' A' ' 16' ' ' ILE . 9.5 mt -143.34 3.37 0.35 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.164 -0.471 . . . . 74.12 111.089 179.928 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . 0.807 ' C ' ' HD2' ' A' ' 19' ' ' PRO . 0.5 OUTLIER -99.91 -68.73 0.04 OUTLIER Pre-proline 0 C--N 1.33 -0.28 0 CA-C-O 121.688 0.756 . . . . 71.02 110.876 -179.92 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . 0.908 ' N ' ' HD2' ' A' ' 19' ' ' PRO . 53.9 Cg_endo -69.77 -27.89 25.86 Favored 'Trans proline' 0 C--N 1.342 0.211 0 C-N-CA 122.683 2.256 . . . . 72.31 112.324 179.977 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' PRO . . . . . 0.908 ' HD2' ' N ' ' A' ' 18' ' ' PRO . 54.2 Cg_endo -69.7 -16.47 37.83 Favored 'Trans proline' 0 C--N 1.342 0.202 0 C-N-CA 122.702 2.268 . . . . 55.2 112.358 179.949 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 2.8 mt-10 -81.94 -19.89 39.76 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.207 -0.451 . . . . 74.43 110.89 -179.964 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -58.64 -34.73 71.52 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.129 -0.487 . . . . 70.42 110.842 -179.911 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.303 0 C-N-CA 120.697 -0.763 . . . . 60.42 112.491 -179.975 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' TRP . . . . . . . . . . . . . 54.8 m0 . . . . . 0 C--O 1.231 0.104 0 CA-C-O 120.787 0.327 . . . . 64.42 110.887 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 4.8 mtt-85 -114.09 73.0 2.36 Favored Pre-proline 0 C--N 1.329 -0.294 0 CA-C-O 121.594 0.711 . . . . 62.41 110.84 -179.953 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.77 78.8 0.99 Allowed 'Trans proline' 0 C--N 1.341 0.175 0 C-N-CA 122.678 2.252 . . . . 74.03 112.342 179.99 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 25.9 m-85 -135.94 -63.7 0.64 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.22 -0.445 . . . . 74.51 110.919 -179.921 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . 0.437 ' O ' HD12 ' A' ' 5' ' ' LEU . 0.3 OUTLIER -82.18 -24.47 34.95 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.092 -0.503 . . . . 71.32 110.904 179.963 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 6.8 mt-30 -55.88 -52.91 62.42 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.202 -0.454 . . . . 71.25 110.891 179.962 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 9.3 t -60.95 -33.11 72.67 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.25 -0.432 . . . . 74.03 111.103 -179.884 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -53.74 -28.21 33.03 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.237 -0.438 . . . . 74.5 110.876 179.986 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 0.7 OUTLIER -91.39 -45.24 8.68 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.176 -0.466 . . . . 74.34 110.936 -179.848 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 22.0 m-85 -58.11 -32.23 67.91 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.123 -0.489 . . . . 55.5 110.942 -179.981 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -53.48 -37.01 62.3 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.128 -0.487 . . . . 75.1 110.858 179.945 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 48.1 t -84.69 -28.21 6.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.229 -0.441 . . . . 73.51 111.168 179.963 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 10.5 ttp -102.06 33.36 3.09 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.182 -0.463 . . . . 65.41 110.899 179.908 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 5.5 t -86.16 -3.94 59.06 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.183 -0.462 . . . . 55.1 111.153 -179.935 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . 0.668 ' C ' ' HG3' ' A' ' 19' ' ' PRO . 25.4 t -92.94 4.13 7.7 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.219 -0.446 . . . . 73.55 111.124 179.898 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . 0.457 HG22 ' O ' ' A' ' 16' ' ' ILE . 9.5 mt -143.27 3.3 0.35 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 116.152 -0.476 . . . . 72.22 111.123 179.914 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . 0.811 ' C ' ' HD2' ' A' ' 19' ' ' PRO . 0.5 OUTLIER -99.84 -68.78 0.04 OUTLIER Pre-proline 0 C--N 1.329 -0.313 0 CA-C-O 121.676 0.75 . . . . 70.14 110.893 -179.917 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . 0.92 ' N ' ' HD2' ' A' ' 19' ' ' PRO . 53.7 Cg_endo -69.77 -27.86 25.92 Favored 'Trans proline' 0 C--N 1.341 0.165 0 C-N-CA 122.673 2.249 . . . . 64.3 112.36 179.952 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' PRO . . . . . 0.92 ' HD2' ' N ' ' A' ' 18' ' ' PRO . 53.2 Cg_endo -69.77 -16.42 37.51 Favored 'Trans proline' 0 C--N 1.341 0.176 0 C-N-CA 122.668 2.246 . . . . 65.14 112.329 179.96 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 1.5 mt-10 -81.91 -19.52 40.65 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.207 -0.451 . . . . 62.23 110.871 -179.995 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -59.56 -25.71 64.79 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.178 -0.465 . . . . 71.02 110.911 -179.918 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.342 0 C-N-CA 120.752 -0.737 . . . . 53.33 112.469 -179.963 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' TRP . . . . . . . . . . . . . 55.0 m0 . . . . . 0 C--O 1.231 0.127 0 CA-C-O 120.742 0.306 . . . . 72.44 110.917 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER 52.07 68.52 3.1 Favored Pre-proline 0 C--N 1.329 -0.314 0 CA-C-O 121.615 0.722 . . . . 62.15 110.902 -179.933 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.76 -171.04 0.43 Allowed 'Trans proline' 0 C--N 1.341 0.183 0 C-N-CA 122.665 2.243 . . . . 64.23 112.335 -179.968 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 46.0 m-85 -132.21 -64.49 0.77 Allowed 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.192 -0.458 . . . . 71.54 110.891 -179.909 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . 0.425 ' O ' HD12 ' A' ' 5' ' ' LEU . 0.3 OUTLIER -81.11 -24.44 37.68 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.116 -0.493 . . . . 64.02 110.971 179.952 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 1.1 tp60 -55.68 -53.93 50.55 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.16 -0.473 . . . . 70.21 110.917 179.928 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 9.0 t -59.33 -32.32 69.97 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.202 -0.454 . . . . 72.31 111.128 -179.944 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -55.39 -26.26 40.42 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.258 -0.428 . . . . 74.32 110.88 -179.997 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 1.0 OUTLIER -94.71 -41.88 9.04 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.157 -0.474 . . . . 72.22 110.872 -179.836 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 22.7 m-85 -61.03 -26.3 67.52 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.137 -0.483 . . . . 73.24 110.934 -179.881 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -57.14 -41.35 78.96 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.119 -0.491 . . . . 53.44 110.881 179.896 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 50.4 t -84.66 -26.87 6.86 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.195 -0.457 . . . . 72.53 111.141 -179.999 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 10.4 ttp -102.26 33.7 3.01 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.13 -0.486 . . . . 65.14 110.884 179.926 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 5.8 t -86.47 -3.94 59.09 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.264 -0.425 . . . . 73.35 111.143 -179.912 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . 0.68 ' C ' ' HG3' ' A' ' 19' ' ' PRO . 24.3 t -93.87 4.1 8.21 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.208 -0.451 . . . . 72.42 111.155 179.911 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . 0.458 HG22 ' O ' ' A' ' 16' ' ' ILE . 2.8 mp -142.5 3.46 0.4 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.194 -0.457 . . . . 54.51 111.144 179.893 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . 0.794 ' C ' ' HD2' ' A' ' 19' ' ' PRO . 0.5 OUTLIER -100.19 -68.43 0.04 OUTLIER Pre-proline 0 C--N 1.329 -0.296 0 CA-C-O 121.675 0.75 . . . . 74.34 110.895 -179.962 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . 0.919 ' N ' ' HD2' ' A' ' 19' ' ' PRO . 53.1 Cg_endo -69.73 -27.94 26.02 Favored 'Trans proline' 0 C--N 1.341 0.144 0 C-N-CA 122.73 2.286 . . . . 64.14 112.319 179.973 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' PRO . . . . . 0.919 ' HD2' ' N ' ' A' ' 18' ' ' PRO . 53.9 Cg_endo -69.71 -16.42 37.74 Favored 'Trans proline' 0 C--N 1.342 0.213 0 C-N-CA 122.651 2.234 . . . . 74.14 112.366 179.952 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -81.93 -19.76 40.08 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.207 -0.451 . . . . 75.41 110.863 -179.979 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -58.63 -32.93 69.5 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.151 -0.477 . . . . 62.44 110.896 -179.891 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.45 -0.372 0 C-N-CA 120.764 -0.732 . . . . 75.22 112.502 179.979 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' TRP . . . . . . . . . . . . . 41.3 m0 . . . . . 0 C--O 1.231 0.11 0 CA-C-O 120.749 0.309 . . . . 73.32 110.899 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 4.3 mtt180 -74.24 160.64 81.01 Favored Pre-proline 0 C--N 1.329 -0.316 0 CA-C-O 121.64 0.733 . . . . 72.23 110.846 -179.951 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.84 79.41 0.97 Allowed 'Trans proline' 0 C--N 1.341 0.181 0 C-N-CA 122.645 2.23 . . . . 71.34 112.319 -179.983 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 1.7 t80 -134.71 -65.02 0.65 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.205 -0.452 . . . . 75.43 110.905 -179.888 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . 0.425 ' O ' HD12 ' A' ' 5' ' ' LEU . 0.3 OUTLIER -80.88 -24.4 38.36 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.075 -0.511 . . . . 60.1 110.941 179.954 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -51.91 -49.03 63.86 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.223 -0.444 . . . . 72.2 110.875 179.926 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 11.7 t -68.97 -31.37 70.18 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.209 -0.451 . . . . 35.23 111.144 -179.93 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 2.6 mt-10 -54.83 -27.75 44.41 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.246 -0.433 . . . . 65.44 110.889 -179.973 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -83.38 -45.6 13.52 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.152 -0.477 . . . . 73.54 110.903 -179.892 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 13.3 m-85 -63.34 -30.94 71.99 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.124 -0.489 . . . . 62.55 110.952 -179.9 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 2.3 t70 -56.17 -34.1 65.86 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.126 -0.488 . . . . 71.33 110.833 179.901 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 61.5 t -92.72 -28.13 4.56 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.222 -0.444 . . . . 70.02 111.132 -179.988 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 10.4 ttp -102.05 33.84 2.91 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.159 -0.473 . . . . 53.14 110.882 179.955 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 5.8 t -86.59 -3.84 59.09 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.212 -0.449 . . . . 64.14 111.193 -179.949 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . 0.684 ' C ' ' HG3' ' A' ' 19' ' ' PRO . 24.2 t -93.94 4.07 8.27 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.191 -0.459 . . . . 71.13 111.132 179.904 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . 0.465 HG22 ' O ' ' A' ' 16' ' ' ILE . 2.8 mp -142.45 3.45 0.4 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.138 -0.483 . . . . 50.25 111.127 179.872 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . 0.798 ' C ' ' HD2' ' A' ' 19' ' ' PRO . 0.5 OUTLIER -100.18 -68.41 0.04 OUTLIER Pre-proline 0 C--N 1.329 -0.291 0 CA-C-O 121.661 0.743 . . . . 72.23 110.884 -179.952 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . 0.919 ' N ' ' HD2' ' A' ' 19' ' ' PRO . 53.6 Cg_endo -69.75 -27.84 26.03 Favored 'Trans proline' 0 N--CA 1.465 -0.159 0 C-N-CA 122.716 2.277 . . . . 71.32 112.37 179.961 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' PRO . . . . . 0.919 ' HD2' ' N ' ' A' ' 18' ' ' PRO . 54.1 Cg_endo -69.77 -16.41 37.5 Favored 'Trans proline' 0 C--N 1.342 0.203 0 C-N-CA 122.624 2.216 . . . . 72.33 112.361 179.932 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -81.95 -19.85 39.84 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.206 -0.452 . . . . 72.5 110.879 -179.949 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -58.65 -34.54 71.31 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.125 -0.488 . . . . 71.52 110.864 -179.907 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.279 0 C-N-CA 120.748 -0.739 . . . . 52.33 112.427 -179.979 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' TRP . . . . . . . . . . . . . 40.9 m0 . . . . . 0 C--O 1.231 0.103 0 CA-C-O 120.798 0.332 . . . . 72.44 110.903 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 5.0 mpt_? -76.81 160.61 76.32 Favored Pre-proline 0 C--N 1.329 -0.283 0 CA-C-O 121.651 0.739 . . . . 74.33 110.898 -179.996 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.74 170.39 16.68 Favored 'Trans proline' 0 C--N 1.342 0.185 0 C-N-CA 122.708 2.272 . . . . 63.33 112.337 -179.984 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 40.6 m-85 -134.47 -64.03 0.69 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.183 -0.462 . . . . 64.01 110.877 -179.88 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . 0.428 ' O ' HD12 ' A' ' 5' ' ' LEU . 0.3 OUTLIER -82.0 -24.4 35.46 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.119 -0.491 . . . . 74.01 110.956 179.944 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 4.6 tp60 -54.4 -51.38 65.06 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.223 -0.444 . . . . 71.54 110.915 179.881 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 10.3 t -63.41 -32.16 73.51 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.234 -0.439 . . . . 70.33 111.141 -179.928 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 1.3 tt0 -52.92 -29.14 26.78 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.207 -0.452 . . . . 71.14 110.899 -179.984 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -84.78 -45.31 12.49 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.102 -0.499 . . . . 65.33 110.919 -179.837 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 13.3 m-85 -63.61 -26.46 68.69 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.112 -0.495 . . . . 75.33 110.929 -179.932 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 2.0 t70 -58.62 -31.68 68.31 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.128 -0.487 . . . . 71.04 110.87 179.942 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 42.4 t -94.26 -28.77 4.21 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.148 -0.478 . . . . 75.03 111.124 179.99 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 10.3 ttp -102.02 33.77 2.93 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.183 -0.462 . . . . 74.11 110.884 179.928 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 5.8 t -86.5 -3.91 59.09 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.214 -0.448 . . . . 64.34 111.172 -179.978 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . 0.679 ' C ' ' HG3' ' A' ' 19' ' ' PRO . 24.1 t -93.86 4.07 8.22 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.243 -0.435 . . . . 62.11 111.107 179.933 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . 0.463 HG22 ' O ' ' A' ' 16' ' ' ILE . 2.8 mp -142.48 3.45 0.4 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.197 -0.456 . . . . 64.31 111.124 179.916 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . 0.811 ' C ' ' HD2' ' A' ' 19' ' ' PRO . 0.5 OUTLIER -100.23 -68.42 0.04 OUTLIER Pre-proline 0 C--N 1.329 -0.293 0 CA-C-O 121.629 0.728 . . . . 72.12 110.838 -179.936 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . 0.911 ' N ' ' HD2' ' A' ' 19' ' ' PRO . 54.0 Cg_endo -69.72 -27.93 26.07 Favored 'Trans proline' 0 C--N 1.341 0.153 0 C-N-CA 122.726 2.284 . . . . 71.12 112.338 179.995 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' PRO . . . . . 0.911 ' HD2' ' N ' ' A' ' 18' ' ' PRO . 54.1 Cg_endo -69.69 -16.44 37.84 Favored 'Trans proline' 0 C--N 1.341 0.172 0 C-N-CA 122.704 2.27 . . . . 53.24 112.365 179.958 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -81.99 -19.51 40.39 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.184 -0.462 . . . . 74.42 110.852 -179.953 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -59.54 -25.72 64.75 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.139 -0.482 . . . . 72.51 110.912 -179.954 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.347 0 C-N-CA 120.795 -0.717 . . . . 71.24 112.496 -179.968 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' TRP . . . . . . . . . . . . . 43.0 m0 . . . . . 0 C--O 1.231 0.102 0 CA-C-O 120.785 0.326 . . . . 75.44 110.932 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER 52.49 72.1 1.27 Allowed Pre-proline 0 C--N 1.329 -0.309 0 CA-C-O 121.57 0.7 . . . . 72.42 110.873 -179.956 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -69.74 78.79 0.98 Allowed 'Trans proline' 0 C--O 1.231 0.164 0 C-N-CA 122.699 2.266 . . . . 74.44 112.36 179.991 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -135.2 -64.83 0.64 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.197 -0.456 . . . . 75.4 110.922 -179.937 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . 0.437 ' O ' HD12 ' A' ' 5' ' ' LEU . 0.3 OUTLIER -81.02 -24.48 37.9 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.154 -0.475 . . . . 74.35 110.895 179.955 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 18.0 mt-30 -51.91 -48.81 64.01 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.202 -0.454 . . . . 73.14 110.882 179.967 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 11.8 t -69.21 -31.31 69.81 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.198 -0.456 . . . . 72.44 111.203 -179.957 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -54.89 -28.67 52.2 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.174 -0.466 . . . . 73.11 110.896 -179.989 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -82.59 -45.07 15.06 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.123 -0.49 . . . . 75.11 110.906 -179.848 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 13.9 m-85 -63.76 -28.63 70.01 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.085 -0.507 . . . . 63.15 110.9 -179.907 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 27.8 t70 -61.45 -45.43 94.32 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.127 -0.488 . . . . 72.22 110.898 179.927 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 41.4 t -81.06 -26.88 10.75 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.196 -0.456 . . . . 53.13 111.121 179.976 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 9.4 ttp -102.24 32.78 3.36 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.212 -0.449 . . . . 73.03 110.872 179.928 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 5.9 t -86.78 -3.76 59.09 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.209 -0.45 . . . . 74.42 111.143 -179.899 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . 0.69 ' C ' ' HG3' ' A' ' 19' ' ' PRO . 23.2 t -94.25 4.58 8.13 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.187 -0.461 . . . . 64.42 111.122 179.904 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . 0.461 HG22 ' O ' ' A' ' 16' ' ' ILE . 2.8 mp -142.46 3.28 0.4 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.157 -0.474 . . . . 74.01 111.149 179.892 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . 0.791 ' C ' ' HD2' ' A' ' 19' ' ' PRO . 0.5 OUTLIER -100.27 -68.24 0.05 OUTLIER Pre-proline 0 C--N 1.33 -0.272 0 CA-C-O 121.688 0.756 . . . . 75.3 110.926 -179.965 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . 0.929 ' N ' ' HD2' ' A' ' 19' ' ' PRO . 53.8 Cg_endo -69.79 -27.8 25.88 Favored 'Trans proline' 0 C--N 1.342 0.206 0 C-N-CA 122.681 2.254 . . . . 73.13 112.362 179.946 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' PRO . . . . . 0.929 ' HD2' ' N ' ' A' ' 18' ' ' PRO . 53.5 Cg_endo -69.77 -16.46 37.54 Favored 'Trans proline' 0 C--N 1.342 0.205 0 C-N-CA 122.717 2.278 . . . . 55.15 112.32 179.949 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -81.94 -19.91 39.72 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.249 -0.432 . . . . 73.02 110.909 -179.954 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -58.57 -34.34 70.96 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.136 -0.484 . . . . 72.45 110.866 -179.934 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.296 0 C-N-CA 120.775 -0.726 . . . . 64.11 112.488 -179.906 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' TRP . . . . . . . . . . . . . 43.0 m0 . . . . . 0 C--O 1.231 0.095 0 CA-C-O 120.787 0.327 . . . . 64.2 110.892 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 2.6 mpp_? -56.3 160.58 4.85 Favored Pre-proline 0 C--N 1.329 -0.302 0 CA-C-O 121.596 0.712 . . . . 71.01 110.879 -179.961 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.75 109.62 2.35 Favored 'Trans proline' 0 C--N 1.341 0.184 0 C-N-CA 122.658 2.239 . . . . 74.14 112.354 180.0 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 5.7 t80 -134.91 -65.46 0.62 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.266 -0.425 . . . . 64.34 110.931 -179.911 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . 0.428 ' O ' HD12 ' A' ' 5' ' ' LEU . 0.3 OUTLIER -79.96 -24.49 40.91 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.119 -0.492 . . . . 72.22 110.952 179.946 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -51.98 -50.83 60.5 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.152 -0.477 . . . . 75.1 110.911 179.948 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 11.1 t -66.62 -31.68 72.53 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.202 -0.454 . . . . 50.32 111.156 -179.949 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -55.51 -26.11 41.07 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.2 -0.455 . . . . 70.52 110.921 180.0 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 2.4 m-85 -94.82 -45.06 7.47 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.138 -0.483 . . . . 75.13 110.891 -179.858 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 22.7 m-85 -56.99 -28.53 62.5 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.128 -0.487 . . . . 63.04 110.908 -179.89 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 2.3 t70 -56.72 -27.22 58.77 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.101 -0.5 . . . . 62.33 110.828 179.964 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 64.1 t -95.93 -28.71 3.93 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.222 -0.444 . . . . 75.12 111.152 179.978 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 10.4 ttp -101.74 33.28 3.05 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.188 -0.46 . . . . 72.33 110.863 179.897 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 5.7 t -86.02 -3.97 59.06 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.219 -0.446 . . . . 61.13 111.162 -179.956 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . 0.669 ' C ' ' HG3' ' A' ' 19' ' ' PRO . 24.4 t -93.84 4.85 7.74 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.191 -0.459 . . . . 53.24 111.11 179.95 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . 0.459 HG22 ' O ' ' A' ' 16' ' ' ILE . 9.6 mt -143.47 3.04 0.34 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 116.177 -0.465 . . . . 72.3 111.121 179.943 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . 0.805 ' C ' ' HD2' ' A' ' 19' ' ' PRO . 0.5 OUTLIER -100.18 -68.39 0.04 OUTLIER Pre-proline 0 C--N 1.329 -0.295 0 CA-C-O 121.613 0.72 . . . . 75.4 110.837 -179.911 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . 0.909 ' N ' ' HD2' ' A' ' 19' ' ' PRO . 54.0 Cg_endo -69.74 -27.89 26.01 Favored 'Trans proline' 0 C--O 1.232 0.203 0 C-N-CA 122.657 2.238 . . . . 72.31 112.339 179.983 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' PRO . . . . . 0.909 ' HD2' ' N ' ' A' ' 18' ' ' PRO . 54.1 Cg_endo -69.71 -16.78 37.91 Favored 'Trans proline' 0 C--N 1.341 0.155 0 C-N-CA 122.725 2.284 . . . . 63.0 112.383 179.921 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 24.4 tt0 -82.55 -21.26 35.41 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.177 -0.465 . . . . 64.21 110.906 179.991 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -58.22 -34.16 70.11 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.173 -0.467 . . . . 74.12 110.864 -179.92 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.292 0 C-N-CA 120.755 -0.736 . . . . 73.32 112.475 -179.957 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' TRP . . . . . . . . . . . . . 41.9 m0 . . . . . 0 C--O 1.231 0.097 0 CA-C-O 120.764 0.316 . . . . 71.33 110.891 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 53.9 73.27 0.94 Allowed Pre-proline 0 C--N 1.329 -0.297 0 CA-C-O 121.609 0.719 . . . . 70.41 110.862 -179.977 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.78 78.74 0.99 Allowed 'Trans proline' 0 C--N 1.341 0.145 0 C-N-CA 122.696 2.264 . . . . 61.13 112.326 179.99 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 5.5 t80 -135.27 -65.24 0.62 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.245 -0.434 . . . . 61.53 110.894 -179.897 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . 0.431 ' O ' HD12 ' A' ' 5' ' ' LEU . 0.3 OUTLIER -80.55 -24.45 39.24 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.142 -0.481 . . . . 73.45 110.881 -179.993 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -51.89 -49.38 63.1 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.216 -0.447 . . . . 73.33 110.942 179.939 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 11.4 t -68.58 -31.43 70.62 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.215 -0.448 . . . . 62.31 111.13 -179.912 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -55.38 -28.39 53.68 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.212 -0.449 . . . . 52.23 110.905 179.98 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 1.3 m-85 -85.7 -45.26 11.84 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.153 -0.476 . . . . 75.43 110.885 -179.853 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 13.6 m-85 -62.75 -31.34 72.27 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.165 -0.47 . . . . 71.04 110.931 -179.903 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 16.6 t0 -54.21 -34.38 60.47 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.073 -0.512 . . . . 72.42 110.903 179.924 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 58.5 t -92.92 -28.12 4.52 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.21 -0.45 . . . . 72.32 111.142 179.982 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 10.5 ttp -102.08 33.88 2.9 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.167 -0.469 . . . . 63.24 110.906 179.878 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 5.6 t -86.67 -3.92 59.1 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.198 -0.455 . . . . 73.42 111.186 -179.944 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . 0.686 ' C ' ' HG3' ' A' ' 19' ' ' PRO . 25.0 t -93.07 3.49 8.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.17 -0.468 . . . . 44.13 111.094 179.937 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . 0.458 HG22 ' O ' ' A' ' 16' ' ' ILE . 2.8 mp -142.45 3.71 0.4 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.171 -0.468 . . . . 62.21 111.121 179.929 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . 0.805 ' C ' ' HD2' ' A' ' 19' ' ' PRO . 0.5 OUTLIER -99.92 -68.77 0.04 OUTLIER Pre-proline 0 C--N 1.329 -0.303 0 CA-C-O 121.681 0.753 . . . . 44.1 110.904 -179.951 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . 0.92 ' N ' ' HD2' ' A' ' 19' ' ' PRO . 53.7 Cg_endo -69.82 -27.86 25.69 Favored 'Trans proline' 0 C--O 1.231 0.174 0 C-N-CA 122.675 2.25 . . . . 71.51 112.334 179.963 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' PRO . . . . . 0.92 ' HD2' ' N ' ' A' ' 18' ' ' PRO . 53.7 Cg_endo -69.78 -16.48 37.51 Favored 'Trans proline' 0 C--N 1.341 0.145 0 C-N-CA 122.701 2.267 . . . . 74.04 112.372 179.938 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 1.5 mt-10 -81.94 -19.89 39.75 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.193 -0.458 . . . . 71.42 110.911 -179.984 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -58.59 -34.43 71.08 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.119 -0.491 . . . . 75.54 110.848 -179.91 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.289 0 C-N-CA 120.715 -0.755 . . . . 73.35 112.529 -179.929 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' TRP . . . . . . . . . . . . . 33.8 m0 . . . . . 0 C--O 1.231 0.131 0 CA-C-O 120.779 0.323 . . . . 72.22 110.909 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -151.05 69.42 8.33 Favored Pre-proline 0 C--N 1.329 -0.298 0 CA-C-O 121.601 0.715 . . . . 44.13 110.876 -179.976 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.79 83.45 0.7 Allowed 'Trans proline' 0 C--N 1.341 0.141 0 C-N-CA 122.676 2.25 . . . . 62.02 112.307 -179.986 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' TYR . . . . . 0.446 ' O ' HG22 ' A' ' 7' ' ' THR . 43.4 m-85 -134.17 -68.0 0.57 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.197 -0.456 . . . . 73.23 110.949 -179.94 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . 0.445 ' O ' HD12 ' A' ' 5' ' ' LEU . 0.3 OUTLIER -76.74 -24.2 53.01 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.077 -0.51 . . . . 75.33 110.894 179.973 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 52.7 mm-40 -55.24 -57.63 11.0 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.167 -0.47 . . . . 74.43 110.945 179.9 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . 0.446 HG22 ' O ' ' A' ' 4' ' ' TYR . 15.1 t -53.52 -27.87 28.11 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.208 -0.451 . . . . 54.13 111.147 -179.922 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 4.1 tt0 -59.53 -20.92 59.02 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.201 -0.454 . . . . 75.21 110.915 179.959 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 0.9 OUTLIER -105.35 -18.75 14.02 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.136 -0.484 . . . . 75.03 110.954 -179.834 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 3.2 m-85 -51.47 -39.49 57.61 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.124 -0.489 . . . . 73.23 110.936 -179.913 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -51.94 -30.9 26.57 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.088 -0.505 . . . . 61.44 110.892 179.865 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 23.5 t -101.03 -26.83 3.49 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.214 -0.448 . . . . 62.51 111.152 179.988 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 10.5 ttp -102.12 33.97 2.88 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.112 -0.494 . . . . 75.22 110.878 179.937 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 5.7 t -86.68 -4.0 59.12 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.247 -0.433 . . . . 70.32 111.158 -179.927 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . 0.679 ' C ' ' HG3' ' A' ' 19' ' ' PRO . 25.0 t -92.98 3.43 8.18 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 116.198 -0.455 . . . . 63.14 111.129 179.932 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . 0.452 HG22 ' O ' ' A' ' 16' ' ' ILE . 2.8 mp -142.37 3.68 0.41 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.175 -0.466 . . . . 74.44 111.178 179.95 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . 0.809 ' C ' ' HD2' ' A' ' 19' ' ' PRO . 0.5 OUTLIER -99.95 -68.81 0.04 OUTLIER Pre-proline 0 C--N 1.33 -0.268 0 CA-C-O 121.615 0.721 . . . . 73.44 110.846 -179.942 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . 0.927 ' N ' ' HD2' ' A' ' 19' ' ' PRO . 54.5 Cg_endo -69.68 -27.88 26.3 Favored 'Trans proline' 0 C--N 1.341 0.166 0 C-N-CA 122.681 2.254 . . . . 52.45 112.379 179.939 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' PRO . . . . . 0.927 ' HD2' ' N ' ' A' ' 18' ' ' PRO . 53.9 Cg_endo -69.75 -16.57 37.65 Favored 'Trans proline' 0 C--N 1.341 0.151 0 C-N-CA 122.689 2.259 . . . . 62.32 112.378 179.922 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -81.85 -19.91 40.04 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.186 -0.461 . . . . 74.02 110.906 -179.982 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -58.54 -33.4 69.85 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.14 -0.482 . . . . 73.54 110.883 -179.933 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.314 0 C-N-CA 120.715 -0.755 . . . . 72.44 112.516 -179.929 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 1' ' ' TRP . . . . . . . . . . . . . 37.9 m0 . . . . . 0 C--O 1.231 0.085 0 CA-C-O 120.795 0.331 . . . . 73.34 110.9 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -120.78 157.65 54.06 Favored Pre-proline 0 C--N 1.329 -0.285 0 CA-C-O 121.594 0.711 . . . . 74.24 110.892 -179.988 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.84 159.82 51.94 Favored 'Trans proline' 0 C--N 1.341 0.177 0 C-N-CA 122.708 2.272 . . . . 51.12 112.326 -179.99 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 37.5 m-85 -133.96 -63.95 0.72 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.22 -0.446 . . . . 74.3 110.94 -179.895 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . 0.429 ' O ' HD12 ' A' ' 5' ' ' LEU . 0.3 OUTLIER -82.09 -24.39 35.23 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.105 -0.498 . . . . 71.41 110.907 179.948 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 7.8 mm-40 -55.06 -52.11 64.23 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.224 -0.443 . . . . 73.13 110.886 179.916 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 9.0 t -62.2 -32.53 73.19 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.213 -0.449 . . . . 75.04 111.141 -179.913 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -52.89 -29.27 27.33 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.223 -0.444 . . . . 71.4 110.906 179.974 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -82.55 -46.06 13.86 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.12 -0.491 . . . . 74.43 110.964 -179.858 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 14.6 m-85 -62.55 -30.31 71.22 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.081 -0.508 . . . . 74.44 110.945 -179.943 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 4.4 t70 -57.93 -44.7 87.06 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.093 -0.503 . . . . 73.45 110.888 179.913 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 61.9 t -83.62 -27.04 7.52 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-N 116.203 -0.453 . . . . 75.03 111.102 -179.973 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 10.3 ttp -101.94 33.76 2.92 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.191 -0.459 . . . . 73.45 110.906 179.908 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 5.8 t -86.48 -3.93 59.09 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.236 -0.438 . . . . 54.11 111.177 -179.972 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . 0.673 ' C ' ' HG3' ' A' ' 19' ' ' PRO . 24.1 t -93.85 4.07 8.22 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.207 -0.451 . . . . 72.41 111.111 179.924 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . 0.461 HG22 ' O ' ' A' ' 16' ' ' ILE . 2.8 mp -142.49 3.43 0.4 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.225 -0.443 . . . . 74.43 111.128 179.954 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . 0.811 ' C ' ' HD2' ' A' ' 19' ' ' PRO . 0.5 OUTLIER -100.24 -68.39 0.04 OUTLIER Pre-proline 0 C--N 1.33 -0.239 0 CA-C-O 121.639 0.733 . . . . 55.23 110.832 -179.91 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . 0.908 ' N ' ' HD2' ' A' ' 19' ' ' PRO . 53.6 Cg_endo -69.73 -27.89 26.07 Favored 'Trans proline' 0 C--N 1.341 0.179 0 C-N-CA 122.746 2.297 . . . . 72.44 112.298 179.994 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 19' ' ' PRO . . . . . 0.908 ' HD2' ' N ' ' A' ' 18' ' ' PRO . 53.4 Cg_endo -69.76 -16.45 37.58 Favored 'Trans proline' 0 C--N 1.342 0.187 0 C-N-CA 122.687 2.258 . . . . 72.25 112.355 179.972 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -81.9 -19.88 39.92 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.235 -0.439 . . . . 71.24 110.924 179.987 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -58.68 -33.95 70.72 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.123 -0.49 . . . . 73.12 110.874 -179.928 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.326 0 C-N-CA 120.782 -0.723 . . . . 61.31 112.469 -179.962 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 1' ' ' TRP . . . . . . . . . . . . . 2.3 t90 . . . . . 0 C--O 1.231 0.123 0 CA-C-O 120.787 0.327 . . . . 72.23 110.915 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 2.4 ptt180 -123.18 73.47 48.49 Favored Pre-proline 0 C--N 1.329 -0.297 0 CA-C-O 121.596 0.712 . . . . 73.43 110.846 -179.953 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.75 79.69 0.93 Allowed 'Trans proline' 0 C--O 1.232 0.184 0 C-N-CA 122.682 2.255 . . . . 60.51 112.358 179.959 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 5.2 t80 -135.92 -65.18 0.59 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.245 -0.434 . . . . 72.54 110.915 -179.882 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . 0.429 ' O ' HD12 ' A' ' 5' ' ' LEU . 0.3 OUTLIER -80.29 -24.36 40.07 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.122 -0.49 . . . . 64.33 110.922 179.976 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 45.1 mt-30 -51.86 -50.41 60.99 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.2 -0.455 . . . . 64.34 110.949 179.875 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 11.3 t -67.29 -31.63 72.08 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.19 -0.459 . . . . 71.33 111.158 -179.953 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -56.6 -30.28 63.07 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.192 -0.458 . . . . 75.23 110.88 -179.958 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 1.2 m-85 -85.82 -44.29 12.59 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.157 -0.474 . . . . 75.21 110.974 -179.911 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 16.4 m-85 -62.39 -28.56 69.86 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.113 -0.494 . . . . 73.24 110.916 -179.919 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -54.7 -42.87 71.98 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.121 -0.49 . . . . 54.31 110.855 179.901 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 57.6 t -88.73 -25.84 5.7 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.192 -0.458 . . . . 72.42 111.122 -179.974 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 10.3 ttp -102.0 33.75 2.94 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.184 -0.462 . . . . 74.24 110.86 179.898 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 5.8 t -86.52 -3.89 59.09 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.234 -0.439 . . . . 32.45 111.136 -179.948 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . 0.686 ' C ' ' HG3' ' A' ' 19' ' ' PRO . 24.3 t -93.88 4.07 8.23 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.232 -0.44 . . . . 62.43 111.116 179.926 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . 0.453 HG22 ' O ' ' A' ' 16' ' ' ILE . 2.8 mp -142.44 3.4 0.4 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.188 -0.46 . . . . 54.04 111.143 179.911 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . 0.806 ' C ' ' HD2' ' A' ' 19' ' ' PRO . 0.5 OUTLIER -100.2 -68.36 0.04 OUTLIER Pre-proline 0 C--N 1.329 -0.325 0 CA-C-O 121.642 0.734 . . . . 63.14 110.865 -179.88 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . 0.915 ' N ' ' HD2' ' A' ' 19' ' ' PRO . 53.5 Cg_endo -69.82 -27.88 25.62 Favored 'Trans proline' 0 C--N 1.341 0.158 0 C-N-CA 122.678 2.252 . . . . 61.33 112.323 179.985 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 19' ' ' PRO . . . . . 0.915 ' HD2' ' N ' ' A' ' 18' ' ' PRO . 53.9 Cg_endo -69.74 -16.82 37.81 Favored 'Trans proline' 0 C--N 1.341 0.168 0 C-N-CA 122.73 2.287 . . . . 70.44 112.323 179.929 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 29.4 tt0 -82.52 -21.29 35.46 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.243 -0.435 . . . . 74.12 110.887 -179.969 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -58.28 -31.34 67.37 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.144 -0.48 . . . . 61.42 110.842 -179.884 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.325 0 C-N-CA 120.716 -0.754 . . . . 63.13 112.52 -179.945 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 1' ' ' TRP . . . . . . . . . . . . . 3.3 t90 . . . . . 0 C--O 1.231 0.121 0 CA-C-O 120.78 0.324 . . . . 74.25 110.885 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -97.0 160.61 28.7 Favored Pre-proline 0 C--N 1.329 -0.305 0 CA-C-O 121.609 0.719 . . . . 64.44 110.89 -179.976 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.73 88.02 0.54 Allowed 'Trans proline' 0 C--O 1.232 0.194 0 C-N-CA 122.726 2.284 . . . . 62.3 112.395 179.967 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -138.43 -66.6 0.48 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.206 -0.452 . . . . 71.43 110.876 -179.878 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . 0.414 ' O ' HD12 ' A' ' 5' ' ' LEU . 0.4 OUTLIER -77.86 -24.63 48.51 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.115 -0.493 . . . . 65.42 110.886 -179.966 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 6.8 mt-30 -53.68 -56.53 16.48 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.171 -0.468 . . . . 71.45 110.867 179.983 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 14.9 t -56.67 -27.21 58.3 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.184 -0.462 . . . . 65.2 111.162 -179.878 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -66.16 -16.41 63.95 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.207 -0.451 . . . . 74.24 110.871 179.999 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -101.08 -20.06 15.52 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.169 -0.469 . . . . 72.2 110.916 -179.853 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 3.6 m-85 -51.39 -36.7 44.65 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.14 -0.482 . . . . 74.42 110.905 -179.949 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 11.1 t0 -52.29 -31.41 32.72 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.127 -0.488 . . . . 64.22 110.878 179.932 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 60.8 t -102.42 -25.58 3.72 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.189 -0.46 . . . . 70.41 111.077 -179.946 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 10.4 ttp -102.2 34.27 2.79 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.193 -0.458 . . . . 62.12 110.895 179.923 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 5.6 t -86.85 -4.05 59.13 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.243 -0.435 . . . . 72.14 111.162 -179.964 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . 0.686 ' C ' ' HG3' ' A' ' 19' ' ' PRO . 24.6 t -93.0 3.45 8.18 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.217 -0.447 . . . . 61.23 111.09 179.93 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . 0.463 HG22 ' O ' ' A' ' 16' ' ' ILE . 2.8 mp -142.3 3.63 0.41 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 116.19 -0.459 . . . . 75.3 111.132 179.942 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . 0.789 ' C ' ' HD2' ' A' ' 19' ' ' PRO . 0.5 OUTLIER -99.91 -68.8 0.04 OUTLIER Pre-proline 0 C--N 1.329 -0.326 0 CA-C-O 121.618 0.723 . . . . 63.12 110.869 -179.89 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . 0.918 ' N ' ' HD2' ' A' ' 19' ' ' PRO . 53.3 Cg_endo -69.77 -27.91 25.86 Favored 'Trans proline' 0 C--O 1.231 0.168 0 C-N-CA 122.738 2.292 . . . . 72.41 112.326 179.975 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 19' ' ' PRO . . . . . 0.918 ' HD2' ' N ' ' A' ' 18' ' ' PRO . 54.1 Cg_endo -69.76 -16.24 37.48 Favored 'Trans proline' 0 C--N 1.341 0.181 0 C-N-CA 122.715 2.276 . . . . 64.33 112.335 179.956 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 1.8 mt-10 -82.12 -19.74 39.45 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.221 -0.445 . . . . 72.23 110.891 -179.973 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -59.39 -25.6 64.41 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.167 -0.469 . . . . 75.2 110.88 -179.891 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.45 -0.368 0 C-N-CA 120.771 -0.728 . . . . 62.51 112.513 -179.985 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 1' ' ' TRP . . . . . . . . . . . . . 49.3 m0 . . . . . 0 C--O 1.231 0.097 0 CA-C-O 120.779 0.323 . . . . 73.54 110.859 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 53.35 68.34 3.01 Favored Pre-proline 0 C--N 1.329 -0.305 0 CA-C-O 121.63 0.729 . . . . 72.11 110.897 -179.962 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.71 -172.23 0.55 Allowed 'Trans proline' 0 C--N 1.342 0.189 0 C-N-CA 122.692 2.261 . . . . 74.52 112.355 179.975 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 39.9 m-85 -135.28 -63.47 0.68 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.224 -0.444 . . . . 62.42 110.951 -179.906 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . 0.429 ' O ' HD12 ' A' ' 5' ' ' LEU . 0.3 OUTLIER -82.61 -24.43 33.87 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.094 -0.503 . . . . 63.14 110.935 179.943 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -56.58 -53.12 61.25 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.187 -0.461 . . . . 60.22 110.884 179.953 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 9.7 t -60.13 -33.51 72.24 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.198 -0.456 . . . . 71.24 111.163 -179.928 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -52.89 -29.26 27.31 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.18 -0.464 . . . . 61.14 110.877 -179.98 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 1.2 m-85 -94.85 -45.02 7.48 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.165 -0.471 . . . . 74.04 110.958 -179.879 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 24.4 m-85 -54.09 -33.74 58.4 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.101 -0.5 . . . . 74.04 110.924 -179.923 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -53.49 -34.61 58.69 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.114 -0.494 . . . . 72.13 110.862 179.951 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 47.5 t -85.06 -30.48 6.71 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.218 -0.446 . . . . 62.32 111.092 -179.965 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 10.4 ttp -102.01 33.9 2.89 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.163 -0.471 . . . . 73.14 110.92 179.903 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 5.6 t -86.71 -3.91 59.11 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.206 -0.452 . . . . 73.35 111.175 -179.913 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . 0.673 ' C ' ' HG3' ' A' ' 19' ' ' PRO . 24.7 t -93.04 3.44 8.21 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.194 -0.457 . . . . 74.1 111.155 179.866 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . 0.457 HG22 ' O ' ' A' ' 16' ' ' ILE . 2.8 mp -142.31 3.67 0.41 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.17 -0.468 . . . . 53.34 111.138 179.89 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . 0.795 ' C ' ' HD2' ' A' ' 19' ' ' PRO . 0.5 OUTLIER -99.91 -68.78 0.04 OUTLIER Pre-proline 0 C--N 1.33 -0.274 0 CA-C-O 121.664 0.745 . . . . 74.22 110.848 -179.889 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . 0.913 ' N ' ' HD2' ' A' ' 19' ' ' PRO . 53.6 Cg_endo -69.75 -27.95 25.91 Favored 'Trans proline' 0 C--N 1.341 0.167 0 C-N-CA 122.752 2.301 . . . . 62.54 112.335 179.974 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 19' ' ' PRO . . . . . 0.913 ' HD2' ' N ' ' A' ' 18' ' ' PRO . 53.7 Cg_endo -69.81 -16.71 37.48 Favored 'Trans proline' 0 C--N 1.342 0.188 0 C-N-CA 122.66 2.24 . . . . 72.23 112.361 179.939 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 60.2 tt0 -82.63 -21.28 35.13 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.216 -0.447 . . . . 74.11 110.854 179.994 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -58.19 -34.24 70.15 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.223 -0.444 . . . . 74.45 110.83 -179.876 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.271 0 C-N-CA 120.754 -0.736 . . . . 61.42 112.465 -179.953 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 1' ' ' TRP . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.231 0.109 0 CA-C-O 120.745 0.307 . . . . 72.32 110.936 . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 5.4 tpt180 -166.19 73.15 1.22 Allowed Pre-proline 0 C--N 1.329 -0.303 0 CA-C-O 121.611 0.719 . . . . 73.31 110.916 -179.929 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.76 93.31 0.52 Allowed 'Trans proline' 0 C--O 1.232 0.202 0 C-N-CA 122.703 2.269 . . . . 75.32 112.324 -179.965 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 1.0 OUTLIER -83.33 -32.53 26.23 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.254 -0.43 . . . . 71.54 110.897 -179.923 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -105.02 -32.66 8.62 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.174 -0.466 . . . . 72.11 110.916 179.978 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -51.85 -43.19 63.1 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.207 -0.451 . . . . 73.34 110.919 179.932 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 12.5 t -85.44 -27.75 25.52 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.203 -0.453 . . . . 71.41 111.136 -179.929 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 2.5 tt0 -68.76 -33.3 73.66 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.238 -0.437 . . . . 75.42 110.885 -179.998 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 2.5 t80 -70.05 -36.33 74.91 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.159 -0.473 . . . . 73.31 110.898 -179.839 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 23.4 m-85 -63.17 -32.27 73.62 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.116 -0.493 . . . . 72.44 110.914 -179.916 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -56.17 -29.22 60.54 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.136 -0.484 . . . . 64.42 110.854 179.938 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 53.4 t -94.39 -29.52 4.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.223 -0.444 . . . . 51.0 111.135 180.0 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 10.5 ttp -101.68 33.22 3.06 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.171 -0.468 . . . . 72.25 110.9 179.887 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 5.7 t -85.92 -4.01 59.06 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.223 -0.444 . . . . 71.15 111.14 -179.94 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . 0.68 ' C ' ' HG3' ' A' ' 19' ' ' PRO . 24.5 t -93.78 4.77 7.76 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.229 -0.441 . . . . 73.12 111.13 179.966 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . 0.447 ' O ' HG22 ' A' ' 16' ' ' ILE . 9.7 mt -143.49 3.2 0.34 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.156 -0.474 . . . . 71.1 111.097 179.927 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . 0.791 ' C ' ' HD2' ' A' ' 19' ' ' PRO . 0.5 OUTLIER -100.27 -68.42 0.04 OUTLIER Pre-proline 0 C--N 1.329 -0.291 0 CA-C-O 121.674 0.749 . . . . 73.35 110.839 -179.911 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . 0.912 ' N ' ' HD2' ' A' ' 19' ' ' PRO . 54.4 Cg_endo -69.71 -27.88 26.17 Favored 'Trans proline' 0 C--O 1.232 0.184 0 C-N-CA 122.683 2.255 . . . . 73.44 112.373 179.933 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 19' ' ' PRO . . . . . 0.912 ' HD2' ' N ' ' A' ' 18' ' ' PRO . 54.4 Cg_endo -69.72 -16.43 37.74 Favored 'Trans proline' 0 C--N 1.341 0.149 0 C-N-CA 122.693 2.262 . . . . 64.41 112.38 179.906 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 2.9 mt-10 -81.91 -19.92 39.83 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.194 -0.457 . . . . 74.31 110.901 -179.998 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -58.61 -34.4 71.09 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.127 -0.488 . . . . 73.23 110.914 -179.916 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.266 0 C-N-CA 120.766 -0.731 . . . . 45.15 112.472 -179.981 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 1' ' ' TRP . . . . . . . . . . . . . 53.8 m0 . . . . . 0 C--O 1.231 0.096 0 CA-C-O 120.752 0.311 . . . . 75.44 110.934 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 4.3 mpt_? 57.81 72.26 0.93 Allowed Pre-proline 0 C--N 1.33 -0.282 0 CA-C-O 121.559 0.695 . . . . 70.33 110.882 -179.927 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_endo -69.81 -171.0 0.43 Allowed 'Trans proline' 0 C--N 1.341 0.182 0 C-N-CA 122.655 2.237 . . . . 72.43 112.326 -179.996 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 4' ' ' TYR . . . . . 0.494 ' C ' HD23 ' A' ' 5' ' ' LEU . 6.3 m-85 66.21 121.64 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.178 -0.465 . . . . 74.14 110.931 -179.876 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . 0.494 HD23 ' C ' ' A' ' 4' ' ' TYR . 0.0 OUTLIER -152.34 -41.15 0.11 Allowed 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.138 -0.483 . . . . 64.41 110.929 179.97 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -49.94 -43.59 50.03 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.184 -0.462 . . . . 74.32 110.908 179.988 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 10.2 t -90.59 -30.88 16.94 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.214 -0.448 . . . . 61.42 111.13 -179.946 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 1.1 mt-10 -68.19 -20.6 64.87 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.196 -0.456 . . . . 54.21 110.875 -179.967 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 1.6 t80 -84.1 -38.28 20.96 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.139 -0.482 . . . . 65.41 110.923 -179.88 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 20.7 m-85 -56.6 -29.17 61.83 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.118 -0.492 . . . . 71.54 110.889 -179.901 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 2.6 m-20 -66.05 -43.69 86.73 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.14 -0.482 . . . . 64.03 110.865 179.919 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 26.0 t -78.62 -28.71 14.42 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.218 -0.446 . . . . 53.12 111.086 -179.97 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 10.6 ttp -101.93 33.43 3.04 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.215 -0.448 . . . . 64.31 110.894 179.901 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 5.5 t -86.12 -4.04 59.08 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.194 -0.457 . . . . 74.53 111.139 -179.94 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . 0.664 ' C ' ' HG3' ' A' ' 19' ' ' PRO . 25.8 t -92.89 4.15 7.66 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-N 116.228 -0.442 . . . . 52.3 111.113 179.901 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . 0.458 HG22 ' O ' ' A' ' 16' ' ' ILE . 9.3 mt -143.34 3.4 0.35 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.195 -0.457 . . . . 61.35 111.102 179.901 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . 0.792 ' C ' ' HD2' ' A' ' 19' ' ' PRO . 0.5 OUTLIER -99.9 -68.75 0.04 OUTLIER Pre-proline 0 C--N 1.329 -0.295 0 CA-C-O 121.683 0.754 . . . . 73.44 110.882 -179.94 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . 0.93 ' N ' ' HD2' ' A' ' 19' ' ' PRO . 53.3 Cg_endo -69.83 -27.79 25.72 Favored 'Trans proline' 0 C--N 1.341 0.168 0 C-N-CA 122.673 2.248 . . . . 74.23 112.333 179.994 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 19' ' ' PRO . . . . . 0.93 ' HD2' ' N ' ' A' ' 18' ' ' PRO . 53.3 Cg_endo -69.82 -16.43 37.3 Favored 'Trans proline' 0 C--N 1.342 0.193 0 C-N-CA 122.683 2.255 . . . . 62.31 112.301 179.957 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -81.91 -19.55 40.57 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.267 -0.424 . . . . 73.51 110.872 -179.965 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -59.78 -25.77 65.18 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.144 -0.48 . . . . 71.52 110.827 -179.887 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.299 0 C-N-CA 120.75 -0.738 . . . . 55.11 112.527 -179.991 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 1' ' ' TRP . . . . . . . . . . . . . 42.8 m0 . . . . . 0 C--O 1.232 0.137 0 CA-C-O 120.763 0.316 . . . . 74.25 110.925 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 1.2 mpt_? -117.87 71.32 7.84 Favored Pre-proline 0 C--N 1.328 -0.339 0 CA-C-O 121.621 0.724 . . . . 75.22 110.884 -179.937 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_endo -69.77 136.69 33.6 Favored 'Trans proline' 0 C--O 1.232 0.191 0 C-N-CA 122.672 2.248 . . . . 74.03 112.326 -179.975 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 0.8 OUTLIER -116.78 -32.33 5.17 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.238 -0.437 . . . . 74.35 110.923 -179.911 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -103.93 -31.29 9.82 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.15 -0.477 . . . . 74.45 110.941 179.949 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -51.21 -43.99 61.53 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.167 -0.469 . . . . 62.24 110.934 179.914 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 14.2 t -81.45 -26.01 35.66 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.238 -0.437 . . . . 61.42 111.142 -179.959 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 29.5 tp10 -68.88 -43.5 75.21 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.217 -0.447 . . . . 74.44 110.918 179.993 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 2.3 t80 -59.36 -34.93 72.99 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.139 -0.482 . . . . 74.43 110.927 -179.884 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 22.0 m-85 -66.98 -26.77 66.97 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.141 -0.481 . . . . 64.53 110.933 -179.955 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 17.3 t0 -58.78 -34.09 71.06 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.138 -0.483 . . . . 74.24 110.86 179.911 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 56.4 t -90.5 -27.51 5.05 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.21 -0.45 . . . . 74.35 111.154 -179.998 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 10.4 ttp -102.23 33.7 3.0 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.117 -0.492 . . . . 74.12 110.883 179.931 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 5.8 t -86.49 -3.89 59.08 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.203 -0.453 . . . . 63.11 111.153 -179.912 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . 0.688 ' C ' ' HG3' ' A' ' 19' ' ' PRO . 24.0 t -93.88 4.07 8.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.186 -0.461 . . . . 64.22 111.131 179.928 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . 0.45 ' O ' HG22 ' A' ' 16' ' ' ILE . 2.8 mp -142.47 3.41 0.4 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.172 -0.467 . . . . 70.22 111.176 179.898 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . 0.797 ' C ' ' HD2' ' A' ' 19' ' ' PRO . 0.5 OUTLIER -100.16 -68.48 0.04 OUTLIER Pre-proline 0 C--N 1.328 -0.33 0 CA-C-O 121.654 0.74 . . . . 73.21 110.877 -179.941 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . 0.914 ' N ' ' HD2' ' A' ' 19' ' ' PRO . 53.6 Cg_endo -69.74 -27.84 26.09 Favored 'Trans proline' 0 C--N 1.341 0.178 0 C-N-CA 122.701 2.268 . . . . 74.11 112.344 179.987 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 19' ' ' PRO . . . . . 0.914 ' HD2' ' N ' ' A' ' 18' ' ' PRO . 53.5 Cg_endo -69.77 -16.5 37.55 Favored 'Trans proline' 0 C--N 1.342 0.216 0 C-N-CA 122.685 2.257 . . . . 71.01 112.339 179.943 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -81.85 -19.85 40.16 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.222 -0.444 . . . . 71.34 110.908 179.999 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -58.65 -34.52 71.29 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.172 -0.467 . . . . 72.33 110.832 -179.9 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.352 0 C-N-CA 120.744 -0.741 . . . . 70.11 112.506 -179.946 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 1' ' ' TRP . . . . . . . . . . . . . 44.4 m0 . . . . . 0 C--O 1.231 0.13 0 CA-C-O 120.799 0.333 . . . . 70.22 110.926 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -55.1 160.55 3.1 Favored Pre-proline 0 C--N 1.329 -0.315 0 CA-C-O 121.59 0.709 . . . . 62.32 110.856 -179.919 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.71 95.48 0.55 Allowed 'Trans proline' 0 C--O 1.231 0.162 0 C-N-CA 122.729 2.286 . . . . 62.31 112.359 179.964 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 1.2 t80 -93.91 -32.6 13.83 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.245 -0.434 . . . . 75.42 110.927 -179.923 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -105.05 -32.7 8.59 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.117 -0.492 . . . . 74.34 110.871 179.999 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -51.88 -43.17 63.18 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.224 -0.443 . . . . 71.32 110.893 179.975 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 12.4 t -85.37 -27.84 25.58 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.196 -0.456 . . . . 72.33 111.137 -179.906 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 1.3 tt0 -68.73 -33.17 73.48 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.176 -0.465 . . . . 75.25 110.874 -179.966 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 2.5 t80 -70.26 -36.25 74.31 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.129 -0.487 . . . . 73.01 110.935 -179.841 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 23.4 m-85 -63.15 -28.18 69.88 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.121 -0.49 . . . . 74.44 110.873 -179.912 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 12.0 t0 -61.88 -47.42 85.08 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.128 -0.487 . . . . 75.33 110.906 179.917 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 21.9 t -76.25 -27.31 17.64 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-N 116.181 -0.463 . . . . 53.04 111.149 179.981 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 10.5 ttp -102.21 33.85 2.94 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.182 -0.463 . . . . 41.34 110.856 179.939 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 5.6 t -86.62 -3.98 59.11 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.23 -0.441 . . . . 71.2 111.145 -179.939 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . 0.68 ' C ' ' HG3' ' A' ' 19' ' ' PRO . 25.3 t -93.01 3.47 8.17 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.201 -0.454 . . . . 41.41 111.143 179.912 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . 0.464 ' O ' HG22 ' A' ' 16' ' ' ILE . 2.8 mp -142.39 3.68 0.41 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.139 -0.482 . . . . 73.13 111.127 179.913 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . 0.798 ' C ' ' HD2' ' A' ' 19' ' ' PRO . 0.5 OUTLIER -99.9 -68.78 0.04 OUTLIER Pre-proline 0 C--N 1.329 -0.287 0 CA-C-O 121.678 0.751 . . . . 61.21 110.831 -179.906 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . 0.926 ' N ' ' HD2' ' A' ' 19' ' ' PRO . 54.0 Cg_endo -69.78 -27.88 25.86 Favored 'Trans proline' 0 C--O 1.232 0.182 0 C-N-CA 122.664 2.243 . . . . 41.33 112.361 179.982 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 19' ' ' PRO . . . . . 0.926 ' HD2' ' N ' ' A' ' 18' ' ' PRO . 53.6 Cg_endo -69.82 -16.38 37.3 Favored 'Trans proline' 0 C--N 1.341 0.155 0 C-N-CA 122.713 2.275 . . . . 72.13 112.322 179.964 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -82.01 -19.85 39.63 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.248 -0.433 . . . . 75.32 110.868 -179.977 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -58.66 -34.36 71.14 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.12 -0.491 . . . . 74.44 110.832 -179.88 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.45 -0.367 0 C-N-CA 120.696 -0.764 . . . . 45.24 112.529 -179.97 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 1' ' ' TRP . . . . . . . . . . . . . 54.4 m0 . . . . . 0 C--O 1.231 0.122 0 CA-C-O 120.73 0.3 . . . . 74.23 110.959 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -87.45 160.55 47.81 Favored Pre-proline 0 C--N 1.329 -0.307 0 CA-C-O 121.655 0.741 . . . . 73.34 110.856 -179.964 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.73 120.2 7.03 Favored 'Trans proline' 0 C--N 1.342 0.214 0 C-N-CA 122.677 2.251 . . . . 54.31 112.328 -179.985 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -101.98 -32.57 10.12 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.157 -0.474 . . . . 74.0 110.914 -179.909 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -104.98 -32.72 8.61 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.143 -0.48 . . . . 64.21 110.921 179.953 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -51.86 -43.16 63.12 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.182 -0.463 . . . . 70.43 110.925 179.946 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 12.5 t -85.39 -27.94 25.48 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.196 -0.456 . . . . 55.15 111.142 -179.921 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -68.5 -33.86 74.88 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.197 -0.456 . . . . 74.22 110.923 179.974 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 2.5 t80 -69.41 -36.37 76.65 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.144 -0.48 . . . . 74.51 110.968 -179.918 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 23.3 m-85 -63.27 -30.33 71.49 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.129 -0.487 . . . . 74.31 110.969 -179.952 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 4.7 t70 -56.47 -40.2 74.47 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.124 -0.489 . . . . 73.22 110.88 179.909 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 25.9 t -84.04 -27.9 7.25 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.186 -0.461 . . . . 74.15 111.127 179.996 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 10.5 ttp -102.22 33.93 2.92 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.146 -0.479 . . . . 75.14 110.878 179.959 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 5.7 t -86.7 -3.91 59.11 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.213 -0.449 . . . . 71.11 111.118 -179.897 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . 0.683 ' C ' ' HG3' ' A' ' 19' ' ' PRO . 25.1 t -93.06 3.48 8.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.233 -0.44 . . . . 71.15 111.171 179.884 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . 0.462 ' O ' HG22 ' A' ' 16' ' ' ILE . 2.8 mp -142.36 3.63 0.41 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.108 -0.497 . . . . 63.32 111.128 179.912 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . 0.79 ' C ' ' HD2' ' A' ' 19' ' ' PRO . 0.5 OUTLIER -99.89 -68.8 0.04 OUTLIER Pre-proline 0 C--N 1.329 -0.287 0 CA-C-O 121.631 0.729 . . . . 71.22 110.874 -179.914 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . 0.918 ' N ' ' HD2' ' A' ' 19' ' ' PRO . 53.9 Cg_endo -69.75 -27.88 25.99 Favored 'Trans proline' 0 C--N 1.341 0.175 0 C-N-CA 122.672 2.248 . . . . 73.51 112.387 179.952 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 19' ' ' PRO . . . . . 0.918 ' HD2' ' N ' ' A' ' 18' ' ' PRO . 53.4 Cg_endo -69.79 -16.43 37.44 Favored 'Trans proline' 0 C--N 1.342 0.203 0 C-N-CA 122.686 2.258 . . . . 43.13 112.323 179.97 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -81.95 -19.83 39.85 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.228 -0.442 . . . . 72.14 110.893 -179.991 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -58.65 -32.52 69.15 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.145 -0.479 . . . . 74.22 110.904 -179.919 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.312 0 C-N-CA 120.771 -0.728 . . . . 73.25 112.494 -179.94 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 1' ' ' TRP . . . . . . . . . . . . . 2.5 t90 . . . . . 0 C--O 1.231 0.121 0 CA-C-O 120.752 0.31 . . . . 74.13 110.948 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 2.0 mpp_? -113.75 73.85 2.3 Favored Pre-proline 0 C--N 1.329 -0.326 0 CA-C-O 121.611 0.72 . . . . 74.33 110.865 -179.924 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.74 -172.18 0.55 Allowed 'Trans proline' 0 C--N 1.341 0.184 0 C-N-CA 122.681 2.254 . . . . 70.01 112.344 179.99 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 4' ' ' TYR . . . . . 0.498 ' C ' HD23 ' A' ' 5' ' ' LEU . 9.9 m-85 66.16 121.23 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.173 -0.467 . . . . 74.11 110.946 -179.901 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . 0.498 HD23 ' C ' ' A' ' 4' ' ' TYR . 0.0 OUTLIER -152.69 -41.19 0.1 Allowed 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.141 -0.482 . . . . 75.03 110.923 179.975 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -49.84 -43.79 49.11 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.192 -0.458 . . . . 73.01 110.929 179.935 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 10.2 t -90.39 -30.81 17.16 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.222 -0.445 . . . . 74.13 111.152 -179.958 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 1.6 mm-40 -68.13 -20.53 64.91 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.251 -0.431 . . . . 71.33 110.875 -179.996 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 1.6 t80 -84.29 -38.21 20.72 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.153 -0.476 . . . . 65.5 110.89 -179.823 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 20.9 m-85 -56.82 -34.77 68.05 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.148 -0.478 . . . . 72.31 110.89 -179.879 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 41.0 m-20 -59.84 -47.93 83.74 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.122 -0.49 . . . . 61.11 110.843 179.958 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 39.7 t -77.05 -28.19 16.64 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 116.184 -0.462 . . . . 73.21 111.139 179.972 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 10.4 ttp -102.0 33.98 2.86 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.174 -0.466 . . . . 42.24 110.871 179.939 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 5.8 t -86.64 -3.87 59.09 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.258 -0.428 . . . . 53.44 111.108 -179.896 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . 0.683 ' C ' ' HG3' ' A' ' 19' ' ' PRO . 24.7 t -93.77 3.97 8.23 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.23 -0.441 . . . . 75.22 111.141 179.885 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . 0.463 HG22 ' O ' ' A' ' 16' ' ' ILE . 2.8 mp -142.52 3.49 0.4 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.183 -0.462 . . . . 73.13 111.099 179.922 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . 0.794 ' C ' ' HD2' ' A' ' 19' ' ' PRO . 0.5 OUTLIER -100.25 -68.42 0.04 OUTLIER Pre-proline 0 C--N 1.329 -0.305 0 CA-C-O 121.656 0.741 . . . . 64.01 110.85 -179.923 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . 0.929 ' N ' ' HD2' ' A' ' 19' ' ' PRO . 53.7 Cg_endo -69.76 -27.81 26.01 Favored 'Trans proline' 0 C--N 1.342 0.199 0 C-N-CA 122.612 2.208 . . . . 61.1 112.363 179.97 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 19' ' ' PRO . . . . . 0.929 ' HD2' ' N ' ' A' ' 18' ' ' PRO . 53.8 Cg_endo -69.74 -16.52 37.68 Favored 'Trans proline' 0 C--N 1.341 0.156 0 C-N-CA 122.699 2.266 . . . . 74.45 112.326 179.948 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 2.1 mt-10 -81.88 -19.94 39.86 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.216 -0.447 . . . . 52.41 110.907 -179.975 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -58.56 -33.13 69.59 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.145 -0.479 . . . . 73.2 110.858 -179.908 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.286 0 C-N-CA 120.725 -0.75 . . . . 15.15 112.489 -179.964 . . . . . . . . 0 0 . 1 . 021 nuclear nobuild full ' A' A ' 1' ' ' TRP . . . . . . . . . . . . . 54.5 m0 . . . . . 0 C--O 1.23 0.071 0 CA-C-O 120.736 0.303 . . . . 70.51 110.925 . . . . . . . . . 0 0 . 1 . 021 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 13.1 mmm180 -121.64 70.89 26.86 Favored Pre-proline 0 C--N 1.329 -0.298 0 CA-C-O 121.658 0.742 . . . . 73.22 110.865 -179.941 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_endo -69.74 172.03 13.37 Favored 'Trans proline' 0 C--N 1.342 0.196 0 C-N-CA 122.704 2.27 . . . . 72.44 112.393 179.969 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 4' ' ' TYR . . . . . 0.604 ' C ' HD23 ' A' ' 5' ' ' LEU . 13.0 p90 -166.74 123.27 1.23 Allowed 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.229 -0.441 . . . . 61.25 110.932 -179.883 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . 0.604 HD23 ' C ' ' A' ' 4' ' ' TYR . 0.0 OUTLIER -158.0 -40.84 0.06 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.112 -0.495 . . . . 60.44 110.897 179.967 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -50.37 -47.87 56.02 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.189 -0.459 . . . . 75.14 110.904 179.966 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 14.4 t -76.41 -23.37 54.02 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.189 -0.459 . . . . 73.24 111.176 -179.95 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 11.5 tt0 -79.97 -20.11 46.3 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.192 -0.458 . . . . 74.51 110.884 179.983 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 1.4 t80 -87.13 -30.43 21.08 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.161 -0.472 . . . . 75.04 110.929 -179.88 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 22.5 m-85 -65.35 -32.89 74.76 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.136 -0.484 . . . . 74.34 110.94 -179.941 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -57.94 -36.92 73.21 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.113 -0.494 . . . . 72.42 110.885 179.914 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 56.4 t -77.77 -33.02 18.37 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.146 -0.479 . . . . 73.34 111.146 -179.983 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 10.6 ttp -101.91 33.43 3.03 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.124 -0.489 . . . . 62.23 110.906 179.906 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 5.5 t -86.15 -4.04 59.08 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.178 -0.465 . . . . 52.02 111.099 -179.908 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . 0.666 ' C ' ' HG3' ' A' ' 19' ' ' PRO . 25.5 t -92.91 4.11 7.7 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.262 -0.426 . . . . 55.21 111.095 179.948 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . 0.449 HG22 ' O ' ' A' ' 16' ' ' ILE . 9.4 mt -143.28 3.37 0.35 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.196 -0.456 . . . . 65.12 111.172 179.913 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . 0.791 ' C ' ' HD2' ' A' ' 19' ' ' PRO . 0.5 OUTLIER -99.98 -68.78 0.04 OUTLIER Pre-proline 0 C--N 1.33 -0.274 0 CA-C-O 121.633 0.73 . . . . 74.33 110.825 -179.843 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . 0.925 ' N ' ' HD2' ' A' ' 19' ' ' PRO . 53.6 Cg_endo -69.79 -27.83 25.87 Favored 'Trans proline' 0 C--O 1.231 0.171 0 C-N-CA 122.72 2.28 . . . . 61.33 112.339 179.96 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 19' ' ' PRO . . . . . 0.925 ' HD2' ' N ' ' A' ' 18' ' ' PRO . 53.9 Cg_endo -69.75 -16.47 37.61 Favored 'Trans proline' 0 C--N 1.341 0.137 0 C-N-CA 122.697 2.265 . . . . 75.23 112.341 179.917 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -82.0 -19.39 40.6 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.249 -0.432 . . . . 73.44 110.866 -179.952 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -59.69 -25.7 64.98 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.168 -0.469 . . . . 74.31 110.866 -179.936 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.315 0 C-N-CA 120.718 -0.753 . . . . 53.24 112.502 -179.983 . . . . . . . . 0 0 . 1 . 022 nuclear nobuild full ' A' A ' 1' ' ' TRP . . . . . . . . . . . . . 37.1 m0 . . . . . 0 C--O 1.231 0.124 0 CA-C-O 120.772 0.32 . . . . 72.42 110.936 . . . . . . . . . 0 0 . 1 . 022 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 6.1 mtt85 54.31 73.3 0.92 Allowed Pre-proline 0 C--N 1.329 -0.283 0 CA-C-O 121.606 0.717 . . . . 71.14 110.919 -179.924 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_endo -69.74 -172.59 0.59 Allowed 'Trans proline' 0 C--N 1.341 0.167 0 C-N-CA 122.712 2.274 . . . . 44.34 112.322 -179.948 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 4' ' ' TYR . . . . . 0.495 ' C ' HD23 ' A' ' 5' ' ' LEU . 84.7 m-85 -151.78 119.77 6.23 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.207 -0.451 . . . . 72.13 110.939 -179.917 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . 0.495 HD23 ' C ' ' A' ' 4' ' ' TYR . 0.0 OUTLIER -151.53 -40.88 0.12 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.155 -0.475 . . . . 71.31 110.932 179.964 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -49.52 -43.91 45.98 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.174 -0.466 . . . . 71.1 110.954 179.895 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . 0.477 HG23 ' OE1' ' A' ' 8' ' ' GLU . 9.9 t -90.49 -31.0 16.96 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.19 -0.459 . . . . 71.21 111.178 -179.984 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . 0.477 ' OE1' HG23 ' A' ' 7' ' ' THR . 0.4 OUTLIER -68.08 -19.55 64.87 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.22 -0.445 . . . . 64.12 110.888 179.977 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 1.7 t80 -85.46 -38.21 18.88 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.148 -0.478 . . . . 73.11 110.899 -179.843 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 20.8 m-85 -56.65 -30.82 63.76 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.138 -0.483 . . . . 61.13 110.927 -179.925 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 37.4 m-20 -63.58 -46.15 87.17 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.163 -0.472 . . . . 73.41 110.854 179.913 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 37.7 t -79.61 -26.92 12.59 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-N 116.193 -0.458 . . . . 60.32 111.145 179.999 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 10.4 ttp -102.11 33.91 2.9 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.186 -0.461 . . . . 70.13 110.868 179.944 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 5.6 t -86.65 -3.94 59.11 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.224 -0.443 . . . . 71.25 111.156 -179.922 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . 0.678 ' C ' ' HG3' ' A' ' 19' ' ' PRO . 25.2 t -93.01 3.45 8.18 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-N 116.206 -0.452 . . . . 72.41 111.147 179.912 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . 0.464 HG22 ' O ' ' A' ' 16' ' ' ILE . 2.8 mp -142.35 3.61 0.41 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.161 -0.472 . . . . 73.31 111.159 179.964 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . 0.781 ' C ' ' HD2' ' A' ' 19' ' ' PRO . 0.5 OUTLIER -99.92 -68.74 0.04 OUTLIER Pre-proline 0 C--N 1.329 -0.302 0 CA-C-O 121.673 0.749 . . . . 52.11 110.885 -179.882 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . 0.929 ' N ' ' HD2' ' A' ' 19' ' ' PRO . 53.4 Cg_endo -69.85 -27.88 25.51 Favored 'Trans proline' 0 C--O 1.232 0.188 0 C-N-CA 122.681 2.254 . . . . 73.31 112.345 179.965 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 19' ' ' PRO . . . . . 0.929 ' HD2' ' N ' ' A' ' 18' ' ' PRO . 54.1 Cg_endo -69.68 -16.47 37.91 Favored 'Trans proline' 0 C--N 1.341 0.169 0 C-N-CA 122.693 2.262 . . . . 74.53 112.377 179.871 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -82.03 -19.45 40.36 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.215 -0.448 . . . . 50.01 110.907 -179.957 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -59.63 -25.74 64.92 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.182 -0.463 . . . . 72.23 110.892 -179.988 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.307 0 C-N-CA 120.75 -0.738 . . . . 65.42 112.486 -179.932 . . . . . . . . 0 0 . 1 . 023 nuclear nobuild full ' A' A ' 1' ' ' TRP . . . . . . . . . . . . . 2.2 t90 . . . . . 0 C--O 1.231 0.118 0 CA-C-O 120.775 0.321 . . . . 74.23 110.945 . . . . . . . . . 0 0 . 1 . 023 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 12.4 tpt180 53.22 73.6 0.91 Allowed Pre-proline 0 C--N 1.329 -0.291 0 CA-C-O 121.558 0.694 . . . . 74.2 110.866 -179.925 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.82 -17.01 37.54 Favored 'Trans proline' 0 C--N 1.341 0.158 0 C-N-CA 122.654 2.236 . . . . 71.14 112.356 179.983 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 4' ' ' TYR . . . . . 0.419 ' C ' HD23 ' A' ' 5' ' ' LEU . 20.7 m-85 66.52 125.52 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.217 -0.447 . . . . 61.21 110.94 -179.953 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . 0.419 HD23 ' C ' ' A' ' 4' ' ' TYR . 0.0 OUTLIER -151.37 -41.98 0.12 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.118 -0.492 . . . . 72.41 110.908 179.972 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 4.0 tt0 -51.27 -48.06 62.32 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.182 -0.463 . . . . 75.23 110.907 179.912 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 14.4 t -76.94 -23.98 52.4 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.202 -0.453 . . . . 74.12 111.089 -179.881 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 14.4 tt0 -79.15 -19.92 49.81 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.255 -0.43 . . . . 72.51 110.9 179.989 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 1.2 t80 -87.27 -31.09 20.42 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.181 -0.463 . . . . 72.51 110.92 -179.844 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 22.7 m-85 -64.61 -29.33 70.35 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.141 -0.481 . . . . 72.51 110.899 -179.904 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 16.1 m-20 -61.12 -38.49 86.54 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.091 -0.504 . . . . 61.44 110.889 179.901 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 41.9 t -77.08 -31.39 18.48 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.181 -0.463 . . . . 75.21 111.141 179.986 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 10.5 ttp -101.95 33.39 3.06 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.185 -0.461 . . . . 72.43 110.91 179.873 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 5.5 t -86.17 -4.02 59.08 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.214 -0.448 . . . . 65.2 111.139 -179.925 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . 0.665 ' C ' ' HG3' ' A' ' 19' ' ' PRO . 25.4 t -92.85 4.15 7.63 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.208 -0.451 . . . . 71.31 111.167 179.87 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . 0.456 HG22 ' O ' ' A' ' 16' ' ' ILE . 9.4 mt -143.33 3.32 0.35 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.18 -0.463 . . . . 71.22 111.121 179.927 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . 0.8 ' C ' ' HD2' ' A' ' 19' ' ' PRO . 0.5 OUTLIER -99.89 -68.72 0.04 OUTLIER Pre-proline 0 C--N 1.329 -0.31 0 CA-C-O 121.624 0.726 . . . . 62.53 110.882 -179.943 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . 0.93 ' N ' ' HD2' ' A' ' 19' ' ' PRO . 53.2 Cg_endo -69.8 -27.86 25.76 Favored 'Trans proline' 0 C--O 1.232 0.178 0 C-N-CA 122.681 2.254 . . . . 75.15 112.32 -179.996 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 19' ' ' PRO . . . . . 0.93 ' HD2' ' N ' ' A' ' 18' ' ' PRO . 54.1 Cg_endo -69.73 -16.49 37.71 Favored 'Trans proline' 0 C--N 1.342 0.203 0 C-N-CA 122.732 2.288 . . . . 40.33 112.346 179.964 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -81.87 -19.92 39.94 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.195 -0.457 . . . . 55.32 110.902 -179.97 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -58.52 -33.37 69.77 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.129 -0.487 . . . . 63.43 110.871 -179.913 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.337 0 C-N-CA 120.782 -0.723 . . . . 72.22 112.49 -179.943 . . . . . . . . 0 0 . 1 . 024 nuclear nobuild full ' A' A ' 1' ' ' TRP . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.231 0.124 0 CA-C-O 120.734 0.302 . . . . 75.31 110.93 . . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . 0.791 ' HB2' HD21 ' A' ' 5' ' ' LEU . 0.0 OUTLIER -159.22 68.04 3.17 Favored Pre-proline 0 C--N 1.328 -0.349 0 CA-C-O 121.652 0.739 . . . . 65.21 110.926 -179.967 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.8 -32.7 17.88 Favored 'Trans proline' 0 C--N 1.342 0.196 0 C-N-CA 122.706 2.271 . . . . 64.41 112.353 -179.972 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 4' ' ' TYR . . . . . 0.622 ' C ' HD23 ' A' ' 5' ' ' LEU . 15.3 p90 -162.64 124.1 2.58 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.183 -0.462 . . . . 73.25 110.941 -179.93 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . 0.791 HD21 ' HB2' ' A' ' 2' ' ' ARG . 0.0 OUTLIER -157.2 -40.66 0.07 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.102 -0.499 . . . . 70.44 110.893 179.969 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -50.21 -43.01 52.47 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.162 -0.472 . . . . 71.12 110.957 179.911 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 9.8 t -91.36 -30.57 16.47 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.19 -0.459 . . . . 71.24 111.116 -179.89 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 4.4 mm-40 -68.47 -21.2 64.64 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.208 -0.451 . . . . 71.32 110.921 179.981 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 1.6 t80 -83.22 -38.48 22.2 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.146 -0.479 . . . . 75.12 110.909 -179.869 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 20.4 m-85 -56.09 -30.72 62.44 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.168 -0.469 . . . . 71.02 110.955 -179.952 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -65.07 -40.16 94.28 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.146 -0.479 . . . . 73.4 110.864 179.904 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 38.4 t -82.47 -28.24 8.8 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.24 -0.436 . . . . 63.33 111.163 179.99 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 10.4 ttp -102.0 33.84 2.9 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.18 -0.464 . . . . 74.34 110.861 179.902 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 5.8 t -86.52 -3.89 59.09 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.225 -0.443 . . . . 73.12 111.211 -179.986 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . 0.675 ' C ' ' HG3' ' A' ' 19' ' ' PRO . 24.1 t -93.85 4.04 8.24 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.183 -0.462 . . . . 70.12 111.1 179.933 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . 0.46 HG22 ' O ' ' A' ' 16' ' ' ILE . 2.8 mp -142.52 3.43 0.4 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-N 116.168 -0.469 . . . . 75.22 111.153 179.94 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . 0.791 ' C ' ' HD2' ' A' ' 19' ' ' PRO . 0.5 OUTLIER -100.19 -68.42 0.04 OUTLIER Pre-proline 0 C--N 1.329 -0.307 0 CA-C-O 121.615 0.721 . . . . 53.4 110.85 -179.951 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . 0.919 ' N ' ' HD2' ' A' ' 19' ' ' PRO . 53.9 Cg_endo -69.77 -27.81 25.97 Favored 'Trans proline' 0 C--O 1.232 0.19 0 C-N-CA 122.624 2.216 . . . . 45.0 112.352 179.975 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 19' ' ' PRO . . . . . 0.919 ' HD2' ' N ' ' A' ' 18' ' ' PRO . 53.8 Cg_endo -69.77 -16.49 37.54 Favored 'Trans proline' 0 C--N 1.341 0.166 0 C-N-CA 122.714 2.276 . . . . 71.31 112.334 179.975 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -81.88 -19.9 39.97 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.203 -0.453 . . . . 70.43 110.889 -179.987 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -58.67 -34.71 71.54 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.168 -0.469 . . . . 74.05 110.855 -179.875 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.302 0 C-N-CA 120.696 -0.764 . . . . 62.42 112.485 179.984 . . . . . . . . 0 0 . 1 . 025 nuclear nobuild full ' A' A ' 1' ' ' TRP . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.231 0.113 0 CA-C-O 120.744 0.307 . . . . 63.34 110.944 . . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -53.58 160.56 1.9 Allowed Pre-proline 0 C--N 1.328 -0.337 0 CA-C-O 121.612 0.72 . . . . 75.32 110.877 -179.942 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.74 106.71 1.71 Allowed 'Trans proline' 0 C--N 1.341 0.163 0 C-N-CA 122.676 2.251 . . . . 61.43 112.332 -179.983 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -179.45 -34.76 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.227 -0.442 . . . . 75.25 110.943 -179.884 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -103.56 -33.53 8.98 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.111 -0.495 . . . . 70.42 110.89 179.958 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -51.83 -43.43 63.16 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.208 -0.451 . . . . 73.14 110.893 179.941 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 13.5 t -84.51 -27.4 27.43 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.253 -0.43 . . . . 63.32 111.119 -179.916 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -69.27 -33.89 73.91 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.191 -0.459 . . . . 62.23 110.916 -179.978 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 2.4 t80 -69.56 -35.84 75.78 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.138 -0.483 . . . . 65.41 110.946 -179.887 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 23.1 m-85 -63.72 -30.71 71.78 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.142 -0.481 . . . . 71.51 110.899 -179.926 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -67.04 -35.07 79.06 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.097 -0.501 . . . . 64.12 110.86 179.948 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 36.1 t -85.78 -29.56 6.27 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.2 -0.455 . . . . 72.33 111.128 179.985 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 10.5 ttp -102.46 33.89 2.98 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.187 -0.461 . . . . 64.11 110.862 179.916 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 5.6 t -86.68 -3.97 59.11 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.262 -0.426 . . . . 73.34 111.145 -179.925 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . 0.685 ' C ' ' HG3' ' A' ' 19' ' ' PRO . 25.1 t -93.03 3.47 8.18 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-N 116.221 -0.445 . . . . 75.31 111.122 179.895 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . 0.463 ' O ' HG22 ' A' ' 16' ' ' ILE . 2.8 mp -142.36 3.72 0.41 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.184 -0.462 . . . . 72.32 111.132 179.865 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . 0.801 ' C ' ' HD2' ' A' ' 19' ' ' PRO . 0.5 OUTLIER -99.93 -68.82 0.04 OUTLIER Pre-proline 0 C--N 1.329 -0.294 0 CA-C-O 121.697 0.761 . . . . 73.45 110.83 -179.897 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . 0.924 ' N ' ' HD2' ' A' ' 19' ' ' PRO . 54.2 Cg_endo -69.7 -27.94 26.14 Favored 'Trans proline' 0 C--O 1.232 0.181 0 C-N-CA 122.7 2.267 . . . . 73.14 112.358 179.954 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 19' ' ' PRO . . . . . 0.924 ' HD2' ' N ' ' A' ' 18' ' ' PRO . 53.5 Cg_endo -69.77 -16.43 37.51 Favored 'Trans proline' 0 C--N 1.342 0.213 0 C-N-CA 122.664 2.243 . . . . 73.21 112.38 179.961 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -81.93 -19.86 39.87 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.171 -0.468 . . . . 74.13 110.911 179.977 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -58.6 -33.16 69.68 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.131 -0.486 . . . . 74.34 110.876 -179.92 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.279 0 C-N-CA 120.74 -0.743 . . . . 72.12 112.46 -179.947 . . . . . . . . 0 0 . 1 . 026 nuclear nobuild full ' A' A ' 1' ' ' TRP . . . . . . . . . . . . . 37.9 m0 . . . . . 0 C--O 1.231 0.131 0 CA-C-O 120.712 0.292 . . . . 72.12 110.931 . . . . . . . . . 0 0 . 1 . 026 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 1.2 mmt-85 52.71 70.04 2.06 Favored Pre-proline 0 C--N 1.328 -0.334 0 CA-C-O 121.615 0.721 . . . . 70.32 110.858 -179.977 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_endo -69.82 89.25 0.53 Allowed 'Trans proline' 0 C--O 1.232 0.189 0 C-N-CA 122.656 2.237 . . . . 74.55 112.32 -179.935 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 4' ' ' TYR . . . . . 0.482 ' C ' HD23 ' A' ' 5' ' ' LEU . 84.5 m-85 -151.8 119.78 6.23 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.236 -0.438 . . . . 75.34 110.916 -179.911 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . 0.482 HD23 ' C ' ' A' ' 4' ' ' TYR . 0.0 OUTLIER -151.24 -40.83 0.12 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.118 -0.492 . . . . 71.43 110.882 179.926 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 33.0 tp60 -49.53 -43.9 46.06 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.234 -0.439 . . . . 74.41 110.925 179.949 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 9.9 t -90.56 -31.02 16.88 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.167 -0.469 . . . . 70.51 111.104 -179.905 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -68.03 -19.65 64.92 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.264 -0.425 . . . . 75.2 110.896 179.998 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 1.7 t80 -85.43 -38.22 18.91 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.149 -0.478 . . . . 64.41 110.911 -179.821 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 20.8 m-85 -56.49 -31.47 64.09 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.167 -0.47 . . . . 73.11 110.878 -179.935 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -56.61 -31.69 64.55 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.114 -0.494 . . . . 64.51 110.899 179.976 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 61.5 t -90.88 -28.54 4.85 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.158 -0.474 . . . . 73.4 111.115 -179.985 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 10.6 ttp -102.06 33.4 3.07 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.152 -0.476 . . . . 72.44 110.862 179.932 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 5.6 t -86.17 -3.99 59.08 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.23 -0.441 . . . . 71.42 111.148 -179.937 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . 0.666 ' C ' ' HG3' ' A' ' 19' ' ' PRO . 25.3 t -92.89 4.12 7.68 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-N 116.221 -0.445 . . . . 63.42 111.158 179.853 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . 0.454 HG22 ' O ' ' A' ' 16' ' ' ILE . 9.6 mt -143.29 3.34 0.35 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.206 -0.452 . . . . 74.11 111.153 179.898 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . 0.79 ' C ' ' HD2' ' A' ' 19' ' ' PRO . 0.5 OUTLIER -99.82 -68.77 0.04 OUTLIER Pre-proline 0 C--N 1.33 -0.277 0 CA-C-O 121.694 0.759 . . . . 72.3 110.849 -179.929 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . 0.909 ' N ' ' HD2' ' A' ' 19' ' ' PRO . 53.7 Cg_endo -69.77 -27.93 25.82 Favored 'Trans proline' 0 C--N 1.342 0.185 0 C-N-CA 122.66 2.24 . . . . 55.44 112.337 -179.992 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 19' ' ' PRO . . . . . 0.909 ' HD2' ' N ' ' A' ' 18' ' ' PRO . 54.1 Cg_endo -69.75 -16.8 37.77 Favored 'Trans proline' 0 C--N 1.341 0.184 0 C-N-CA 122.643 2.229 . . . . 74.52 112.354 179.937 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 21.3 tt0 -82.5 -21.29 35.53 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.222 -0.445 . . . . 72.5 110.903 179.981 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -58.27 -33.21 69.17 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.201 -0.454 . . . . 74.55 110.854 -179.913 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.317 0 C-N-CA 120.693 -0.765 . . . . 72.22 112.527 -179.953 . . . . . . . . 0 0 . 1 . 027 nuclear nobuild full ' A' A ' 1' ' ' TRP . . . . . . . . . . . . . 45.8 m0 . . . . . 0 C--O 1.231 0.09 0 CA-C-O 120.742 0.306 . . . . 71.45 110.915 . . . . . . . . . 0 0 . 1 . 027 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 3.0 mmt85 -119.13 73.35 13.25 Favored Pre-proline 0 C--N 1.329 -0.321 0 CA-C-O 121.583 0.706 . . . . 75.32 110.909 -179.955 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.75 114.27 3.65 Favored 'Trans proline' 0 C--N 1.342 0.216 0 C-N-CA 122.665 2.244 . . . . 54.32 112.346 -179.97 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 38.2 m-85 -135.92 -70.37 0.48 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.218 -0.446 . . . . 72.43 110.862 -179.881 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . 0.528 ' O ' HD12 ' A' ' 5' ' ' LEU . 0.4 OUTLIER -77.2 -16.65 58.99 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.129 -0.487 . . . . 71.32 110.898 -179.977 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 3.0 pp0? -56.17 -48.8 75.61 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.188 -0.46 . . . . 63.33 110.917 179.924 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 3.5 t -65.31 -31.22 72.25 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.244 -0.435 . . . . 42.02 111.131 -179.923 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 2.0 tt0 -52.94 -41.26 64.32 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.216 -0.447 . . . . 44.45 110.854 -179.962 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -69.37 -42.13 75.61 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.181 -0.463 . . . . 75.14 110.891 -179.814 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 15.4 m-85 -68.56 -25.27 64.82 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.181 -0.463 . . . . 52.21 110.88 -179.878 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -60.64 -32.2 71.37 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.126 -0.488 . . . . 71.21 110.875 179.895 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 58.8 t -90.28 -27.65 5.07 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.19 -0.459 . . . . 75.32 111.139 -179.984 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 9.4 ttp -102.26 32.83 3.34 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.162 -0.472 . . . . 64.43 110.851 179.927 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 5.9 t -86.82 -3.74 59.1 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.212 -0.449 . . . . 64.32 111.149 -179.974 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . 0.683 ' C ' ' HG3' ' A' ' 19' ' ' PRO . 23.0 t -94.26 4.65 8.09 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.228 -0.442 . . . . 63.33 111.12 179.867 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . 0.452 HG22 ' O ' ' A' ' 16' ' ' ILE . 2.8 mp -142.54 3.36 0.4 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.326 0 CA-C-N 116.173 -0.467 . . . . 74.24 111.122 179.894 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . 0.799 ' C ' ' HD2' ' A' ' 19' ' ' PRO . 0.5 OUTLIER -100.32 -68.38 0.04 OUTLIER Pre-proline 0 C--N 1.329 -0.323 0 CA-C-O 121.739 0.78 . . . . 73.22 110.836 -179.911 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . 0.916 ' N ' ' HD2' ' A' ' 19' ' ' PRO . 54.2 Cg_endo -69.69 -27.87 26.29 Favored 'Trans proline' 0 C--N 1.342 0.214 0 C-N-CA 122.686 2.258 . . . . 62.35 112.349 179.989 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 19' ' ' PRO . . . . . 0.916 ' HD2' ' N ' ' A' ' 18' ' ' PRO . 53.7 Cg_endo -69.79 -16.47 37.46 Favored 'Trans proline' 0 C--N 1.342 0.192 0 C-N-CA 122.637 2.225 . . . . 71.31 112.341 179.989 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -81.87 -19.88 40.01 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.22 -0.446 . . . . 75.54 110.903 -179.994 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -58.66 -34.05 70.79 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.185 -0.461 . . . . 74.52 110.868 -179.947 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.303 0 C-N-CA 120.724 -0.751 . . . . 74.23 112.503 -179.977 . . . . . . . . 0 0 . 1 . 028 nuclear nobuild full ' A' A ' 1' ' ' TRP . . . . . . . . . . . . . 52.5 m0 . . . . . 0 C--O 1.232 0.132 0 CA-C-O 120.777 0.322 . . . . 74.52 110.908 . . . . . . . . . 0 0 . 1 . 028 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . 0.55 ' HB3' HD21 ' A' ' 5' ' ' LEU . 0.9 OUTLIER -119.86 70.52 14.21 Favored Pre-proline 0 C--N 1.329 -0.29 0 CA-C-O 121.628 0.728 . . . . 74.32 110.862 -179.944 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.76 -48.46 0.71 Allowed 'Trans proline' 0 C--N 1.342 0.186 0 C-N-CA 122.688 2.259 . . . . 75.2 112.331 -179.995 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 4' ' ' TYR . . . . . 0.438 ' C ' HD23 ' A' ' 5' ' ' LEU . 34.3 m-85 -154.76 121.76 5.54 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.203 -0.453 . . . . 65.41 110.954 -179.913 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . 0.55 HD21 ' HB3' ' A' ' 2' ' ' ARG . 0.0 OUTLIER -148.81 -40.94 0.15 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.143 -0.48 . . . . 75.31 110.947 179.987 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 37.7 tt0 -49.76 -43.54 48.09 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.153 -0.476 . . . . 75.1 110.913 179.93 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 10.2 t -90.88 -30.97 16.62 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.185 -0.461 . . . . 62.24 111.102 -179.899 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 3.2 mt-10 -68.05 -20.35 64.96 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.24 -0.436 . . . . 72.4 110.906 -179.991 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 1.6 t80 -84.42 -38.47 20.17 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.119 -0.491 . . . . 75.24 110.87 -179.831 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 20.6 m-85 -56.24 -38.63 71.36 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.141 -0.481 . . . . 72.03 110.954 -179.9 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 71.9 m-20 -56.52 -35.76 68.44 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.113 -0.494 . . . . 64.1 110.869 179.916 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 23.7 t -89.15 -27.49 5.3 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.169 -0.469 . . . . 70.04 111.16 179.949 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 10.6 ttp -101.86 33.4 3.03 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.154 -0.475 . . . . 44.21 110.851 179.968 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 5.5 t -86.18 -4.0 59.08 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.217 -0.447 . . . . 72.21 111.106 -179.923 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . 0.668 ' C ' ' HG3' ' A' ' 19' ' ' PRO . 25.3 t -92.93 4.15 7.68 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.24 -0.436 . . . . 72.54 111.132 179.911 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . 0.455 HG22 ' O ' ' A' ' 16' ' ' ILE . 9.4 mt -143.32 3.39 0.35 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.215 -0.448 . . . . 75.31 111.141 179.888 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . 0.799 ' C ' ' HD2' ' A' ' 19' ' ' PRO . 0.5 OUTLIER -99.86 -68.8 0.04 OUTLIER Pre-proline 0 C--N 1.329 -0.301 0 CA-C-O 121.686 0.755 . . . . 65.22 110.863 -179.941 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . 0.913 ' N ' ' HD2' ' A' ' 19' ' ' PRO . 54.2 Cg_endo -69.73 -27.89 26.05 Favored 'Trans proline' 0 C--N 1.342 0.203 0 C-N-CA 122.702 2.268 . . . . 73.3 112.361 179.953 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 19' ' ' PRO . . . . . 0.913 ' HD2' ' N ' ' A' ' 18' ' ' PRO . 53.7 Cg_endo -69.8 -16.75 37.52 Favored 'Trans proline' 0 C--N 1.341 0.171 0 C-N-CA 122.64 2.227 . . . . 54.03 112.312 179.956 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 15.1 tp10 -82.51 -21.35 35.49 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.264 -0.425 . . . . 70.22 110.883 -179.986 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -58.14 -34.48 70.31 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.139 -0.482 . . . . 62.43 110.876 -179.903 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.348 0 C-N-CA 120.722 -0.751 . . . . 73.43 112.529 -179.932 . . . . . . . . 0 0 . 1 . 029 nuclear nobuild full ' A' A ' 1' ' ' TRP . . . . . . . . . . . . . 48.8 m0 . . . . . 0 C--O 1.23 0.059 0 CA-C-O 120.774 0.321 . . . . 75.31 110.914 . . . . . . . . . 0 0 . 1 . 029 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER 55.47 70.51 1.54 Allowed Pre-proline 0 C--N 1.33 -0.275 0 CA-C-O 121.61 0.719 . . . . 73.41 110.897 -179.951 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_endo -69.83 106.97 1.77 Allowed 'Trans proline' 0 C--N 1.341 0.176 0 C-N-CA 122.63 2.22 . . . . 74.05 112.35 -179.96 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -92.39 -32.42 14.95 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.207 -0.451 . . . . 72.25 110.892 -179.886 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -105.09 -32.6 8.62 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.173 -0.467 . . . . 74.34 110.94 179.98 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -51.87 -43.18 63.16 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.16 -0.473 . . . . 72.31 110.934 179.915 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 12.3 t -85.42 -27.86 25.48 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.211 -0.45 . . . . 70.02 111.122 -179.922 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 2.5 mt-10 -68.83 -32.52 72.28 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.197 -0.456 . . . . 71.53 110.885 -179.979 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 2.5 t80 -71.05 -36.11 72.19 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.165 -0.47 . . . . 73.12 110.948 -179.861 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 23.4 m-85 -63.15 -28.34 70.0 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.124 -0.489 . . . . 75.23 110.884 -179.939 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -56.78 -44.1 81.5 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.136 -0.484 . . . . 71.3 110.87 179.934 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 21.8 t -82.78 -29.08 8.41 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.203 -0.453 . . . . 75.3 111.131 179.997 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 10.4 ttp -101.29 33.82 2.77 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.141 -0.481 . . . . 71.14 110.907 179.927 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 5.6 t -86.67 -3.91 59.1 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.21 -0.45 . . . . 74.55 111.167 -179.897 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . 0.685 ' C ' ' HG3' ' A' ' 19' ' ' PRO . 25.0 t -93.07 3.49 8.19 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-N 116.149 -0.478 . . . . 54.35 111.114 179.932 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . 0.447 ' O ' HG22 ' A' ' 16' ' ' ILE . 2.8 mp -142.34 3.63 0.41 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.212 -0.449 . . . . 71.23 111.155 179.924 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . 0.786 ' C ' ' HD2' ' A' ' 19' ' ' PRO . 0.5 OUTLIER -99.89 -68.77 0.04 OUTLIER Pre-proline 0 C--N 1.329 -0.319 0 CA-C-O 121.674 0.75 . . . . 72.21 110.844 -179.879 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . 0.912 ' N ' ' HD2' ' A' ' 19' ' ' PRO . 53.5 Cg_endo -69.83 -27.9 25.58 Favored 'Trans proline' 0 C--N 1.342 0.191 0 C-N-CA 122.645 2.23 . . . . 55.45 112.325 -179.982 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 19' ' ' PRO . . . . . 0.912 ' HD2' ' N ' ' A' ' 18' ' ' PRO . 54.2 Cg_endo -69.74 -16.81 37.81 Favored 'Trans proline' 0 C--N 1.342 0.195 0 C-N-CA 122.72 2.28 . . . . 72.43 112.346 179.903 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 25.6 tt0 -82.59 -21.24 35.28 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.205 -0.452 . . . . 74.13 110.867 -179.94 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -58.1 -32.86 68.49 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.154 -0.476 . . . . 74.12 110.872 -179.913 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.303 0 C-N-CA 120.72 -0.752 . . . . 70.21 112.462 179.978 . . . . . . . . 0 0 . 1 . 030 nuclear nobuild full ' A' A ' 1' ' ' TRP . . . . . . . . . . . . . 36.2 m0 . . . . . 0 C--O 1.231 0.114 0 CA-C-O 120.777 0.322 . . . . 72.32 110.911 . . . . . . . . . 0 0 . 1 . 030 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . 0.541 ' HB3' HD22 ' A' ' 5' ' ' LEU . 25.5 mmt180 56.2 73.66 0.8 Allowed Pre-proline 0 C--N 1.329 -0.29 0 CA-C-O 121.624 0.726 . . . . 74.1 110.891 -179.952 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.77 -8.37 23.43 Favored 'Trans proline' 0 C--N 1.341 0.175 0 C-N-CA 122.663 2.242 . . . . 70.32 112.32 -179.962 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 12.7 m-85 -158.27 125.29 4.93 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.21 -0.45 . . . . 70.55 110.925 -179.884 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . 0.541 HD22 ' HB3' ' A' ' 2' ' ' ARG . 0.0 OUTLIER -143.8 -41.08 0.28 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.095 -0.502 . . . . 75.3 110.929 179.953 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -50.31 -42.53 52.76 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.203 -0.453 . . . . 74.53 110.943 179.884 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 8.9 t -91.97 -30.6 16.0 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.188 -0.46 . . . . 71.34 111.1 -179.92 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -68.46 -21.94 64.6 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.239 -0.437 . . . . 62.34 110.92 -179.995 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 1.6 t80 -82.11 -39.21 23.67 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.106 -0.497 . . . . 74.33 110.939 -179.858 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 20.0 m-85 -55.17 -32.55 62.24 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.082 -0.508 . . . . 64.12 110.926 -179.959 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -53.13 -36.6 60.97 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.145 -0.48 . . . . 51.01 110.892 179.91 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 57.7 t -82.4 -30.84 9.54 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.18 -0.464 . . . . 60.11 111.115 179.971 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 10.6 ttp -101.97 33.38 3.06 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.182 -0.463 . . . . 72.32 110.83 179.962 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 5.5 t -86.18 -4.0 59.08 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.261 -0.427 . . . . 64.33 111.139 -179.941 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . 0.678 ' C ' ' HG3' ' A' ' 19' ' ' PRO . 25.4 t -92.95 4.18 7.67 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.22 -0.446 . . . . 73.44 111.134 179.904 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . 0.459 HG22 ' O ' ' A' ' 16' ' ' ILE . 9.5 mt -143.3 3.31 0.35 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.186 -0.461 . . . . 72.01 111.164 179.926 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . 0.809 ' C ' ' HD2' ' A' ' 19' ' ' PRO . 0.5 OUTLIER -99.9 -68.73 0.04 OUTLIER Pre-proline 0 C--N 1.33 -0.278 0 CA-C-O 121.612 0.72 . . . . 61.45 110.866 -179.919 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . 0.913 ' N ' ' HD2' ' A' ' 19' ' ' PRO . 53.5 Cg_endo -69.75 -27.97 25.88 Favored 'Trans proline' 0 C--N 1.341 0.157 0 C-N-CA 122.721 2.281 . . . . 44.24 112.32 179.988 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 19' ' ' PRO . . . . . 0.913 ' HD2' ' N ' ' A' ' 18' ' ' PRO . 53.8 Cg_endo -69.72 -16.75 37.87 Favored 'Trans proline' 0 C--N 1.342 0.201 0 C-N-CA 122.684 2.256 . . . . 64.43 112.389 179.935 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 57.6 tt0 -82.53 -21.34 35.43 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.197 -0.456 . . . . 72.54 110.936 179.988 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -58.17 -34.42 70.29 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.103 -0.499 . . . . 73.32 110.926 -179.934 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.342 0 C-N-CA 120.727 -0.749 . . . . 73.2 112.478 179.988 . . . . . . . . 0 0 . 1 . 031 nuclear nobuild full ' A' A ' 1' ' ' TRP . . . . . . . . . . . . . 54.9 m0 . . . . . 0 C--O 1.231 0.113 0 CA-C-O 120.747 0.308 . . . . 71.54 110.901 . . . . . . . . . 0 0 . 1 . 031 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 6.7 ptt180 -140.15 157.59 68.69 Favored Pre-proline 0 C--N 1.329 -0.299 0 CA-C-O 121.598 0.713 . . . . 72.34 110.856 -179.977 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.72 -171.82 0.51 Allowed 'Trans proline' 0 C--N 1.341 0.171 0 C-N-CA 122.693 2.262 . . . . 73.15 112.3 -179.963 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 35.2 m-85 -120.48 8.19 10.72 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.195 -0.457 . . . . 72.54 110.903 -179.889 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -101.45 -7.88 22.48 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.144 -0.48 . . . . 33.24 110.929 179.961 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -50.44 -42.4 54.01 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.204 -0.453 . . . . 74.33 110.88 179.944 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 7.9 t -77.92 -29.4 50.01 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.235 -0.439 . . . . 75.35 111.143 -179.913 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -61.2 -38.67 87.38 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.223 -0.444 . . . . 75.32 110.875 -180.0 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 1.1 t80 -66.88 -37.85 85.19 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.179 -0.464 . . . . 70.31 110.91 -179.87 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 18.1 m-85 -71.13 -28.67 64.46 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.129 -0.487 . . . . 63.51 110.917 -179.907 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -67.02 -45.55 77.16 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.13 -0.487 . . . . 64.3 110.844 179.937 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 60.6 t -81.72 -25.7 9.77 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.211 -0.449 . . . . 65.51 111.118 -179.958 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 10.6 ttp -101.97 33.38 3.06 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.182 -0.463 . . . . 72.33 110.876 179.929 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 5.5 t -86.11 -4.03 59.08 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.215 -0.448 . . . . 73.42 111.137 -179.921 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . 0.675 ' C ' ' HG3' ' A' ' 19' ' ' PRO . 25.4 t -92.91 4.14 7.68 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.183 -0.462 . . . . 74.02 111.122 179.937 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . 0.456 ' O ' HG22 ' A' ' 16' ' ' ILE . 9.5 mt -143.28 3.34 0.35 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.178 -0.465 . . . . 72.13 111.169 179.911 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . 0.792 ' C ' ' HD2' ' A' ' 19' ' ' PRO . 0.5 OUTLIER -99.86 -68.81 0.04 OUTLIER Pre-proline 0 C--N 1.329 -0.297 0 CA-C-O 121.696 0.76 . . . . 63.43 110.895 -179.92 . . . . . . . . 3 3 . 1 . 031 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . 0.919 ' N ' ' HD2' ' A' ' 19' ' ' PRO . 54.0 Cg_endo -69.75 -27.88 25.99 Favored 'Trans proline' 0 C--N 1.342 0.213 0 C-N-CA 122.684 2.256 . . . . 75.1 112.329 179.971 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 19' ' ' PRO . . . . . 0.919 ' HD2' ' N ' ' A' ' 18' ' ' PRO . 53.9 Cg_endo -69.72 -16.49 37.73 Favored 'Trans proline' 0 C--N 1.341 0.153 0 C-N-CA 122.69 2.26 . . . . 73.02 112.315 179.966 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -81.92 -19.44 40.77 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.261 -0.427 . . . . 72.11 110.909 -179.966 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -59.7 -25.74 65.02 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.13 -0.486 . . . . 74.31 110.852 -179.902 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.325 0 C-N-CA 120.699 -0.762 . . . . 54.41 112.51 -179.993 . . . . . . . . 0 0 . 1 . 032 nuclear nobuild full ' A' A ' 1' ' ' TRP . . . . . . . . . . . . . 3.6 t90 . . . . . 0 C--O 1.231 0.112 0 CA-C-O 120.741 0.305 . . . . 64.34 110.947 . . . . . . . . . 0 0 . 1 . 032 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . 0.544 ' HB2' HD22 ' A' ' 5' ' ' LEU . 0.6 OUTLIER -57.18 160.65 6.24 Favored Pre-proline 0 C--N 1.329 -0.31 0 CA-C-O 121.571 0.7 . . . . 74.01 110.898 -179.975 . . . . . . . . 3 3 . 1 . 032 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.74 -19.44 36.23 Favored 'Trans proline' 0 C--O 1.231 0.164 0 C-N-CA 122.704 2.269 . . . . 75.51 112.346 179.977 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 17.0 m-85 -159.54 125.24 4.24 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.18 -0.464 . . . . 75.24 110.892 -179.885 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . 0.544 HD22 ' HB2' ' A' ' 2' ' ' ARG . 0.0 OUTLIER -146.55 -41.28 0.2 Allowed 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.112 -0.495 . . . . 73.22 110.927 179.937 . . . . . . . . 3 3 . 1 . 032 nuclear nobuild full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 6.3 tt0 -50.25 -42.76 52.55 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.226 -0.443 . . . . 44.53 110.938 179.898 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 8.8 t -91.61 -30.53 16.3 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.17 -0.468 . . . . 54.33 111.131 -179.941 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 3.8 mt-10 -68.51 -21.6 64.58 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.22 -0.445 . . . . 71.02 110.918 179.994 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 1.6 t80 -82.56 -38.84 23.14 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.146 -0.479 . . . . 64.13 110.926 -179.86 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 20.1 m-85 -55.83 -32.09 63.28 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.076 -0.511 . . . . 74.2 110.922 -179.89 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 14.9 t70 -65.74 -44.93 84.47 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.155 -0.475 . . . . 64.34 110.906 179.86 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 58.3 t -76.66 -29.34 18.11 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.178 -0.464 . . . . 75.02 111.109 179.982 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 10.4 ttp -102.49 33.9 2.98 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.181 -0.463 . . . . 72.23 110.895 179.954 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 5.6 t -86.65 -3.96 59.11 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.199 -0.455 . . . . 51.14 111.182 -179.973 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . 0.685 ' C ' ' HG3' ' A' ' 19' ' ' PRO . 24.9 t -93.0 3.49 8.15 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.203 -0.453 . . . . 72.3 111.129 179.879 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . 0.465 HG22 ' O ' ' A' ' 16' ' ' ILE . 2.8 mp -142.38 3.61 0.41 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.19 -0.459 . . . . 72.25 111.146 179.918 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . 0.797 ' C ' ' HD2' ' A' ' 19' ' ' PRO . 0.5 OUTLIER -99.85 -68.79 0.04 OUTLIER Pre-proline 0 C--N 1.329 -0.284 0 CA-C-O 121.674 0.75 . . . . 74.53 110.868 -179.94 . . . . . . . . 3 3 . 1 . 032 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . 0.924 ' N ' ' HD2' ' A' ' 19' ' ' PRO . 53.7 Cg_endo -69.73 -27.99 25.94 Favored 'Trans proline' 0 C--O 1.231 0.171 0 C-N-CA 122.718 2.278 . . . . 74.34 112.313 179.994 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 19' ' ' PRO . . . . . 0.924 ' HD2' ' N ' ' A' ' 18' ' ' PRO . 53.9 Cg_endo -69.74 -16.71 37.77 Favored 'Trans proline' 0 C--N 1.341 0.179 0 C-N-CA 122.669 2.246 . . . . 75.42 112.359 179.939 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 17.6 tp10 -82.61 -21.36 35.16 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.252 -0.431 . . . . 75.41 110.875 -179.978 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -58.14 -34.11 69.91 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.167 -0.469 . . . . 74.25 110.864 -179.894 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.291 0 C-N-CA 120.719 -0.753 . . . . 63.41 112.485 -179.993 . . . . . . . . 0 0 . 1 . 033 nuclear nobuild full ' A' A ' 1' ' ' TRP . . . . . . . . . . . . . 4.1 t90 . . . . . 0 C--O 1.231 0.101 0 CA-C-O 120.765 0.316 . . . . 54.34 110.915 . . . . . . . . . 0 0 . 1 . 033 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 5.4 mpt_? -84.97 160.67 54.83 Favored Pre-proline 0 C--N 1.329 -0.316 0 CA-C-O 121.635 0.731 . . . . 75.0 110.871 -179.948 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.71 156.3 63.85 Favored 'Trans proline' 0 C--O 1.231 0.165 0 C-N-CA 122.702 2.268 . . . . 64.41 112.358 -179.982 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 42.2 m-85 -132.25 -65.83 0.72 Allowed 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.246 -0.434 . . . . 71.24 110.963 -179.939 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . 0.444 ' O ' HD12 ' A' ' 5' ' ' LEU . 0.3 OUTLIER -79.27 -24.29 43.06 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.118 -0.492 . . . . 62.25 110.91 179.934 . . . . . . . . 3 3 . 1 . 033 nuclear nobuild full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 12.7 mt-30 -53.7 -54.45 37.83 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.209 -0.451 . . . . 71.24 110.917 179.942 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 9.8 t -60.94 -31.67 71.21 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.171 -0.468 . . . . 60.24 111.155 -179.927 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . 0.523 ' O ' HG23 ' A' ' 12' ' ' VAL . 1.1 mt-10 -59.18 -24.48 63.11 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.213 -0.449 . . . . 61.13 110.921 179.98 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 1.2 m-85 -94.93 -39.7 10.07 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.125 -0.489 . . . . 73.43 110.939 -179.86 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 23.3 m-85 -61.76 -49.34 76.77 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.103 -0.499 . . . . 62.22 110.894 -179.905 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 22.4 t0 -54.55 -32.49 58.44 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.19 -0.459 . . . . 71.1 110.85 179.93 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . 0.523 HG23 ' O ' ' A' ' 8' ' ' GLU . 93.6 t -64.77 -22.75 31.97 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.231 -0.441 . . . . 52.23 111.146 179.981 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 2.8 ttp -113.61 -2.45 13.8 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.159 -0.473 . . . . 42.43 110.886 179.922 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . 0.486 HG22 ' O ' ' A' ' 14' ' ' THR . 25.7 m -76.55 -4.92 45.32 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.211 -0.449 . . . . 74.13 111.135 -179.967 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . 0.684 ' C ' ' HG3' ' A' ' 19' ' ' PRO . 23.5 t -97.88 10.97 5.93 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.269 -0.423 . . . . 54.32 111.176 179.861 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . 0.462 HG22 ' O ' ' A' ' 16' ' ' ILE . 3.0 mp -142.37 2.56 0.41 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.189 -0.46 . . . . 64.45 111.14 179.924 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . 0.798 ' C ' ' HD2' ' A' ' 19' ' ' PRO . 0.6 OUTLIER -101.74 -66.2 0.05 OUTLIER Pre-proline 0 C--N 1.33 -0.273 0 CA-C-O 121.622 0.725 . . . . 72.22 110.88 -179.935 . . . . . . . . 3 3 . 1 . 033 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . 0.92 ' N ' ' HD2' ' A' ' 19' ' ' PRO . 53.7 Cg_endo -69.8 -27.66 26.02 Favored 'Trans proline' 0 C--N 1.342 0.189 0 C-N-CA 122.664 2.243 . . . . 63.12 112.374 179.953 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 19' ' ' PRO . . . . . 0.92 ' HD2' ' N ' ' A' ' 18' ' ' PRO . 53.2 Cg_endo -69.81 -16.2 37.25 Favored 'Trans proline' 0 C--N 1.341 0.145 0 C-N-CA 122.664 2.243 . . . . 73.31 112.329 179.946 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 5.8 tm-20 -83.02 -21.25 33.9 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.2 -0.455 . . . . 74.22 110.855 -179.968 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -57.55 -32.78 67.44 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.166 -0.47 . . . . 75.02 110.896 -179.932 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.366 0 C-N-CA 120.754 -0.736 . . . . 33.43 112.508 -179.95 . . . . . . . . 0 0 . 1 . 034 nuclear nobuild full ' A' A ' 1' ' ' TRP . . . . . . . . . . . . . 53.9 m0 . . . . . 0 C--O 1.231 0.117 0 CA-C-O 120.711 0.291 . . . . 74.51 110.938 . . . . . . . . . 0 0 . 1 . 034 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 2.1 mtt-85 57.81 73.33 0.77 Allowed Pre-proline 0 C--N 1.329 -0.297 0 CA-C-O 121.628 0.728 . . . . 62.15 110.881 -179.955 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.78 78.77 0.99 Allowed 'Trans proline' 0 C--O 1.232 0.194 0 C-N-CA 122.664 2.242 . . . . 74.21 112.327 -179.981 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -134.67 -65.24 0.64 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.217 -0.447 . . . . 71.24 110.917 -179.908 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . 0.426 ' O ' HD12 ' A' ' 5' ' ' LEU . 0.3 OUTLIER -80.36 -24.58 39.72 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.131 -0.486 . . . . 72.14 110.926 179.936 . . . . . . . . 3 3 . 1 . 034 nuclear nobuild full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 87.7 mm-40 -51.85 -49.89 61.99 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.189 -0.46 . . . . 62.33 110.905 179.918 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 11.2 t -68.0 -31.63 71.46 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.236 -0.438 . . . . 64.0 111.198 -179.945 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 1.2 mt-10 -55.77 -31.7 62.83 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.18 -0.464 . . . . 72.35 110.856 179.992 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -76.77 -44.58 32.37 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.201 -0.454 . . . . 75.12 110.883 -179.814 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 14.4 m-85 -64.66 -26.72 68.5 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.122 -0.49 . . . . 74.13 110.908 -179.917 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . 0.453 ' O ' HG22 ' A' ' 14' ' ' THR . 11.7 t70 -67.98 -27.85 66.93 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.121 -0.49 . . . . 73.13 110.862 179.958 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 55.7 t -83.2 -24.2 8.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.204 -0.453 . . . . 45.15 111.091 -179.962 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 10.1 ttp -105.76 6.26 31.63 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.144 -0.48 . . . . 44.43 110.913 179.92 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . 0.453 HG22 ' O ' ' A' ' 11' ' ' ASP . 6.0 t -70.18 -6.34 33.68 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.221 -0.445 . . . . 53.41 111.104 -179.922 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . 0.663 HG12 ' O ' ' A' ' 15' ' ' VAL . 40.3 t -96.27 9.83 5.85 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.242 -0.436 . . . . 64.52 111.177 179.922 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . 0.457 HG22 ' O ' ' A' ' 16' ' ' ILE . 10.6 mt -143.96 2.11 0.3 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.092 -0.504 . . . . 71.43 111.102 179.963 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . 0.815 ' C ' ' HD2' ' A' ' 19' ' ' PRO . 0.0 OUTLIER -99.74 -65.89 0.06 OUTLIER Pre-proline 0 C--N 1.329 -0.288 0 CA-C-O 121.65 0.738 . . . . 73.12 110.818 -179.898 . . . . . . . . 3 3 . 1 . 034 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . 0.922 ' N ' ' HD2' ' A' ' 19' ' ' PRO . 53.7 Cg_endo -69.77 -27.38 26.5 Favored 'Trans proline' 0 C--O 1.231 0.156 0 C-N-CA 122.649 2.232 . . . . 74.21 112.331 -179.976 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 19' ' ' PRO . . . . . 0.922 ' HD2' ' N ' ' A' ' 18' ' ' PRO . 53.6 Cg_endo -69.74 -16.98 37.91 Favored 'Trans proline' 0 C--N 1.341 0.177 0 C-N-CA 122.651 2.234 . . . . 51.14 112.336 179.952 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 1.9 mt-10 -82.79 -19.99 36.66 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.228 -0.442 . . . . 73.3 110.879 -179.967 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -58.59 -33.35 69.88 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.21 -0.45 . . . . 73.51 110.894 -179.945 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.302 0 C-N-CA 120.7 -0.762 . . . . 54.23 112.461 179.998 . . . . . . . . 0 0 . 1 . 035 nuclear nobuild full ' A' A ' 1' ' ' TRP . . . . . . . . . . . . . 3.1 t90 . . . . . 0 C--O 1.231 0.11 0 CA-C-O 120.775 0.321 . . . . 73.11 110.927 . . . . . . . . . 0 0 . 1 . 035 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 2.3 mtm180 -59.7 160.64 13.81 Favored Pre-proline 0 C--N 1.329 -0.287 0 CA-C-O 121.614 0.721 . . . . 44.44 110.866 -179.936 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.8 -48.93 0.61 Allowed 'Trans proline' 0 C--O 1.231 0.159 0 C-N-CA 122.677 2.251 . . . . 74.35 112.35 -179.991 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 6.5 p90 179.49 133.3 0.09 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.253 -0.43 . . . . 53.22 110.917 -179.941 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -142.49 -41.26 0.33 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.095 -0.502 . . . . 71.11 110.913 179.986 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 6.4 mm-40 -54.73 -46.97 74.32 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.179 -0.464 . . . . 73.41 110.914 179.912 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 13.5 t -81.25 -25.24 36.77 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.207 -0.451 . . . . 63.52 111.161 -179.942 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 33.0 tp10 -77.72 -19.75 54.69 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.218 -0.446 . . . . 75.24 110.926 179.948 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 1.4 t80 -86.21 -34.07 20.58 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.151 -0.477 . . . . 62.11 110.925 -179.844 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 22.1 m-85 -59.71 -26.66 65.79 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.109 -0.496 . . . . 74.23 110.927 -179.93 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -64.32 -44.66 90.88 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.139 -0.482 . . . . 64.22 110.891 179.9 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 50.8 t -75.3 -30.01 22.14 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.219 -0.446 . . . . 73.04 111.159 179.96 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 10.4 ttp -102.3 33.93 2.93 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.191 -0.459 . . . . 73.14 110.884 179.884 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 5.6 t -86.74 -3.92 59.11 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.212 -0.449 . . . . 71.23 111.138 -179.92 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . 0.687 ' C ' ' HG3' ' A' ' 19' ' ' PRO . 25.1 t -93.04 3.45 8.2 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.222 -0.445 . . . . 71.32 111.125 179.895 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . 0.462 ' O ' HG22 ' A' ' 16' ' ' ILE . 2.8 mp -142.33 3.6 0.41 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.144 -0.48 . . . . 53.34 111.156 179.949 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . 0.79 ' C ' ' HD2' ' A' ' 19' ' ' PRO . 0.5 OUTLIER -99.86 -68.78 0.04 OUTLIER Pre-proline 0 C--N 1.33 -0.271 0 CA-C-O 121.671 0.748 . . . . 75.04 110.855 -179.879 . . . . . . . . 3 3 . 1 . 035 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . 0.911 ' N ' ' HD2' ' A' ' 19' ' ' PRO . 53.6 Cg_endo -69.77 -27.99 25.74 Favored 'Trans proline' 0 C--N 1.341 0.172 0 C-N-CA 122.651 2.234 . . . . 53.55 112.323 179.981 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 19' ' ' PRO . . . . . 0.911 ' HD2' ' N ' ' A' ' 18' ' ' PRO . 54.1 Cg_endo -69.7 -16.76 37.97 Favored 'Trans proline' 0 C--N 1.341 0.149 0 C-N-CA 122.702 2.268 . . . . 72.34 112.366 179.942 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 28.4 tt0 -82.64 -21.24 35.13 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.191 -0.459 . . . . 73.33 110.888 -179.975 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -59.13 -25.39 63.82 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.113 -0.494 . . . . 63.41 110.875 -179.878 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.339 0 C-N-CA 120.746 -0.74 . . . . 75.23 112.516 -179.987 . . . . . . . . 0 0 . 1 . 036 nuclear nobuild full ' A' A ' 1' ' ' TRP . . . . . . . . . . . . . 37.0 m0 . . . . . 0 C--O 1.231 0.124 0 CA-C-O 120.769 0.319 . . . . 71.51 110.945 . . . . . . . . . 0 0 . 1 . 036 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 3.1 mpp_? -128.39 73.29 80.27 Favored Pre-proline 0 C--N 1.329 -0.319 0 CA-C-O 121.6 0.714 . . . . 74.51 110.866 -179.93 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.75 133.14 24.87 Favored 'Trans proline' 0 C--O 1.232 0.193 0 C-N-CA 122.688 2.259 . . . . 61.32 112.359 -179.997 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild full ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 6.1 t80 -134.66 -65.98 0.61 Allowed 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.272 -0.422 . . . . 75.34 110.959 -179.943 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . 0.457 ' O ' HD12 ' A' ' 5' ' ' LEU . 0.3 OUTLIER -78.98 -22.63 45.32 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.127 -0.488 . . . . 71.33 110.932 179.936 . . . . . . . . 3 3 . 1 . 036 nuclear nobuild full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 22.0 mt-30 -51.58 -51.0 59.05 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.194 -0.457 . . . . 63.31 110.892 179.954 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 8.9 t -71.12 -33.36 70.04 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.226 -0.443 . . . . 71.04 111.191 -179.96 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 2.4 tt0 -56.07 -26.38 49.21 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.2 -0.455 . . . . 72.12 110.888 179.949 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 20.9 t80 -82.78 -43.6 16.54 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.162 -0.472 . . . . 73.31 110.877 -179.819 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild full ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 22.4 m-85 -62.15 -26.78 68.52 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.128 -0.487 . . . . 53.23 110.909 -179.912 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . 0.509 ' O ' HG22 ' A' ' 14' ' ' THR . 3.2 t0 -64.49 -24.83 67.75 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.119 -0.491 . . . . 64.25 110.848 179.93 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 47.8 t -82.95 -24.05 8.4 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.232 -0.44 . . . . 73.45 111.147 -179.976 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 9.0 ttp -105.58 2.98 28.77 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.134 -0.485 . . . . 54.15 110.852 179.918 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . 0.509 HG22 ' O ' ' A' ' 11' ' ' ASP . 5.6 t -70.28 -5.93 31.3 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.272 -0.422 . . . . 75.34 111.162 -179.98 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . 0.655 HG12 ' O ' ' A' ' 15' ' ' VAL . 40.0 t -96.18 9.84 5.79 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.229 -0.442 . . . . 71.32 111.171 179.872 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . 0.449 HG22 ' O ' ' A' ' 16' ' ' ILE . 10.4 mt -143.86 2.05 0.31 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.176 -0.466 . . . . 70.33 111.16 179.945 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . 0.815 ' C ' ' HD2' ' A' ' 19' ' ' PRO . 0.0 OUTLIER -99.73 -65.79 0.06 OUTLIER Pre-proline 0 C--N 1.33 -0.252 0 CA-C-O 121.673 0.749 . . . . 61.52 110.864 -179.922 . . . . . . . . 3 3 . 1 . 036 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . 0.911 ' N ' ' HD2' ' A' ' 19' ' ' PRO . 53.6 Cg_endo -69.74 -27.4 26.61 Favored 'Trans proline' 0 C--N 1.341 0.175 0 C-N-CA 122.713 2.276 . . . . 62.33 112.36 179.978 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild full ' A' A ' 19' ' ' PRO . . . . . 0.911 ' HD2' ' N ' ' A' ' 18' ' ' PRO . 53.5 Cg_endo -69.82 -16.95 37.55 Favored 'Trans proline' 0 C--N 1.342 0.217 0 C-N-CA 122.673 2.249 . . . . 71.34 112.318 179.981 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 1.2 mt-10 -82.81 -20.23 36.15 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.232 -0.44 . . . . 74.32 110.836 -179.969 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -58.41 -32.8 68.98 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.188 -0.46 . . . . 75.42 110.903 -179.91 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.288 0 C-N-CA 120.735 -0.745 . . . . 63.23 112.475 -179.999 . . . . . . . . 0 0 . 1 . 037 nuclear nobuild full ' A' A ' 1' ' ' TRP . . . . . . . . . . . . . 2.5 t90 . . . . . 0 C--O 1.231 0.082 0 CA-C-O 120.771 0.32 . . . . 70.34 110.904 . . . . . . . . . 0 0 . 1 . 037 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 8.3 mtt-85 -53.67 160.61 1.94 Allowed Pre-proline 0 C--N 1.329 -0.283 0 CA-C-O 121.592 0.71 . . . . 75.12 110.85 -179.931 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.79 105.0 1.41 Allowed 'Trans proline' 0 C--N 1.341 0.164 0 C-N-CA 122.665 2.243 . . . . 72.2 112.36 -179.997 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild full ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 12.6 t80 -135.84 -68.16 0.51 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.207 -0.451 . . . . 74.33 110.946 -179.896 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . 0.426 ' O ' HD12 ' A' ' 5' ' ' LEU . 0.3 OUTLIER -74.93 -24.73 58.54 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.12 -0.491 . . . . 75.54 110.867 179.964 . . . . . . . . 3 3 . 1 . 037 nuclear nobuild full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -51.62 -58.03 7.5 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.201 -0.454 . . . . 62.23 110.917 179.952 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 13.4 t -58.87 -28.27 65.97 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.178 -0.465 . . . . 70.23 111.148 -179.901 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -70.16 -21.83 63.03 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.227 -0.442 . . . . 74.22 110.908 179.948 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -82.37 -27.6 32.02 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.189 -0.46 . . . . 73.21 110.906 -179.876 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild full ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 15.9 m-85 -52.1 -37.52 54.34 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.122 -0.49 . . . . 75.42 110.936 -179.932 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . 0.543 ' O ' HG22 ' A' ' 14' ' ' THR . 11.1 m-20 -56.86 -31.46 64.82 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.095 -0.502 . . . . 70.44 110.879 179.911 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 39.7 t -78.21 -23.03 13.53 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-N 116.207 -0.451 . . . . 73.12 111.159 179.992 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 9.7 ttp -104.36 6.37 35.11 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.138 -0.483 . . . . 64.23 110.872 179.9 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . 0.543 HG22 ' O ' ' A' ' 11' ' ' ASP . 5.8 t -70.04 -6.34 32.92 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.257 -0.429 . . . . 61.12 111.183 -179.955 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . 0.647 HG12 ' O ' ' A' ' 15' ' ' VAL . 40.7 t -96.28 9.87 5.83 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.207 -0.451 . . . . 74.4 111.137 179.907 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . 0.447 HG22 ' O ' ' A' ' 16' ' ' ILE . 10.8 mt -143.96 1.98 0.3 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.193 -0.458 . . . . 75.41 111.132 179.942 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . 0.812 ' C ' ' HD2' ' A' ' 19' ' ' PRO . 0.0 OUTLIER -99.66 -65.88 0.06 OUTLIER Pre-proline 0 C--N 1.329 -0.307 0 CA-C-O 121.707 0.765 . . . . 65.11 110.863 -179.895 . . . . . . . . 3 3 . 1 . 037 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . 0.91 ' N ' ' HD2' ' A' ' 19' ' ' PRO . 53.8 Cg_endo -69.77 -27.42 26.43 Favored 'Trans proline' 0 C--N 1.342 0.205 0 C-N-CA 122.739 2.292 . . . . 75.52 112.321 179.999 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild full ' A' A ' 19' ' ' PRO . . . . . 0.91 ' HD2' ' N ' ' A' ' 18' ' ' PRO . 54.1 Cg_endo -69.74 -17.02 37.9 Favored 'Trans proline' 0 C--N 1.341 0.176 0 C-N-CA 122.657 2.238 . . . . 75.34 112.392 179.922 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 1.3 mt-10 -82.73 -19.88 37.07 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.208 -0.451 . . . . 74.24 110.92 179.989 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -58.62 -33.72 70.35 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.111 -0.495 . . . . 73.44 110.903 -179.943 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.309 0 C-N-CA 120.715 -0.755 . . . . 64.32 112.469 -179.953 . . . . . . . . 0 0 . 1 . 038 nuclear nobuild full ' A' A ' 1' ' ' TRP . . . . . . . . . . . . . 46.3 m0 . . . . . 0 C--O 1.231 0.128 0 CA-C-O 120.786 0.327 . . . . 71.42 110.944 . . . . . . . . . 0 0 . 1 . 038 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER 52.94 72.77 1.07 Allowed Pre-proline 0 C--N 1.329 -0.319 0 CA-C-O 121.631 0.729 . . . . 65.44 110.868 -179.928 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -69.78 141.18 44.46 Favored 'Trans proline' 0 C--N 1.342 0.205 0 C-N-CA 122.705 2.27 . . . . 62.1 112.362 179.98 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild full ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 5.9 t80 -134.43 -65.43 0.64 Allowed 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.197 -0.456 . . . . 71.14 110.989 -179.917 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . 0.438 ' O ' HD12 ' A' ' 5' ' ' LEU . 0.3 OUTLIER -79.88 -24.43 41.2 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.122 -0.49 . . . . 72.24 110.911 179.926 . . . . . . . . 3 3 . 1 . 038 nuclear nobuild full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -51.92 -51.18 58.75 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.241 -0.436 . . . . 53.51 110.942 179.904 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 10.4 t -66.63 -31.97 72.99 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.178 -0.465 . . . . 70.25 111.143 -179.935 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -56.95 -26.29 59.33 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.191 -0.459 . . . . 73.3 110.905 -179.983 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -81.86 -44.56 16.71 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.151 -0.477 . . . . 75.11 110.934 -179.879 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild full ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 20.9 m-85 -61.11 -27.88 68.7 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.101 -0.499 . . . . 73.23 110.926 -179.898 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . 0.408 ' O ' HG22 ' A' ' 14' ' ' THR . 2.1 m-20 -68.46 -27.28 66.02 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.131 -0.486 . . . . 51.54 110.92 179.879 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 46.3 t -84.43 -24.45 7.4 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.125 -0.489 . . . . 72.51 111.109 179.98 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 9.7 ttp -105.4 6.37 32.5 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.229 -0.442 . . . . 72.44 110.876 179.939 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . 0.408 HG22 ' O ' ' A' ' 11' ' ' ASP . 6.0 t -70.02 -6.32 32.68 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.186 -0.461 . . . . 55.54 111.177 -179.981 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . 0.662 HG12 ' O ' ' A' ' 15' ' ' VAL . 40.5 t -96.33 9.94 5.81 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.195 -0.457 . . . . 51.2 111.127 179.93 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . 0.449 HG22 ' O ' ' A' ' 16' ' ' ILE . 10.6 mt -143.96 1.96 0.3 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.159 -0.473 . . . . 73.22 111.117 179.952 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . 0.817 ' C ' ' HD2' ' A' ' 19' ' ' PRO . 0.0 OUTLIER -99.64 -65.88 0.06 OUTLIER Pre-proline 0 C--N 1.329 -0.301 0 CA-C-O 121.688 0.756 . . . . 63.42 110.859 -179.934 . . . . . . . . 3 3 . 1 . 038 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . 0.923 ' N ' ' HD2' ' A' ' 19' ' ' PRO . 53.7 Cg_endo -69.73 -27.41 26.67 Favored 'Trans proline' 0 C--N 1.342 0.199 0 C-N-CA 122.691 2.261 . . . . 75.24 112.324 -179.999 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild full ' A' A ' 19' ' ' PRO . . . . . 0.923 ' HD2' ' N ' ' A' ' 18' ' ' PRO . 53.4 Cg_endo -69.82 -17.34 37.36 Favored 'Trans proline' 0 C--N 1.342 0.191 0 C-N-CA 122.691 2.26 . . . . 71.31 112.348 179.979 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 6.2 tm-20 -83.06 -20.74 34.39 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.204 -0.453 . . . . 43.15 110.898 179.993 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -58.64 -32.63 69.23 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.151 -0.477 . . . . 74.12 110.888 -179.916 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.321 0 C-N-CA 120.761 -0.733 . . . . 52.31 112.506 -179.99 . . . . . . . . 0 0 . 1 . 039 nuclear nobuild full ' A' A ' 1' ' ' TRP . . . . . . . . . . . . . 51.3 m0 . . . . . 0 C--O 1.231 0.097 0 CA-C-O 120.811 0.338 . . . . 75.14 110.89 . . . . . . . . . 0 0 . 1 . 039 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 3.5 ptt180 -51.64 156.86 2.09 Favored Pre-proline 0 C--N 1.329 -0.292 0 CA-C-O 121.604 0.716 . . . . 71.15 110.849 -179.952 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_endo -69.73 153.57 68.91 Favored 'Trans proline' 0 C--N 1.342 0.204 0 C-N-CA 122.667 2.245 . . . . 34.13 112.373 179.945 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild full ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 5.5 t80 -134.57 -65.24 0.65 Allowed 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.24 -0.436 . . . . 61.11 110.896 -179.91 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . 0.432 ' O ' HD12 ' A' ' 5' ' ' LEU . 0.3 OUTLIER -80.46 -24.5 39.48 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.12 -0.491 . . . . 72.03 110.924 179.961 . . . . . . . . 3 3 . 1 . 039 nuclear nobuild full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 4.3 mm-40 -51.95 -49.81 62.43 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.179 -0.464 . . . . 61.22 110.907 179.924 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 11.0 t -68.13 -31.8 71.64 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.219 -0.446 . . . . 62.15 111.102 -179.902 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -55.73 -27.74 52.14 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.232 -0.44 . . . . 65.23 110.9 -179.986 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -81.76 -44.65 16.72 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.154 -0.476 . . . . 75.3 110.943 -179.869 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild full ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 16.7 m-85 -63.13 -27.83 69.65 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.113 -0.494 . . . . 74.52 110.959 -179.938 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . 0.471 ' O ' HG22 ' A' ' 14' ' ' THR . 3.3 t70 -67.98 -28.78 67.74 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.111 -0.495 . . . . 71.12 110.883 179.897 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 59.0 t -82.55 -24.41 8.81 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.166 -0.47 . . . . 61.23 111.12 -179.979 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 9.7 ttp -105.47 6.38 32.37 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.185 -0.461 . . . . 64.22 110.901 179.86 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . 0.471 HG22 ' O ' ' A' ' 11' ' ' ASP . 6.1 t -70.11 -6.37 33.56 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.235 -0.439 . . . . 73.42 111.193 -179.991 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . 0.644 HG12 ' O ' ' A' ' 15' ' ' VAL . 40.5 t -96.26 9.91 5.79 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.164 -0.471 . . . . 75.41 111.119 179.891 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . 0.455 HG22 ' O ' ' A' ' 16' ' ' ILE . 10.8 mt -143.93 2.04 0.31 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.192 -0.458 . . . . 75.21 111.121 179.899 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . 0.804 ' C ' ' HD2' ' A' ' 19' ' ' PRO . 0.0 OUTLIER -99.67 -65.89 0.06 OUTLIER Pre-proline 0 C--N 1.329 -0.303 0 CA-C-O 121.678 0.752 . . . . 62.13 110.861 -179.916 . . . . . . . . 3 3 . 1 . 039 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . 0.907 ' N ' ' HD2' ' A' ' 19' ' ' PRO . 53.7 Cg_endo -69.74 -27.44 26.55 Favored 'Trans proline' 0 C--N 1.341 0.168 0 C-N-CA 122.716 2.277 . . . . 61.23 112.341 179.995 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild full ' A' A ' 19' ' ' PRO . . . . . 0.907 ' HD2' ' N ' ' A' ' 18' ' ' PRO . 53.7 Cg_endo -69.81 -16.87 37.55 Favored 'Trans proline' 0 C--N 1.342 0.203 0 C-N-CA 122.65 2.234 . . . . 75.4 112.336 179.991 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 1.1 mt-10 -82.83 -19.49 37.51 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.221 -0.445 . . . . 55.31 110.933 179.975 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -59.68 -25.82 65.05 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.122 -0.49 . . . . 73.21 110.881 -179.965 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.313 0 C-N-CA 120.73 -0.747 . . . . 52.34 112.483 -179.955 . . . . . . . . 0 0 . 1 . 040 nuclear nobuild full ' A' A ' 1' ' ' TRP . . . . . . . . . . . . . 1.7 t90 . . . . . 0 C--O 1.23 0.076 0 CA-C-O 120.801 0.334 . . . . 65.32 110.962 . . . . . . . . . 0 0 . 1 . 040 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -117.41 72.36 7.16 Favored Pre-proline 0 C--N 1.329 -0.294 0 CA-C-O 121.573 0.702 . . . . 72.3 110.836 -179.913 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.78 -172.27 0.56 Allowed 'Trans proline' 0 C--N 1.341 0.173 0 C-N-CA 122.661 2.241 . . . . 75.02 112.345 179.982 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild full ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 45.1 m-85 -134.12 -65.56 0.65 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.22 -0.445 . . . . 74.53 110.931 -179.896 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . 0.424 ' O ' HD12 ' A' ' 5' ' ' LEU . 0.3 OUTLIER -79.77 -24.54 41.45 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.13 -0.486 . . . . 74.55 110.896 179.936 . . . . . . . . 3 3 . 1 . 040 nuclear nobuild full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -54.38 -54.13 44.73 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.204 -0.453 . . . . 74.52 110.926 179.97 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 12.3 t -59.33 -31.19 68.95 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.187 -0.46 . . . . 75.14 111.16 -179.956 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -55.71 -26.1 43.5 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.196 -0.456 . . . . 64.4 110.856 -179.985 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -88.93 -45.44 9.68 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.174 -0.466 . . . . 74.24 110.961 -179.834 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild full ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 16.4 m-85 -60.91 -26.5 67.51 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.11 -0.495 . . . . 71.44 110.932 -179.963 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . 0.565 ' O ' HG22 ' A' ' 14' ' ' THR . 0.4 OUTLIER -63.21 -25.57 68.4 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.111 -0.495 . . . . 72.54 110.883 179.919 . . . . . . . . 3 3 . 1 . 040 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 48.5 t -81.03 -24.26 10.68 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 116.181 -0.463 . . . . 62.43 111.154 -179.989 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 8.5 ttp -106.05 3.25 27.99 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.135 -0.484 . . . . 64.14 110.86 179.921 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . 0.565 HG22 ' O ' ' A' ' 11' ' ' ASP . 5.6 t -70.8 -5.72 32.36 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.217 -0.447 . . . . 72.33 111.142 -179.927 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . 0.654 HG12 ' O ' ' A' ' 15' ' ' VAL . 40.3 t -96.33 9.09 6.37 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.18 -0.464 . . . . 44.0 111.163 179.88 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . 0.452 HG22 ' O ' ' A' ' 16' ' ' ILE . 2.9 mp -142.78 2.26 0.38 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.136 -0.484 . . . . 72.41 111.128 179.934 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . 0.827 ' C ' ' HD2' ' A' ' 19' ' ' PRO . 0.0 OUTLIER -99.65 -65.79 0.06 OUTLIER Pre-proline 0 C--N 1.33 -0.281 0 CA-C-O 121.657 0.741 . . . . 61.45 110.844 -179.924 . . . . . . . . 3 3 . 1 . 040 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . 0.93 ' N ' ' HD2' ' A' ' 19' ' ' PRO . 53.4 Cg_endo -69.76 -27.33 26.62 Favored 'Trans proline' 0 C--N 1.342 0.195 0 C-N-CA 122.651 2.234 . . . . 75.22 112.315 -179.979 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild full ' A' A ' 19' ' ' PRO . . . . . 0.93 ' HD2' ' N ' ' A' ' 18' ' ' PRO . 53.3 Cg_endo -69.75 -17.09 37.82 Favored 'Trans proline' 0 C--N 1.341 0.18 0 C-N-CA 122.705 2.27 . . . . 75.54 112.321 179.986 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -82.65 -19.72 37.68 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.184 -0.462 . . . . 72.5 110.857 -179.946 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -59.57 -25.83 64.9 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.153 -0.476 . . . . 54.4 110.89 -179.913 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.304 0 C-N-CA 120.739 -0.743 . . . . 50.43 112.476 -179.953 . . . . . . . . 0 0 . 1 stop_ save_