data_6u7x_residue ############################ # Computer software used # ############################ save_MolProbity _Software.Sf_category software _Software.Sf_framecode MolProbity _Software.Entry_ID ? _Software.ID 1 _Software.Name MolProbity _Software.Version 4.0 _Software.Details . save_ save_CYRANGE _Software.Sf_category software _Software.Sf_framecode CYRANGE _Software.Entry_ID ? _Software.ID 2 _Software.Name CYRANGE _Software.Version 2.0 _Software.Details . save_ save_Structure_validation_residue _Structure_validation_residue.Sf_category structure_validation _Structure_validation_residue.Sf_framecode Structure_validation_residue _Structure_validation_residue.Entry_ID ? _Structure_validation_residue.List_ID 1 _Structure_validation_residue.PDB_accession_code 6u7x _Structure_validation_residue.Date_analyzed 2020-04-17 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 ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.436 -1.36 0 N-CA-C 110.682 -0.967 . . . . 0.0 110.682 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 2' ' ' ARG . . . . . 0.47 ' O ' ' HA ' ' A' ' 11' ' ' ALA . 26.7 mtt180 -124.26 93.65 3.98 Favored 'General case' 0 C--N 1.315 -0.917 0 N-CA-C 108.268 -1.012 . . . . 0.0 108.268 -178.958 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -108.1 134.76 50.52 Favored 'General case' 0 C--N 1.293 -1.872 0 CA-C-O 120.999 0.428 . . . . 0.0 110.959 178.091 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 4' ' ' TYR . . . . . 0.46 ' HD1' ' O ' ' A' ' 10' ' ' ILE . 96.3 m-85 -104.05 142.42 34.48 Favored 'General case' 0 C--N 1.302 -1.463 0 CA-C-N 115.536 -0.757 . . . . 0.0 110.218 -179.698 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 12.8 mptt -82.63 -30.08 29.67 Favored 'General case' 0 C--O 1.246 0.891 0 CA-C-N 115.852 -0.613 . . . . 0.0 111.549 -177.23 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 10.6 m -66.24 155.28 37.56 Favored 'General case' 0 N--CA 1.442 -0.862 0 CA-C-N 115.587 -0.733 . . . . 0.0 110.237 -178.589 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . 0.441 ' HD2' ' N ' ' A' ' 7' ' ' LYS . 3.5 mptp? -104.56 135.39 19.32 Favored Pre-proline 0 N--CA 1.437 -1.121 0 N-CA-C 109.183 -0.673 . . . . 0.0 109.183 179.294 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 67.2 Cg_endo -70.54 136.15 38.99 Favored 'Cis proline' 0 N--CA 1.484 0.912 0 C-N-CA 124.373 -1.094 . . . . 0.0 112.374 1.384 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 42.9 Cg_endo -71.68 107.32 2.16 Favored 'Trans proline' 0 N--CA 1.447 -1.207 0 C-N-CA 122.049 1.833 . . . . 0.0 111.52 179.63 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 10' ' ' ILE . . . . . 0.46 ' O ' ' HD1' ' A' ' 4' ' ' TYR . 50.6 mm -93.7 129.69 43.73 Favored 'Isoleucine or valine' 0 C--N 1.291 -1.952 0 N-CA-C 108.35 -0.981 . . . . 0.0 108.35 179.616 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . 0.47 ' HA ' ' O ' ' A' ' 2' ' ' ARG . . . -126.8 126.52 43.53 Favored 'General case' 0 N--CA 1.434 -1.249 0 N-CA-C 109.582 -0.525 . . . . 0.0 109.582 177.702 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 74.6 m-85 -98.66 132.19 24.42 Favored Pre-proline 0 C--N 1.291 -1.956 0 N-CA-C 107.181 -1.414 . . . . 0.0 107.181 175.809 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 26.5 Cg_endo -57.67 -8.98 4.77 Favored 'Trans proline' 0 N--CA 1.485 1.002 0 C-N-CA 124.169 3.246 . . . . 0.0 115.064 -173.035 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 45.3 m-20 . . . . . 0 C--N 1.319 -0.742 0 CA-C-O 120.729 0.3 . . . . 0.0 110.308 178.131 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.434 -1.483 0 N-CA-C 112.664 -0.175 . . . . 0.0 112.664 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 73.8 mtm180 -134.97 102.78 5.34 Favored 'General case' 0 C--N 1.305 -1.363 0 N-CA-C 109.968 -0.382 . . . . 0.0 109.968 177.634 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -118.49 134.41 55.1 Favored 'General case' 0 C--N 1.287 -2.151 0 CA-C-N 115.802 -0.635 . . . . 0.0 111.44 178.764 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 92.2 m-85 -88.25 122.18 31.49 Favored 'General case' 0 N--CA 1.421 -1.881 0 N-CA-C 106.263 -1.755 . . . . 0.0 106.263 171.92 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . 0.481 ' HZ1' ' HB2' ' A' ' 5' ' ' LYS . 10.5 mtmp? -80.94 -5.63 57.71 Favored 'General case' 0 C--N 1.311 -1.098 0 CA-C-O 121.237 0.541 . . . . 0.0 111.106 -176.314 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 11.5 p -83.95 148.33 26.97 Favored 'General case' 0 N--CA 1.425 -1.717 0 CA-C-N 115.423 -0.808 . . . . 0.0 109.361 175.977 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 55.3 mtpt -97.7 141.34 22.84 Favored Pre-proline 0 C--N 1.304 -1.385 0 N-CA-C 108.071 -1.085 . . . . 0.0 108.071 177.248 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 24.7 Cg_exo -66.74 140.54 50.5 Favored 'Cis proline' 0 N--CA 1.486 1.039 0 CA-C-N 119.813 0.969 . . . . 0.0 113.435 2.11 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 57.6 Cg_endo -70.73 109.25 2.45 Favored 'Trans proline' 0 C--O 1.244 0.78 0 C-N-CA 123.251 2.634 . . . . 0.0 113.542 -177.837 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 64.1 mt -109.09 122.29 63.52 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.346 0 N-CA-C 107.659 -1.238 . . . . 0.0 107.659 175.87 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -133.52 154.04 51.15 Favored 'General case' 0 C--N 1.317 -0.819 0 CA-C-O 121.175 0.512 . . . . 0.0 110.926 -177.307 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 99.8 m-85 -121.63 131.36 24.46 Favored Pre-proline 0 C--N 1.297 -1.698 0 N-CA-C 107.052 -1.462 . . . . 0.0 107.052 173.916 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 37.5 Cg_exo -58.83 -12.66 15.53 Favored 'Trans proline' 0 N--CA 1.489 1.215 0 C-N-CA 123.965 3.11 . . . . 0.0 115.188 -174.514 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 5.8 p-10 . . . . . 0 C--N 1.318 -0.77 0 CA-C-O 120.93 0.395 . . . . 0.0 110.832 178.203 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.492 -1.403 0 N-CA-C 110.424 -1.071 . . . . 0.0 110.424 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 82.0 mtt180 -128.61 100.62 5.82 Favored 'General case' 0 C--N 1.315 -0.913 0 N-CA-C 108.379 -0.971 . . . . 0.0 108.379 -178.8 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -110.71 135.5 51.22 Favored 'General case' 0 C--N 1.29 -1.985 0 CA-C-N 116.351 -0.386 . . . . 0.0 111.12 -179.428 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 4' ' ' TYR . . . . . 0.474 ' HD1' ' O ' ' A' ' 10' ' ' ILE . 94.8 m-85 -88.91 141.16 28.73 Favored 'General case' 0 C--N 1.301 -1.533 0 CA-C-N 115.92 -0.582 . . . . 0.0 109.568 176.325 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 66.2 mttm -92.54 -42.1 9.88 Favored 'General case' 0 C--N 1.3 -1.564 0 N-CA-C 108.895 -0.78 . . . . 0.0 108.895 -179.106 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 24.9 m -65.42 127.13 30.54 Favored 'General case' 0 N--CA 1.424 -1.725 0 N-CA-C 108.668 -0.864 . . . . 0.0 108.668 176.867 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 42.7 mmtm -75.12 146.07 81.52 Favored Pre-proline 0 C--N 1.306 -1.302 0 CA-C-N 115.741 -0.663 . . . . 0.0 110.643 -173.773 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 56.7 Cg_endo -71.29 144.33 79.21 Favored 'Cis proline' 0 C--N 1.352 0.711 0 C-N-CA 123.979 -1.259 . . . . 0.0 112.729 1.63 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 55.4 Cg_endo -73.16 96.03 0.86 Allowed 'Trans proline' 0 N--CA 1.446 -1.3 0 C-N-CA 122.22 1.947 . . . . 0.0 111.574 -179.178 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 10' ' ' ILE . . . . . 0.474 ' O ' ' HD1' ' A' ' 4' ' ' TYR . 50.4 mm -92.32 134.4 30.58 Favored 'Isoleucine or valine' 0 C--N 1.294 -1.814 0 N-CA-C 106.642 -1.614 . . . . 0.0 106.642 177.64 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -130.98 144.32 51.39 Favored 'General case' 0 C--N 1.303 -1.434 0 C-N-CA 119.925 -0.71 . . . . 0.0 109.323 179.081 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 80.1 m-85 -109.46 129.54 23.79 Favored Pre-proline 0 C--N 1.288 -2.093 0 N-CA-C 107.311 -1.366 . . . . 0.0 107.311 173.264 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 3.4 Cg_exo -49.18 -17.06 1.22 Allowed 'Trans proline' 0 C--N 1.361 1.226 0 C-N-CA 124.522 3.481 . . . . 0.0 114.689 179.599 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 25.5 t70 . . . . . 0 C--N 1.318 -0.763 0 CA-C-O 121.672 0.749 . . . . 0.0 110.569 175.703 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.431 -1.658 0 N-CA-C 109.804 -1.319 . . . . 0.0 109.804 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 2' ' ' ARG . . . . . 0.434 ' HB3' ' HB2' ' A' ' 12' ' ' PHE . 9.6 ttm180 -135.76 98.28 3.87 Favored 'General case' 0 N--CA 1.431 -1.378 0 N-CA-C 109.57 -0.53 . . . . 0.0 109.57 -177.67 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -107.56 134.99 49.77 Favored 'General case' 0 C--N 1.289 -2.058 0 CA-C-O 121.639 0.733 . . . . 0.0 112.001 179.839 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 66.9 m-85 -101.18 105.49 16.63 Favored 'General case' 0 C--N 1.287 -2.121 0 N-CA-C 107.182 -1.414 . . . . 0.0 107.182 172.137 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 56.5 mtmt -86.1 -7.29 58.7 Favored 'General case' 0 C--N 1.31 -1.109 0 CA-C-N 115.36 -0.836 . . . . 0.0 109.945 -178.652 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 14.9 m -85.88 168.15 14.48 Favored 'General case' 0 N--CA 1.432 -1.364 0 N-CA-C 106.052 -1.833 . . . . 0.0 106.052 171.931 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 18.2 ptpt -95.44 146.34 31.14 Favored Pre-proline 0 C--N 1.301 -1.534 0 C-N-CA 118.998 -1.081 . . . . 0.0 111.262 -179.601 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 6.0 Cg_exo -76.58 138.88 56.87 Favored 'Cis proline' 0 C--N 1.349 0.596 0 C-N-CA 124.045 -1.231 . . . . 0.0 112.235 0.531 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 32.4 Cg_endo -65.74 114.96 3.15 Favored 'Trans proline' 0 C--O 1.239 0.546 0 C-N-CA 122.489 2.126 . . . . 0.0 111.441 -179.896 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 7.3 tp -142.29 132.58 24.08 Favored 'Isoleucine or valine' 0 C--N 1.293 -1.871 0 N-CA-C 108.529 -0.915 . . . . 0.0 108.529 179.219 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -124.23 123.2 39.73 Favored 'General case' 0 N--CA 1.434 -1.267 0 CA-C-O 121.333 0.587 . . . . 0.0 110.006 -178.858 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 12' ' ' PHE . . . . . 0.434 ' HB2' ' HB3' ' A' ' 2' ' ' ARG . 82.6 m-85 -95.69 132.3 27.65 Favored Pre-proline 0 C--N 1.282 -2.349 0 N-CA-C 108.282 -1.007 . . . . 0.0 108.282 -179.877 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 25.6 Cg_exo -60.91 9.33 0.08 OUTLIER 'Trans proline' 0 N--CA 1.491 1.335 0 C-N-CA 124.497 3.464 . . . . 0.0 116.112 -174.047 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 6.7 p-10 . . . . . 0 C--N 1.3 -1.573 0 N-CA-C 108.82 -0.807 . . . . 0.0 108.82 176.48 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.44 -1.082 0 N-CA-C 110.856 -0.898 . . . . 0.0 110.856 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 90.7 mtt180 -110.19 97.54 7.0 Favored 'General case' 0 C--N 1.315 -0.912 0 N-CA-C 109.329 -0.619 . . . . 0.0 109.329 -177.744 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -108.59 135.28 50.11 Favored 'General case' 0 C--N 1.303 -1.437 0 CA-C-N 115.356 -0.838 . . . . 0.0 112.862 -179.437 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 55.8 m-85 -92.22 151.93 20.1 Favored 'General case' 0 C--N 1.3 -1.548 0 CA-C-N 114.684 -1.144 . . . . 0.0 109.109 173.718 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -101.95 -1.48 31.85 Favored 'General case' 0 C--N 1.308 -1.219 0 CA-C-O 121.797 0.808 . . . . 0.0 110.59 175.04 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 25.5 m -89.13 130.94 35.49 Favored 'General case' 0 N--CA 1.425 -1.712 0 CA-C-N 115.057 -0.974 . . . . 0.0 108.716 177.29 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . 0.508 ' HA ' ' C ' ' A' ' 8' ' ' PRO . 2.9 mppt? -92.63 141.16 24.22 Favored Pre-proline 0 C--N 1.315 -0.905 0 N-CA-C 109.495 -0.557 . . . . 0.0 109.495 179.486 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . 0.508 ' C ' ' HA ' ' A' ' 7' ' ' LYS . 38.4 Cg_exo -63.1 132.98 12.86 Favored 'Cis proline' 0 C--N 1.353 0.797 0 C-N-CA 124.312 -1.12 . . . . 0.0 111.066 -1.261 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 70.6 Cg_endo -76.86 119.14 5.01 Favored 'Trans proline' 0 N--CA 1.445 -1.33 0 C-N-CA 122.377 2.051 . . . . 0.0 112.718 -173.878 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 73.7 mt -98.29 121.97 49.44 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.708 0 CA-C-N 115.242 -0.89 . . . . 0.0 108.859 178.435 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -127.63 119.18 25.35 Favored 'General case' 0 N--CA 1.439 -0.986 0 CA-C-O 121.095 0.474 . . . . 0.0 109.964 178.182 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 97.3 m-85 -89.6 131.38 40.14 Favored Pre-proline 0 C--N 1.288 -2.092 0 N-CA-C 107.917 -1.142 . . . . 0.0 107.917 175.989 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 81.4 Cg_exo -52.54 -7.73 0.34 Allowed 'Trans proline' 0 N--CA 1.505 2.205 0 C-N-CA 124.932 3.754 . . . . 0.0 115.067 -178.763 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 25.8 t70 . . . . . 0 C--N 1.314 -0.955 0 CA-C-O 121.579 0.704 . . . . 0.0 109.583 174.306 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.423 -2.214 0 N-CA-C 110.677 -0.969 . . . . 0.0 110.677 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 54.5 mtt180 -134.01 105.53 6.76 Favored 'General case' 0 C--N 1.312 -1.026 0 N-CA-C 108.539 -0.911 . . . . 0.0 108.539 -178.048 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -118.98 134.59 55.1 Favored 'General case' 0 C--N 1.298 -1.667 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.631 177.635 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 80.2 m-85 -96.66 129.09 44.13 Favored 'General case' 0 C--N 1.298 -1.647 0 CA-C-N 115.305 -0.861 . . . . 0.0 110.352 177.425 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 34.5 mtmm -90.05 -16.1 30.42 Favored 'General case' 0 C--N 1.306 -1.312 0 CA-C-O 121.71 0.767 . . . . 0.0 109.643 177.674 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 23.0 m -81.12 135.65 35.82 Favored 'General case' 0 N--CA 1.419 -2.014 0 N-CA-C 108.032 -1.099 . . . . 0.0 108.032 175.534 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 2.0 mppt? -80.49 135.84 52.96 Favored Pre-proline 0 C--N 1.305 -1.335 0 N-CA-C 109.681 -0.488 . . . . 0.0 109.681 -176.72 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 61.1 Cg_endo -73.43 132.19 25.83 Favored 'Cis proline' 0 CA--C 1.542 0.922 0 C-N-CA 124.131 -1.195 . . . . 0.0 112.848 1.694 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 8.9 Cg_exo -72.08 97.11 0.81 Allowed 'Trans proline' 0 N--CA 1.455 -0.766 0 C-N-CA 122.432 2.088 . . . . 0.0 111.272 -179.351 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 61.4 mt -94.69 136.01 27.18 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.798 0 CA-C-N 115.895 -0.593 . . . . 0.0 109.678 179.336 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -124.2 151.81 43.63 Favored 'General case' 0 N--CA 1.437 -1.11 0 CA-C-O 121.407 0.623 . . . . 0.0 110.947 179.22 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 96.4 m-85 -130.09 132.92 24.4 Favored Pre-proline 0 C--N 1.297 -1.683 0 C-N-CA 124.935 1.294 . . . . 0.0 108.301 179.205 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 33.6 Cg_exo -58.84 -12.2 14.24 Favored 'Trans proline' 0 N--CA 1.497 1.733 0 C-N-CA 123.715 2.943 . . . . 0.0 113.135 -178.899 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 11.1 t70 . . . . . 0 C--O 1.241 0.61 0 C-N-CA 124.227 1.011 . . . . 0.0 109.305 175.419 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.437 -1.274 0 N-CA-C 110.811 -0.915 . . . . 0.0 110.811 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 2' ' ' ARG . . . . . 0.451 ' HE ' ' HB2' ' A' ' 14' ' ' ASP . 73.2 mtm180 -103.63 107.27 18.05 Favored 'General case' 0 C--N 1.313 -0.986 0 N-CA-C 109.899 -0.408 . . . . 0.0 109.899 -176.51 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -122.11 146.31 47.34 Favored 'General case' 0 C--N 1.3 -1.566 0 C-N-CA 123.325 0.65 . . . . 0.0 111.573 -179.538 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 97.5 m-85 -115.11 130.56 56.96 Favored 'General case' 0 C--N 1.301 -1.533 0 N-CA-C 108.674 -0.861 . . . . 0.0 108.674 174.758 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 2.6 mppt? -92.88 85.99 5.34 Favored 'General case' 0 N--CA 1.431 -1.384 0 N-CA-C 106.923 -1.51 . . . . 0.0 106.923 176.511 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 13.5 p -139.54 171.28 14.48 Favored 'General case' 0 C--N 1.285 -2.227 0 CA-C-N 114.139 -1.391 . . . . 0.0 108.572 -176.572 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 4.8 mptp? -113.5 108.7 51.75 Favored Pre-proline 0 C--N 1.309 -1.167 0 N-CA-C 109.211 -0.663 . . . . 0.0 109.211 174.207 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 1.3 Cg_endo -85.21 154.36 59.56 Favored 'Cis proline' 0 C--O 1.245 0.829 0 CA-C-N 119.643 0.908 . . . . 0.0 111.362 0.245 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 3.4 Cg_exo -72.63 124.5 9.83 Favored 'Trans proline' 0 N--CA 1.457 -0.623 0 C-N-CA 122.42 2.08 . . . . 0.0 111.87 -178.11 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 48.7 mm -106.75 130.35 58.8 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.212 0 N-CA-C 108.377 -0.971 . . . . 0.0 108.377 179.64 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -134.33 153.99 51.58 Favored 'General case' 0 CA--C 1.508 -0.667 0 CA-C-O 121.251 0.548 . . . . 0.0 110.667 -178.263 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 97.6 m-85 -125.11 131.77 24.16 Favored Pre-proline 0 C--N 1.291 -1.973 0 N-CA-C 106.918 -1.512 . . . . 0.0 106.918 175.098 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 31.3 Cg_exo -59.57 4.13 0.17 Allowed 'Trans proline' 0 N--CA 1.497 1.734 0 C-N-CA 124.444 3.43 . . . . 0.0 115.262 -174.944 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . 0.451 ' HB2' ' HE ' ' A' ' 2' ' ' ARG . 8.5 m-20 . . . . . 0 C--N 1.307 -1.281 0 N-CA-C 108.854 -0.795 . . . . 0.0 108.854 174.338 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.485 -1.784 0 N-CA-C 108.767 -1.733 . . . . 0.0 108.767 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 6.9 tpp180 -130.1 103.1 6.55 Favored 'General case' 0 N--CA 1.431 -1.389 0 N-CA-C 108.535 -0.913 . . . . 0.0 108.535 -174.93 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -108.99 133.83 52.45 Favored 'General case' 0 C--N 1.296 -1.732 0 CA-C-O 120.89 0.376 . . . . 0.0 111.816 -179.561 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 96.6 m-85 -119.15 103.76 9.82 Favored 'General case' 0 C--N 1.303 -1.418 0 N-CA-C 108.475 -0.935 . . . . 0.0 108.475 176.399 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 55.7 mtpt -87.05 76.15 9.38 Favored 'General case' 0 N--CA 1.426 -1.658 0 CA-C-O 122.503 1.144 . . . . 0.0 110.827 -178.71 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 56.8 m -150.09 170.77 18.12 Favored 'General case' 0 C--N 1.279 -2.491 0 N-CA-C 104.578 -2.378 . . . . 0.0 104.578 178.25 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 12.0 mptt -91.91 130.19 39.39 Favored Pre-proline 0 C--N 1.299 -1.63 0 CA-C-N 118.789 0.722 . . . . 0.0 110.837 -177.776 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 96.7 Cg_endo -82.66 150.6 71.12 Favored 'Cis proline' 0 C--O 1.245 0.873 0 C-N-CA 123.993 -1.253 . . . . 0.0 111.083 -4.954 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 28.2 Cg_exo -62.2 109.59 0.86 Allowed 'Trans proline' 0 C--N 1.354 0.83 0 C-N-CA 122.355 2.037 . . . . 0.0 111.207 -179.069 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 8.1 tp -118.36 122.53 69.78 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.755 0 CA-C-O 121.341 0.591 . . . . 0.0 110.262 -179.384 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -126.22 126.84 44.71 Favored 'General case' 0 N--CA 1.433 -1.316 0 CA-C-N 115.601 -0.727 . . . . 0.0 109.177 178.728 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 90.7 m-85 -97.69 132.69 24.57 Favored Pre-proline 0 C--N 1.282 -2.352 0 CA-C-N 114.956 -1.02 . . . . 0.0 109.494 -178.676 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 78.4 Cg_exo -49.68 -16.28 1.37 Allowed 'Trans proline' 0 N--CA 1.502 1.982 0 C-N-CA 124.743 3.629 . . . . 0.0 115.036 179.547 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 28.2 t70 . . . . . 0 N--CA 1.479 0.98 0 CA-C-O 121.818 0.818 . . . . 0.0 109.897 175.259 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.496 -1.137 0 N-CA-C 110.161 -1.176 . . . . 0.0 110.161 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 2' ' ' ARG . . . . . 0.48 ' HB3' ' HB2' ' A' ' 12' ' ' PHE . 24.4 ttm180 -132.72 135.07 45.54 Favored 'General case' 0 C--N 1.31 -1.128 0 N-CA-C 107.532 -1.284 . . . . 0.0 107.532 -175.125 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -148.81 134.66 18.95 Favored 'General case' 0 C--N 1.304 -1.406 0 CA-C-O 121.112 0.482 . . . . 0.0 112.005 -175.898 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 80.9 m-85 -90.24 154.59 19.62 Favored 'General case' 0 C--N 1.302 -1.462 0 CA-C-N 115.569 -0.741 . . . . 0.0 109.648 175.964 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 75.2 mmtt -102.87 -0.36 31.34 Favored 'General case' 0 C--N 1.316 -0.869 0 CA-C-O 121.522 0.677 . . . . 0.0 109.739 178.743 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 34.9 m -95.86 170.1 9.54 Favored 'General case' 0 C--N 1.308 -1.212 0 CA-C-N 115.527 -0.76 . . . . 0.0 110.19 179.208 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 35.4 mmtp -98.02 137.15 20.85 Favored Pre-proline 0 C--N 1.308 -1.23 0 N-CA-C 108.538 -0.912 . . . . 0.0 108.538 177.307 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 3.0 Cg_exo -77.83 156.26 95.08 Favored 'Cis proline' 0 C--O 1.251 1.148 0 C-N-CA 124.032 -1.236 . . . . 0.0 111.58 0.164 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 15.0 Cg_exo -66.67 92.11 0.3 Allowed 'Trans proline' 0 N--CA 1.452 -0.929 0 C-N-CA 122.411 2.074 . . . . 0.0 110.596 177.267 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 71.3 mt -98.37 118.22 44.56 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.665 0 CA-C-N 115.472 -0.786 . . . . 0.0 108.96 179.902 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -127.36 150.95 49.37 Favored 'General case' 0 N--CA 1.432 -1.355 0 N-CA-C 109.735 -0.468 . . . . 0.0 109.735 -179.25 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 12' ' ' PHE . . . . . 0.48 ' HB2' ' HB3' ' A' ' 2' ' ' ARG . 43.2 m-85 -117.82 132.86 23.45 Favored Pre-proline 0 C--N 1.296 -1.754 0 C-N-CA 124.413 1.085 . . . . 0.0 108.406 -179.242 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 37.1 Cg_exo -61.53 -2.74 2.8 Favored 'Trans proline' 0 N--CA 1.494 1.523 0 C-N-CA 123.871 3.047 . . . . 0.0 113.44 -178.527 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 33.6 t70 . . . . . 0 C--N 1.32 -0.697 0 C-N-CA 123.802 0.841 . . . . 0.0 109.035 174.0 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.432 -1.618 0 CA-C-O 119.771 -0.461 . . . . 0.0 113.43 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 2' ' ' ARG . . . . . 0.474 ' HG3' ' OD1' ' A' ' 14' ' ' ASP . 65.4 mtp180 -72.39 95.03 1.69 Allowed 'General case' 0 N--CA 1.464 0.256 0 N-CA-C 108.885 -0.783 . . . . 0.0 108.885 176.93 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -107.21 135.1 49.31 Favored 'General case' 0 C--N 1.299 -1.589 0 CA-C-O 121.132 0.492 . . . . 0.0 110.678 -178.927 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 97.2 m-85 -120.86 115.85 24.03 Favored 'General case' 0 C--N 1.293 -1.856 0 CA-C-N 115.168 -0.924 . . . . 0.0 109.552 179.023 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 98.0 mttt -83.06 83.74 7.73 Favored 'General case' 0 N--CA 1.43 -1.454 0 CA-C-O 122.325 1.06 . . . . 0.0 109.051 177.645 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 27.7 m -146.94 171.5 15.14 Favored 'General case' 0 C--N 1.282 -2.349 0 N-CA-C 105.573 -2.01 . . . . 0.0 105.573 -178.914 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 63.7 mttp -108.9 119.79 47.91 Favored Pre-proline 0 C--N 1.297 -1.68 0 CA-C-N 118.413 0.551 . . . . 0.0 110.642 177.434 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 88.0 Cg_endo -78.53 152.85 90.79 Favored 'Cis proline' 0 CA--C 1.545 1.069 0 C-N-CA 124.662 -0.974 . . . . 0.0 112.712 -2.084 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 37.5 Cg_endo -71.23 107.14 2.06 Favored 'Trans proline' 0 C--O 1.252 1.211 0 C-N-CA 122.504 2.136 . . . . 0.0 112.088 179.107 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 5.7 tp -100.89 128.89 52.6 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.317 0 CA-C-N 115.356 -0.838 . . . . 0.0 110.116 179.766 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . 0.43 ' HA ' ' O ' ' A' ' 2' ' ' ARG . . . -129.62 118.18 21.56 Favored 'General case' 0 N--CA 1.428 -1.565 0 N-CA-C 108.638 -0.875 . . . . 0.0 108.638 177.496 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 12' ' ' PHE . . . . . 0.453 ' HB2' ' HB2' ' A' ' 2' ' ' ARG . 91.0 m-85 -84.56 132.26 47.37 Favored Pre-proline 0 C--N 1.294 -1.835 0 N-CA-C 108.22 -1.03 . . . . 0.0 108.22 178.168 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 0.4 OUTLIER -25.24 -46.22 0.05 OUTLIER 'Trans proline' 0 C--N 1.356 0.971 1 C-N-CA 126.795 4.996 . . . . 0.0 118.343 -174.275 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . 0.474 ' OD1' ' HG3' ' A' ' 2' ' ' ARG . 5.7 p-10 . . . . . 0 N--CA 1.474 0.771 0 N-CA-C 111.693 0.257 . . . . 0.0 111.693 -176.344 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.486 -1.773 0 N-CA-C 108.995 -1.642 . . . . 0.0 108.995 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 2' ' ' ARG . . . . . 0.442 ' HB3' ' HB2' ' A' ' 12' ' ' PHE . 27.4 ttm180 -137.68 92.41 2.68 Favored 'General case' 0 N--CA 1.431 -1.399 0 N-CA-C 109.289 -0.634 . . . . 0.0 109.289 -175.168 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -109.3 134.46 51.76 Favored 'General case' 0 C--N 1.29 -2.009 0 CA-C-N 115.894 -0.594 . . . . 0.0 111.411 176.817 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 94.4 m-85 -106.61 151.29 25.24 Favored 'General case' 0 C--N 1.298 -1.637 0 CA-C-N 114.994 -1.003 . . . . 0.0 108.415 177.36 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 18.6 ptpt -93.01 -1.73 56.37 Favored 'General case' 0 C--N 1.312 -1.059 0 CA-C-O 121.696 0.76 . . . . 0.0 110.209 -179.223 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 23.5 m -81.66 167.18 19.46 Favored 'General case' 0 N--CA 1.429 -1.496 0 CA-C-N 115.051 -0.977 . . . . 0.0 110.283 179.672 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . 0.458 ' HA ' ' C ' ' A' ' 8' ' ' PRO . 20.0 ptmt -113.56 141.66 26.32 Favored Pre-proline 0 C--N 1.308 -1.222 0 CA-C-N 115.953 -0.567 . . . . 0.0 109.915 179.827 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . 0.458 ' C ' ' HA ' ' A' ' 7' ' ' LYS . 59.3 Cg_endo -68.56 165.45 72.83 Favored 'Cis proline' 0 N--CA 1.483 0.903 0 C-N-CA 124.17 -1.179 . . . . 0.0 112.007 1.394 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 16.1 Cg_exo -63.35 96.88 0.19 Allowed 'Trans proline' 0 C--N 1.354 0.823 0 C-N-CA 122.198 1.932 . . . . 0.0 112.04 179.873 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 10' ' ' ILE . . . . . 0.425 HG13 ' O ' ' A' ' 8' ' ' PRO . 72.8 mt -93.97 107.2 18.98 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.326 0 CA-C-N 115.33 -0.85 . . . . 0.0 109.093 179.281 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . 0.422 ' HA ' ' O ' ' A' ' 2' ' ' ARG . . . -132.41 132.44 42.8 Favored 'General case' 0 N--CA 1.441 -0.884 0 CA-C-O 121.343 0.592 . . . . 0.0 110.355 178.327 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 12' ' ' PHE . . . . . 0.442 ' HB2' ' HB3' ' A' ' 2' ' ' ARG . 87.8 m-85 -108.96 131.9 21.51 Favored Pre-proline 0 C--N 1.277 -2.556 0 N-CA-C 108.312 -0.995 . . . . 0.0 108.312 176.403 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 11.8 Cg_endo -58.36 -7.99 4.65 Favored 'Trans proline' 0 C--N 1.359 1.124 0 C-N-CA 123.529 2.819 . . . . 0.0 112.956 177.543 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 10.2 t70 . . . . . 0 C--N 1.322 -0.593 0 C-N-CA 123.589 0.756 . . . . 0.0 109.315 171.904 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.445 -0.701 0 N-CA-C 114.489 0.555 . . . . 0.0 114.489 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 2' ' ' ARG . . . . . 0.495 ' O ' ' HA ' ' A' ' 11' ' ' ALA . 26.9 mmm180 -125.09 98.81 5.83 Favored 'General case' 0 C--N 1.31 -1.115 0 CA-C-N 117.51 0.655 . . . . 0.0 110.667 178.592 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -108.08 134.73 50.54 Favored 'General case' 0 C--N 1.306 -1.314 0 N-CA-C 109.719 -0.474 . . . . 0.0 109.719 174.775 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 95.7 m-85 -114.08 125.78 54.35 Favored 'General case' 0 C--N 1.288 -2.098 0 N-CA-C 109.467 -0.568 . . . . 0.0 109.467 178.46 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -72.44 -20.72 61.36 Favored 'General case' 0 C--N 1.316 -0.87 0 O-C-N 123.878 0.736 . . . . 0.0 111.276 -179.694 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 60.6 m -73.86 135.59 43.4 Favored 'General case' 0 N--CA 1.433 -1.292 0 CA-C-O 120.757 0.313 . . . . 0.0 110.24 178.854 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 8.4 mtmp? -82.32 141.3 45.84 Favored Pre-proline 0 C--N 1.313 -1.021 0 CA-C-N 115.756 -0.656 . . . . 0.0 110.926 -175.686 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 14.2 Cg_exo -72.46 132.09 24.61 Favored 'Cis proline' 0 C--O 1.242 0.688 0 C-N-CA 123.776 -1.343 . . . . 0.0 110.902 -1.692 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 22.5 Cg_exo -65.68 110.45 1.66 Allowed 'Trans proline' 0 N--CA 1.456 -0.694 0 C-N-CA 122.239 1.959 . . . . 0.0 111.296 -178.761 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 6.6 tp -104.68 127.34 59.19 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.736 0 N-CA-C 108.788 -0.819 . . . . 0.0 108.788 178.856 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . 0.495 ' HA ' ' O ' ' A' ' 2' ' ' ARG . . . -122.58 121.41 36.41 Favored 'General case' 0 N--CA 1.429 -1.489 0 CA-C-N 115.981 -0.554 . . . . 0.0 109.854 -179.731 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 86.6 m-85 -94.19 131.65 31.0 Favored Pre-proline 0 C--N 1.282 -2.339 0 CA-C-N 114.996 -1.002 . . . . 0.0 108.451 178.605 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 63.5 Cg_exo -54.97 -13.3 6.15 Favored 'Trans proline' 0 N--CA 1.494 1.522 0 C-N-CA 124.344 3.362 . . . . 0.0 114.673 -177.852 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 5.2 p-10 . . . . . 0 C--N 1.315 -0.899 0 O-C-N 122.098 -0.376 . . . . 0.0 111.779 178.05 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.433 -1.557 0 N-CA-C 110.776 -0.93 . . . . 0.0 110.776 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 2' ' ' ARG . . . . . 0.52 ' O ' ' HA ' ' A' ' 11' ' ' ALA . 20.3 mmm180 -123.64 97.19 5.27 Favored 'General case' 0 C--N 1.311 -1.081 0 N-CA-C 110.171 -0.307 . . . . 0.0 110.171 -177.646 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -107.2 134.64 49.99 Favored 'General case' 0 C--N 1.293 -1.857 0 CA-C-O 121.116 0.484 . . . . 0.0 110.048 177.507 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 88.9 m-85 -118.93 126.75 52.49 Favored 'General case' 0 C--N 1.302 -1.459 0 CA-C-N 115.444 -0.798 . . . . 0.0 109.303 -179.492 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 54.1 mtmt -88.91 82.91 6.64 Favored 'General case' 0 C--N 1.3 -1.555 0 CA-C-O 121.966 0.889 . . . . 0.0 112.157 -175.163 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 49.8 m -150.49 170.32 19.38 Favored 'General case' 0 C--N 1.292 -1.923 0 N-CA-C 105.938 -1.875 . . . . 0.0 105.938 175.93 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 28.7 mtpp -113.27 125.48 29.62 Favored Pre-proline 0 C--N 1.303 -1.42 0 N-CA-C 108.891 -0.781 . . . . 0.0 108.891 176.951 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 5.6 Cg_exo -75.11 147.08 88.24 Favored 'Cis proline' 0 C--O 1.246 0.922 0 C-N-CA 124.304 -1.123 . . . . 0.0 111.898 0.406 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 36.1 Cg_endo -67.41 114.45 3.27 Favored 'Trans proline' 0 N--CA 1.455 -0.773 0 C-N-CA 122.556 2.17 . . . . 0.0 111.702 179.095 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 51.0 mm -99.5 117.61 44.9 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.512 0 N-CA-C 108.683 -0.858 . . . . 0.0 108.683 -179.956 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . 0.52 ' HA ' ' O ' ' A' ' 2' ' ' ARG . . . -128.2 128.42 44.72 Favored 'General case' 0 N--CA 1.441 -0.888 0 N-CA-C 109.496 -0.557 . . . . 0.0 109.496 178.787 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 12' ' ' PHE . . . . . 0.407 ' HB2' ' HB2' ' A' ' 2' ' ' ARG . 98.1 m-85 -99.35 131.67 24.66 Favored Pre-proline 0 C--N 1.289 -2.058 0 N-CA-C 108.75 -0.833 . . . . 0.0 108.75 177.072 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 82.5 Cg_exo -50.31 -15.91 1.69 Allowed 'Trans proline' 0 N--CA 1.497 1.716 0 C-N-CA 124.949 3.766 . . . . 0.0 116.113 -176.68 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 24.5 t70 . . . . . 0 N--CA 1.474 0.749 0 CA-C-O 121.351 0.595 . . . . 0.0 110.212 175.483 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.435 -1.389 0 N-CA-C 109.575 -1.41 . . . . 0.0 109.575 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 38.7 ttm180 -150.98 120.08 6.73 Favored 'General case' 0 C--N 1.303 -1.439 0 N-CA-C 108.744 -0.836 . . . . 0.0 108.744 -175.969 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -129.76 135.49 48.51 Favored 'General case' 0 C--N 1.305 -1.365 0 CA-C-O 121.066 0.46 . . . . 0.0 110.885 -178.734 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 56.7 m-85 -89.18 115.97 27.09 Favored 'General case' 0 C--N 1.297 -1.715 0 CA-C-N 115.321 -0.854 . . . . 0.0 108.793 176.243 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 95.2 mttt -82.04 72.06 9.09 Favored 'General case' 0 C--N 1.317 -0.806 0 CA-C-O 121.76 0.79 . . . . 0.0 110.034 -179.171 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 26.9 m -146.56 166.66 25.82 Favored 'General case' 0 C--N 1.29 -2.011 0 N-CA-C 106.627 -1.62 . . . . 0.0 106.627 179.858 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 28.1 mtpp -114.11 116.36 44.72 Favored Pre-proline 0 C--N 1.291 -1.944 0 N-CA-C 108.949 -0.76 . . . . 0.0 108.949 175.849 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 3.2 Cg_exo -81.87 147.48 68.31 Favored 'Cis proline' 0 CA--C 1.541 0.861 0 C-N-CA 124.813 -0.911 . . . . 0.0 112.987 2.755 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 74.1 Cg_endo -82.47 126.94 4.91 Favored 'Trans proline' 0 N--CA 1.447 -1.211 0 C-N-CA 122.467 2.111 . . . . 0.0 112.887 -179.214 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 68.4 mt -102.92 130.46 52.98 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.796 0 N-CA-C 107.289 -1.375 . . . . 0.0 107.289 175.898 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -127.22 153.94 45.47 Favored 'General case' 0 C--N 1.311 -1.087 0 N-CA-C 109.555 -0.535 . . . . 0.0 109.555 179.46 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 89.9 m-85 -124.47 131.73 24.21 Favored Pre-proline 0 C--N 1.295 -1.762 0 CA-C-N 115.627 -0.715 . . . . 0.0 109.324 178.496 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 77.9 Cg_exo -46.5 -19.49 0.7 Allowed 'Trans proline' 0 N--CA 1.501 1.915 1 C-N-CA 125.372 4.048 . . . . 0.0 115.858 -177.565 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 32.1 t70 . . . . . 0 C--N 1.319 -0.753 0 CA-C-O 121.162 0.506 . . . . 0.0 110.765 177.335 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.435 -1.379 0 N-CA-C 112.094 -0.402 . . . . 0.0 112.094 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 33.4 ttm180 -143.9 128.09 17.68 Favored 'General case' 0 C--N 1.312 -1.051 0 N-CA-C 109.101 -0.703 . . . . 0.0 109.101 179.146 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -120.91 135.52 55.17 Favored 'General case' 0 C--N 1.293 -1.857 0 CA-C-O 120.487 0.184 . . . . 0.0 111.297 178.78 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 96.8 m-85 -101.52 118.78 37.65 Favored 'General case' 0 C--N 1.306 -1.303 0 N-CA-C 108.838 -0.801 . . . . 0.0 108.838 175.716 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 30.2 mmmt -88.18 72.1 9.14 Favored 'General case' 0 N--CA 1.427 -1.595 0 CA-C-O 122.589 1.185 . . . . 0.0 110.913 179.188 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 35.0 m -151.07 170.87 18.34 Favored 'General case' 0 C--N 1.293 -1.852 0 CA-C-N 113.308 -1.769 . . . . 0.0 106.324 178.795 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 19.7 ptpt -98.51 135.65 21.07 Favored Pre-proline 0 C--N 1.295 -1.798 0 N-CA-C 107.406 -1.331 . . . . 0.0 107.406 170.949 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 74.3 Cg_endo -81.25 160.56 82.0 Favored 'Cis proline' 0 CA--C 1.54 0.8 0 C-N-CA 123.533 -1.444 . . . . 0.0 111.277 0.473 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 33.6 Cg_endo -66.41 95.43 0.32 Allowed 'Trans proline' 0 N--CA 1.452 -0.917 0 C-N-CA 121.909 1.739 . . . . 0.0 111.202 177.927 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 49.7 mm -106.72 115.21 47.76 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.46 0 N-CA-C 108.487 -0.931 . . . . 0.0 108.487 179.633 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -125.89 138.97 53.83 Favored 'General case' 0 C--N 1.295 -1.792 0 N-CA-C 107.447 -1.316 . . . . 0.0 107.447 178.196 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 22.2 m-30 -96.11 131.97 27.78 Favored Pre-proline 0 C--N 1.288 -2.077 0 N-CA-C 108.758 -0.83 . . . . 0.0 108.758 179.841 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 13.7 Cg_endo -57.92 -10.77 8.29 Favored 'Trans proline' 0 C--N 1.356 0.925 0 C-N-CA 123.84 3.026 . . . . 0.0 113.704 -179.032 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 24.4 t70 . . . . . 0 C--N 1.317 -0.812 0 CA-C-O 121.446 0.641 . . . . 0.0 110.123 174.754 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.44 -1.074 0 N-CA-C 111.986 -0.446 . . . . 0.0 111.986 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 21.4 ttm180 -115.94 114.03 24.1 Favored 'General case' 0 C--N 1.316 -0.862 0 C-N-CA 120.713 -0.395 . . . . 0.0 110.053 -178.869 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -108.25 135.51 49.45 Favored 'General case' 0 C--N 1.304 -1.379 0 C-N-CA 123.169 0.587 . . . . 0.0 111.694 -178.542 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 12.1 m-85 -89.81 122.14 32.61 Favored 'General case' 0 C--N 1.301 -1.523 0 N-CA-C 108.641 -0.874 . . . . 0.0 108.641 173.43 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . 0.478 ' HD2' ' N ' ' A' ' 5' ' ' LYS . 0.1 OUTLIER -84.0 -22.61 31.31 Favored 'General case' 0 C--N 1.303 -1.425 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.058 -177.218 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 41.4 m -84.5 141.73 30.54 Favored 'General case' 0 N--CA 1.43 -1.464 0 N-CA-C 109.081 -0.711 . . . . 0.0 109.081 176.245 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 38.1 ttpt -67.82 138.98 93.21 Favored Pre-proline 0 C--N 1.308 -1.214 0 C-N-CA 123.504 0.722 . . . . 0.0 109.407 178.581 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 74.3 Cg_endo -77.15 134.22 34.36 Favored 'Cis proline' 0 C--N 1.351 0.671 0 C-N-CA 123.882 -1.299 . . . . 0.0 111.566 -0.965 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 21.9 Cg_exo -65.58 105.1 0.72 Allowed 'Trans proline' 0 N--CA 1.457 -0.655 0 C-N-CA 122.017 1.811 . . . . 0.0 111.081 179.916 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 67.8 mt -108.58 128.26 64.38 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.554 0 N-CA-C 107.725 -1.213 . . . . 0.0 107.725 178.207 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -123.09 112.51 17.83 Favored 'General case' 0 N--CA 1.433 -1.278 0 CA-C-O 121.249 0.547 . . . . 0.0 109.764 -179.808 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 92.6 m-85 -79.5 132.1 63.03 Favored Pre-proline 0 C--N 1.289 -2.025 0 CA-C-N 115.039 -0.982 . . . . 0.0 109.487 -179.962 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 84.5 Cg_exo -48.8 -21.32 3.54 Favored 'Trans proline' 0 N--CA 1.495 1.575 0 C-N-CA 124.696 3.597 . . . . 0.0 114.65 -177.2 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 19.2 t70 . . . . . 0 N--CA 1.469 0.486 0 C-N-CA 123.14 0.576 . . . . 0.0 110.376 177.345 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.436 -1.366 0 N-CA-C 111.542 -0.623 . . . . 0.0 111.542 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 2' ' ' ARG . . . . . 0.49 ' O ' ' HA ' ' A' ' 11' ' ' ALA . 78.5 mtp180 -117.83 102.35 9.03 Favored 'General case' 0 C--N 1.313 -0.995 0 O-C-N 122.568 -0.372 . . . . 0.0 110.521 -179.019 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -107.9 134.56 50.65 Favored 'General case' 0 C--N 1.3 -1.55 0 CA-C-N 115.634 -0.712 . . . . 0.0 109.195 179.002 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 62.9 m-85 -103.75 154.55 19.44 Favored 'General case' 0 C--N 1.295 -1.79 0 CA-C-N 115.726 -0.67 . . . . 0.0 110.936 179.749 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -88.19 -27.66 21.68 Favored 'General case' 0 C--N 1.313 -0.991 0 N-CA-C 108.615 -0.883 . . . . 0.0 108.615 -178.467 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 11.8 p -62.79 135.53 57.39 Favored 'General case' 0 N--CA 1.433 -1.283 0 CA-C-N 115.093 -0.958 . . . . 0.0 111.021 -179.572 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 96.6 mttt -90.97 139.67 25.94 Favored Pre-proline 0 C--N 1.309 -1.164 0 N-CA-C 110.164 -0.31 . . . . 0.0 110.164 -178.66 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 57.1 Cg_endo -73.16 133.11 29.04 Favored 'Cis proline' 0 C--O 1.245 0.855 0 C-N-CA 123.73 -1.363 . . . . 0.0 110.948 -3.005 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 22.1 Cg_exo -65.65 115.21 3.26 Favored 'Trans proline' 0 N--CA 1.453 -0.861 0 C-N-CA 122.053 1.835 . . . . 0.0 111.636 -178.231 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 7.9 tp -97.9 136.3 29.27 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.741 0 N-CA-C 107.815 -1.18 . . . . 0.0 107.815 177.212 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . 0.49 ' HA ' ' O ' ' A' ' 2' ' ' ARG . . . -123.74 112.37 17.26 Favored 'General case' 0 N--CA 1.436 -1.163 0 N-CA-C 109.333 -0.617 . . . . 0.0 109.333 177.527 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 93.9 m-85 -79.48 132.57 61.7 Favored Pre-proline 0 C--N 1.294 -1.816 0 N-CA-C 108.341 -0.985 . . . . 0.0 108.341 178.55 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 8.5 Cg_endo -48.3 -21.17 2.85 Favored 'Trans proline' 0 N--CA 1.496 1.649 0 C-N-CA 124.975 3.784 . . . . 0.0 115.561 -175.558 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 34.0 t70 . . . . . 0 N--CA 1.473 0.715 0 CA-C-O 121.668 0.747 . . . . 0.0 110.375 177.908 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.436 -1.305 0 CA-C-O 120.242 -0.199 . . . . 0.0 112.695 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 71.6 ttt180 -152.64 129.88 11.24 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 116.79 0.295 . . . . 0.0 110.252 177.843 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -130.56 134.71 47.24 Favored 'General case' 0 C--N 1.305 -1.345 0 C-N-CA 123.078 0.551 . . . . 0.0 111.298 178.711 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 58.7 m-85 -92.77 137.85 32.0 Favored 'General case' 0 C--N 1.31 -1.144 0 CA-C-N 115.908 -0.587 . . . . 0.0 110.151 177.047 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 75.7 mmtt -88.53 -43.94 11.04 Favored 'General case' 0 C--N 1.303 -1.445 0 N-CA-C 109.094 -0.706 . . . . 0.0 109.094 179.322 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 37.5 m -79.9 155.78 27.6 Favored 'General case' 0 N--CA 1.437 -1.084 0 CA-C-N 115.42 -0.809 . . . . 0.0 110.502 179.74 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 53.0 mtmt -79.74 136.88 54.74 Favored Pre-proline 0 C--N 1.313 -1.019 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.144 -178.238 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 78.1 Cg_endo -75.28 127.81 15.24 Favored 'Cis proline' 0 CA--C 1.54 0.822 0 C-N-CA 123.988 -1.255 . . . . 0.0 112.84 2.774 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 3.4 Cg_exo -79.44 87.69 1.52 Allowed 'Trans proline' 0 N--CA 1.436 -1.896 0 C-N-CA 121.748 1.632 . . . . 0.0 109.79 178.574 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 13.3 tt -105.61 140.15 24.57 Favored 'Isoleucine or valine' 0 C--N 1.291 -1.964 0 N-CA-C 108.57 -0.9 . . . . 0.0 108.57 179.029 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -118.15 145.49 44.88 Favored 'General case' 0 N--CA 1.422 -1.861 0 N-CA-C 108.41 -0.959 . . . . 0.0 108.41 178.955 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 48.0 m-85 -110.12 131.7 21.85 Favored Pre-proline 0 C--N 1.276 -2.588 0 N-CA-C 108.038 -1.097 . . . . 0.0 108.038 178.487 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 37.2 Cg_endo -65.87 3.17 1.31 Allowed 'Trans proline' 0 N--CA 1.486 1.033 0 C-N-CA 123.592 2.861 . . . . 0.0 112.716 -179.969 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 51.3 m-20 . . . . . 0 C--N 1.321 -0.667 0 N-CA-C 108.993 -0.743 . . . . 0.0 108.993 176.827 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.433 -1.524 0 N-CA-C 111.212 -0.755 . . . . 0.0 111.212 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 4.4 tpp180 -143.34 105.24 4.36 Favored 'General case' 0 C--N 1.31 -1.119 0 N-CA-C 109.781 -0.451 . . . . 0.0 109.781 179.236 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -108.14 135.26 49.78 Favored 'General case' 0 C--N 1.294 -1.823 0 CA-C-N 115.868 -0.606 . . . . 0.0 110.286 179.003 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 47.0 m-85 -98.16 139.68 33.6 Favored 'General case' 0 C--N 1.298 -1.654 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.66 178.561 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 18.8 ptmt -94.44 12.4 27.32 Favored 'General case' 0 C--N 1.309 -1.188 0 CA-C-O 122.006 0.908 . . . . 0.0 109.702 -179.955 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 41.5 m -75.75 171.02 15.08 Favored 'General case' 0 C--N 1.308 -1.219 0 CA-C-N 114.185 -1.371 . . . . 0.0 109.734 176.097 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 24.1 ttmm -108.15 118.24 53.0 Favored Pre-proline 0 C--N 1.304 -1.373 0 N-CA-C 109.673 -0.492 . . . . 0.0 109.673 177.581 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 93.7 Cg_endo -83.49 159.54 73.03 Favored 'Cis proline' 0 C--O 1.243 0.771 0 C-N-CA 124.327 -1.114 . . . . 0.0 111.218 -2.469 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 28.8 Cg_endo -67.41 104.43 0.91 Allowed 'Trans proline' 0 N--CA 1.451 -1.012 0 C-N-CA 121.818 1.679 . . . . 0.0 111.56 178.905 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 7.6 tp -100.72 138.61 24.41 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.284 0 N-CA-C 108.185 -1.042 . . . . 0.0 108.185 176.891 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -128.65 150.39 50.25 Favored 'General case' 0 N--CA 1.43 -1.433 0 N-CA-C 109.311 -0.626 . . . . 0.0 109.311 -177.797 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 90.3 m-85 -107.94 132.05 21.31 Favored Pre-proline 0 C--N 1.288 -2.075 0 N-CA-C 107.414 -1.328 . . . . 0.0 107.414 174.548 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 21.1 Cg_endo -61.34 -5.68 5.66 Favored 'Trans proline' 0 N--CA 1.485 0.988 0 C-N-CA 123.73 2.953 . . . . 0.0 114.501 -175.758 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 8.7 m-20 . . . . . 0 C--N 1.309 -1.169 0 CA-C-N 116.109 -0.496 . . . . 0.0 109.749 175.087 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.438 -1.199 0 N-CA-C 111.698 -0.561 . . . . 0.0 111.698 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 2' ' ' ARG . . . . . 0.428 ' HB2' ' HB2' ' A' ' 12' ' ' PHE . 95.7 mtt180 -132.53 93.58 3.26 Favored 'General case' 0 C--N 1.317 -0.837 0 CA-C-O 120.92 0.39 . . . . 0.0 110.828 -179.109 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -107.89 137.2 46.3 Favored 'General case' 0 C--N 1.294 -1.834 0 CA-C-N 115.417 -0.811 . . . . 0.0 110.412 177.056 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 53.6 m-85 -115.47 126.2 54.02 Favored 'General case' 0 C--N 1.295 -1.778 0 N-CA-C 107.65 -1.241 . . . . 0.0 107.65 178.944 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -83.66 70.4 10.31 Favored 'General case' 0 C--N 1.309 -1.191 0 CA-C-O 122.751 1.263 . . . . 0.0 111.221 -177.362 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 53.7 m -148.33 158.08 43.88 Favored 'General case' 0 C--N 1.301 -1.505 0 CA-C-N 114.634 -1.166 . . . . 0.0 108.295 179.422 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . 0.42 ' HA ' ' C ' ' A' ' 8' ' ' PRO . 7.8 ptpp? -112.95 133.62 21.95 Favored Pre-proline 0 C--N 1.31 -1.123 0 N-CA-C 110.05 -0.352 . . . . 0.0 110.05 179.474 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . 0.42 ' C ' ' HA ' ' A' ' 7' ' ' LYS . 12.8 Cg_exo -69.05 138.11 45.56 Favored 'Cis proline' 0 C--N 1.356 0.969 0 C-N-CA 124.334 -1.111 . . . . 0.0 111.814 1.42 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 35.3 Cg_endo -66.01 121.47 8.8 Favored 'Trans proline' 0 C--O 1.24 0.613 0 C-N-CA 122.655 2.236 . . . . 0.0 112.537 -177.163 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 48.6 mm -110.24 121.74 63.59 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.618 0 N-CA-C 107.808 -1.182 . . . . 0.0 107.808 178.564 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -134.29 120.54 20.07 Favored 'General case' 0 CA--C 1.491 -1.327 0 N-CA-C 109.609 -0.515 . . . . 0.0 109.609 179.765 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 12' ' ' PHE . . . . . 0.428 ' HB2' ' HB2' ' A' ' 2' ' ' ARG . 99.9 m-85 -90.47 128.25 49.65 Favored Pre-proline 0 C--N 1.288 -2.07 0 N-CA-C 107.411 -1.329 . . . . 0.0 107.411 175.082 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 12.5 Cg_endo -53.8 -20.43 17.37 Favored 'Trans proline' 0 N--CA 1.484 0.927 0 C-N-CA 124.307 3.338 . . . . 0.0 114.593 -172.627 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 17.5 m-20 . . . . . 0 C--N 1.316 -0.866 0 C-N-CA 123.303 0.641 . . . . 0.0 111.73 -179.091 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.436 -1.36 0 N-CA-C 110.682 -0.967 . . . . 0.0 110.682 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . 0.47 ' O ' ' HA ' ' A' ' 11' ' ' ALA . 26.7 mtt180 -124.26 93.65 3.98 Favored 'General case' 0 C--N 1.315 -0.917 0 N-CA-C 108.268 -1.012 . . . . 0.0 108.268 -178.958 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -108.1 134.76 50.52 Favored 'General case' 0 C--N 1.293 -1.872 0 CA-C-O 120.999 0.428 . . . . 0.0 110.959 178.091 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' TYR . . . . . 0.46 ' HD1' ' O ' ' A' ' 10' ' ' ILE . 96.3 m-85 -104.05 142.42 34.48 Favored 'General case' 0 C--N 1.302 -1.463 0 CA-C-N 115.536 -0.757 . . . . 0.0 110.218 -179.698 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 12.8 mptt -82.63 -30.08 29.67 Favored 'General case' 0 C--O 1.246 0.891 0 CA-C-N 115.852 -0.613 . . . . 0.0 111.549 -177.23 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 10.6 m -66.24 155.28 37.56 Favored 'General case' 0 N--CA 1.442 -0.862 0 CA-C-N 115.587 -0.733 . . . . 0.0 110.237 -178.589 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . 0.441 ' HD2' ' N ' ' A' ' 7' ' ' LYS . 3.5 mptp? -104.56 135.39 19.32 Favored Pre-proline 0 N--CA 1.437 -1.121 0 N-CA-C 109.183 -0.673 . . . . 0.0 109.183 179.294 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 67.2 Cg_endo -70.54 136.15 38.99 Favored 'Cis proline' 0 N--CA 1.484 0.912 0 C-N-CA 124.373 -1.094 . . . . 0.0 112.374 1.384 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 42.9 Cg_endo -71.68 107.32 2.16 Favored 'Trans proline' 0 N--CA 1.447 -1.207 0 C-N-CA 122.049 1.833 . . . . 0.0 111.52 179.63 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' ILE . . . . . 0.46 ' O ' ' HD1' ' A' ' 4' ' ' TYR . 50.6 mm -93.7 129.69 43.73 Favored 'Isoleucine or valine' 0 C--N 1.291 -1.952 0 N-CA-C 108.35 -0.981 . . . . 0.0 108.35 179.616 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . 0.47 ' HA ' ' O ' ' A' ' 2' ' ' ARG . . . -126.8 126.52 43.53 Favored 'General case' 0 N--CA 1.434 -1.249 0 N-CA-C 109.582 -0.525 . . . . 0.0 109.582 177.702 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 74.6 m-85 -98.66 132.19 24.42 Favored Pre-proline 0 C--N 1.291 -1.956 0 N-CA-C 107.181 -1.414 . . . . 0.0 107.181 175.809 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 26.5 Cg_endo -57.67 -8.98 4.77 Favored 'Trans proline' 0 N--CA 1.485 1.002 0 C-N-CA 124.169 3.246 . . . . 0.0 115.064 -173.035 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 45.3 m-20 . . . . . 0 C--N 1.319 -0.742 0 CA-C-O 120.729 0.3 . . . . 0.0 110.308 178.131 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 101' ' ' WMH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.434 -1.483 0 N-CA-C 112.664 -0.175 . . . . 0.0 112.664 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 73.8 mtm180 -134.97 102.78 5.34 Favored 'General case' 0 C--N 1.305 -1.363 0 N-CA-C 109.968 -0.382 . . . . 0.0 109.968 177.634 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -118.49 134.41 55.1 Favored 'General case' 0 C--N 1.287 -2.151 0 CA-C-N 115.802 -0.635 . . . . 0.0 111.44 178.764 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 92.2 m-85 -88.25 122.18 31.49 Favored 'General case' 0 N--CA 1.421 -1.881 0 N-CA-C 106.263 -1.755 . . . . 0.0 106.263 171.92 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . 0.481 ' HZ1' ' HB2' ' A' ' 5' ' ' LYS . 10.5 mtmp? -80.94 -5.63 57.71 Favored 'General case' 0 C--N 1.311 -1.098 0 CA-C-O 121.237 0.541 . . . . 0.0 111.106 -176.314 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 11.5 p -83.95 148.33 26.97 Favored 'General case' 0 N--CA 1.425 -1.717 0 CA-C-N 115.423 -0.808 . . . . 0.0 109.361 175.977 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 55.3 mtpt -97.7 141.34 22.84 Favored Pre-proline 0 C--N 1.304 -1.385 0 N-CA-C 108.071 -1.085 . . . . 0.0 108.071 177.248 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 24.7 Cg_exo -66.74 140.54 50.5 Favored 'Cis proline' 0 N--CA 1.486 1.039 0 CA-C-N 119.813 0.969 . . . . 0.0 113.435 2.11 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 57.6 Cg_endo -70.73 109.25 2.45 Favored 'Trans proline' 0 C--O 1.244 0.78 0 C-N-CA 123.251 2.634 . . . . 0.0 113.542 -177.837 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 64.1 mt -109.09 122.29 63.52 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.346 0 N-CA-C 107.659 -1.238 . . . . 0.0 107.659 175.87 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -133.52 154.04 51.15 Favored 'General case' 0 C--N 1.317 -0.819 0 CA-C-O 121.175 0.512 . . . . 0.0 110.926 -177.307 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 99.8 m-85 -121.63 131.36 24.46 Favored Pre-proline 0 C--N 1.297 -1.698 0 N-CA-C 107.052 -1.462 . . . . 0.0 107.052 173.916 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 37.5 Cg_exo -58.83 -12.66 15.53 Favored 'Trans proline' 0 N--CA 1.489 1.215 0 C-N-CA 123.965 3.11 . . . . 0.0 115.188 -174.514 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 5.8 p-10 . . . . . 0 C--N 1.318 -0.77 0 CA-C-O 120.93 0.395 . . . . 0.0 110.832 178.203 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 101' ' ' WMH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.492 -1.403 0 N-CA-C 110.424 -1.071 . . . . 0.0 110.424 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 82.0 mtt180 -128.61 100.62 5.82 Favored 'General case' 0 C--N 1.315 -0.913 0 N-CA-C 108.379 -0.971 . . . . 0.0 108.379 -178.8 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -110.71 135.5 51.22 Favored 'General case' 0 C--N 1.29 -1.985 0 CA-C-N 116.351 -0.386 . . . . 0.0 111.12 -179.428 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' TYR . . . . . 0.474 ' HD1' ' O ' ' A' ' 10' ' ' ILE . 94.8 m-85 -88.91 141.16 28.73 Favored 'General case' 0 C--N 1.301 -1.533 0 CA-C-N 115.92 -0.582 . . . . 0.0 109.568 176.325 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 66.2 mttm -92.54 -42.1 9.88 Favored 'General case' 0 C--N 1.3 -1.564 0 N-CA-C 108.895 -0.78 . . . . 0.0 108.895 -179.106 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 24.9 m -65.42 127.13 30.54 Favored 'General case' 0 N--CA 1.424 -1.725 0 N-CA-C 108.668 -0.864 . . . . 0.0 108.668 176.867 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 42.7 mmtm -75.12 146.07 81.52 Favored Pre-proline 0 C--N 1.306 -1.302 0 CA-C-N 115.741 -0.663 . . . . 0.0 110.643 -173.773 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 56.7 Cg_endo -71.29 144.33 79.21 Favored 'Cis proline' 0 C--N 1.352 0.711 0 C-N-CA 123.979 -1.259 . . . . 0.0 112.729 1.63 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 55.4 Cg_endo -73.16 96.03 0.86 Allowed 'Trans proline' 0 N--CA 1.446 -1.3 0 C-N-CA 122.22 1.947 . . . . 0.0 111.574 -179.178 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' ILE . . . . . 0.474 ' O ' ' HD1' ' A' ' 4' ' ' TYR . 50.4 mm -92.32 134.4 30.58 Favored 'Isoleucine or valine' 0 C--N 1.294 -1.814 0 N-CA-C 106.642 -1.614 . . . . 0.0 106.642 177.64 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -130.98 144.32 51.39 Favored 'General case' 0 C--N 1.303 -1.434 0 C-N-CA 119.925 -0.71 . . . . 0.0 109.323 179.081 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 80.1 m-85 -109.46 129.54 23.79 Favored Pre-proline 0 C--N 1.288 -2.093 0 N-CA-C 107.311 -1.366 . . . . 0.0 107.311 173.264 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 3.4 Cg_exo -49.18 -17.06 1.22 Allowed 'Trans proline' 0 C--N 1.361 1.226 0 C-N-CA 124.522 3.481 . . . . 0.0 114.689 179.599 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 25.5 t70 . . . . . 0 C--N 1.318 -0.763 0 CA-C-O 121.672 0.749 . . . . 0.0 110.569 175.703 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 101' ' ' WMH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.431 -1.658 0 N-CA-C 109.804 -1.319 . . . . 0.0 109.804 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . 0.434 ' HB3' ' HB2' ' A' ' 12' ' ' PHE . 9.6 ttm180 -135.76 98.28 3.87 Favored 'General case' 0 N--CA 1.431 -1.378 0 N-CA-C 109.57 -0.53 . . . . 0.0 109.57 -177.67 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -107.56 134.99 49.77 Favored 'General case' 0 C--N 1.289 -2.058 0 CA-C-O 121.639 0.733 . . . . 0.0 112.001 179.839 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 66.9 m-85 -101.18 105.49 16.63 Favored 'General case' 0 C--N 1.287 -2.121 0 N-CA-C 107.182 -1.414 . . . . 0.0 107.182 172.137 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 56.5 mtmt -86.1 -7.29 58.7 Favored 'General case' 0 C--N 1.31 -1.109 0 CA-C-N 115.36 -0.836 . . . . 0.0 109.945 -178.652 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 14.9 m -85.88 168.15 14.48 Favored 'General case' 0 N--CA 1.432 -1.364 0 N-CA-C 106.052 -1.833 . . . . 0.0 106.052 171.931 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 18.2 ptpt -95.44 146.34 31.14 Favored Pre-proline 0 C--N 1.301 -1.534 0 C-N-CA 118.998 -1.081 . . . . 0.0 111.262 -179.601 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 6.0 Cg_exo -76.58 138.88 56.87 Favored 'Cis proline' 0 C--N 1.349 0.596 0 C-N-CA 124.045 -1.231 . . . . 0.0 112.235 0.531 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 32.4 Cg_endo -65.74 114.96 3.15 Favored 'Trans proline' 0 C--O 1.239 0.546 0 C-N-CA 122.489 2.126 . . . . 0.0 111.441 -179.896 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 7.3 tp -142.29 132.58 24.08 Favored 'Isoleucine or valine' 0 C--N 1.293 -1.871 0 N-CA-C 108.529 -0.915 . . . . 0.0 108.529 179.219 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -124.23 123.2 39.73 Favored 'General case' 0 N--CA 1.434 -1.267 0 CA-C-O 121.333 0.587 . . . . 0.0 110.006 -178.858 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . 0.434 ' HB2' ' HB3' ' A' ' 2' ' ' ARG . 82.6 m-85 -95.69 132.3 27.65 Favored Pre-proline 0 C--N 1.282 -2.349 0 N-CA-C 108.282 -1.007 . . . . 0.0 108.282 -179.877 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 25.6 Cg_exo -60.91 9.33 0.08 OUTLIER 'Trans proline' 0 N--CA 1.491 1.335 0 C-N-CA 124.497 3.464 . . . . 0.0 116.112 -174.047 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 6.7 p-10 . . . . . 0 C--N 1.3 -1.573 0 N-CA-C 108.82 -0.807 . . . . 0.0 108.82 176.48 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 101' ' ' WMH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.44 -1.082 0 N-CA-C 110.856 -0.898 . . . . 0.0 110.856 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 90.7 mtt180 -110.19 97.54 7.0 Favored 'General case' 0 C--N 1.315 -0.912 0 N-CA-C 109.329 -0.619 . . . . 0.0 109.329 -177.744 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -108.59 135.28 50.11 Favored 'General case' 0 C--N 1.303 -1.437 0 CA-C-N 115.356 -0.838 . . . . 0.0 112.862 -179.437 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 55.8 m-85 -92.22 151.93 20.1 Favored 'General case' 0 C--N 1.3 -1.548 0 CA-C-N 114.684 -1.144 . . . . 0.0 109.109 173.718 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -101.95 -1.48 31.85 Favored 'General case' 0 C--N 1.308 -1.219 0 CA-C-O 121.797 0.808 . . . . 0.0 110.59 175.04 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 25.5 m -89.13 130.94 35.49 Favored 'General case' 0 N--CA 1.425 -1.712 0 CA-C-N 115.057 -0.974 . . . . 0.0 108.716 177.29 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . 0.508 ' HA ' ' C ' ' A' ' 8' ' ' PRO . 2.9 mppt? -92.63 141.16 24.22 Favored Pre-proline 0 C--N 1.315 -0.905 0 N-CA-C 109.495 -0.557 . . . . 0.0 109.495 179.486 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . 0.508 ' C ' ' HA ' ' A' ' 7' ' ' LYS . 38.4 Cg_exo -63.1 132.98 12.86 Favored 'Cis proline' 0 C--N 1.353 0.797 0 C-N-CA 124.312 -1.12 . . . . 0.0 111.066 -1.261 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . 0.477 ' HB2' ' N1 ' ' A' ' 101' ' ' WMH . 70.6 Cg_endo -76.86 119.14 5.01 Favored 'Trans proline' 0 N--CA 1.445 -1.33 0 C-N-CA 122.377 2.051 . . . . 0.0 112.718 -173.878 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 73.7 mt -98.29 121.97 49.44 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.708 0 CA-C-N 115.242 -0.89 . . . . 0.0 108.859 178.435 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -127.63 119.18 25.35 Favored 'General case' 0 N--CA 1.439 -0.986 0 CA-C-O 121.095 0.474 . . . . 0.0 109.964 178.182 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 97.3 m-85 -89.6 131.38 40.14 Favored Pre-proline 0 C--N 1.288 -2.092 0 N-CA-C 107.917 -1.142 . . . . 0.0 107.917 175.989 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 81.4 Cg_exo -52.54 -7.73 0.34 Allowed 'Trans proline' 0 N--CA 1.505 2.205 0 C-N-CA 124.932 3.754 . . . . 0.0 115.067 -178.763 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 25.8 t70 . . . . . 0 C--N 1.314 -0.955 0 CA-C-O 121.579 0.704 . . . . 0.0 109.583 174.306 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 101' ' ' WMH . . . . . 0.477 ' N1 ' ' HB2' ' A' ' 9' ' ' PRO . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.423 -2.214 0 N-CA-C 110.677 -0.969 . . . . 0.0 110.677 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 54.5 mtt180 -134.01 105.53 6.76 Favored 'General case' 0 C--N 1.312 -1.026 0 N-CA-C 108.539 -0.911 . . . . 0.0 108.539 -178.048 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -118.98 134.59 55.1 Favored 'General case' 0 C--N 1.298 -1.667 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.631 177.635 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 80.2 m-85 -96.66 129.09 44.13 Favored 'General case' 0 C--N 1.298 -1.647 0 CA-C-N 115.305 -0.861 . . . . 0.0 110.352 177.425 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 34.5 mtmm -90.05 -16.1 30.42 Favored 'General case' 0 C--N 1.306 -1.312 0 CA-C-O 121.71 0.767 . . . . 0.0 109.643 177.674 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 23.0 m -81.12 135.65 35.82 Favored 'General case' 0 N--CA 1.419 -2.014 0 N-CA-C 108.032 -1.099 . . . . 0.0 108.032 175.534 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 2.0 mppt? -80.49 135.84 52.96 Favored Pre-proline 0 C--N 1.305 -1.335 0 N-CA-C 109.681 -0.488 . . . . 0.0 109.681 -176.72 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 61.1 Cg_endo -73.43 132.19 25.83 Favored 'Cis proline' 0 CA--C 1.542 0.922 0 C-N-CA 124.131 -1.195 . . . . 0.0 112.848 1.694 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 8.9 Cg_exo -72.08 97.11 0.81 Allowed 'Trans proline' 0 N--CA 1.455 -0.766 0 C-N-CA 122.432 2.088 . . . . 0.0 111.272 -179.351 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 61.4 mt -94.69 136.01 27.18 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.798 0 CA-C-N 115.895 -0.593 . . . . 0.0 109.678 179.336 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -124.2 151.81 43.63 Favored 'General case' 0 N--CA 1.437 -1.11 0 CA-C-O 121.407 0.623 . . . . 0.0 110.947 179.22 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 96.4 m-85 -130.09 132.92 24.4 Favored Pre-proline 0 C--N 1.297 -1.683 0 C-N-CA 124.935 1.294 . . . . 0.0 108.301 179.205 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 33.6 Cg_exo -58.84 -12.2 14.24 Favored 'Trans proline' 0 N--CA 1.497 1.733 0 C-N-CA 123.715 2.943 . . . . 0.0 113.135 -178.899 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 11.1 t70 . . . . . 0 C--O 1.241 0.61 0 C-N-CA 124.227 1.011 . . . . 0.0 109.305 175.419 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 101' ' ' WMH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.437 -1.274 0 N-CA-C 110.811 -0.915 . . . . 0.0 110.811 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . 0.451 ' HE ' ' HB2' ' A' ' 14' ' ' ASP . 73.2 mtm180 -103.63 107.27 18.05 Favored 'General case' 0 C--N 1.313 -0.986 0 N-CA-C 109.899 -0.408 . . . . 0.0 109.899 -176.51 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -122.11 146.31 47.34 Favored 'General case' 0 C--N 1.3 -1.566 0 C-N-CA 123.325 0.65 . . . . 0.0 111.573 -179.538 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 97.5 m-85 -115.11 130.56 56.96 Favored 'General case' 0 C--N 1.301 -1.533 0 N-CA-C 108.674 -0.861 . . . . 0.0 108.674 174.758 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 2.6 mppt? -92.88 85.99 5.34 Favored 'General case' 0 N--CA 1.431 -1.384 0 N-CA-C 106.923 -1.51 . . . . 0.0 106.923 176.511 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 13.5 p -139.54 171.28 14.48 Favored 'General case' 0 C--N 1.285 -2.227 0 CA-C-N 114.139 -1.391 . . . . 0.0 108.572 -176.572 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 4.8 mptp? -113.5 108.7 51.75 Favored Pre-proline 0 C--N 1.309 -1.167 0 N-CA-C 109.211 -0.663 . . . . 0.0 109.211 174.207 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 1.3 Cg_endo -85.21 154.36 59.56 Favored 'Cis proline' 0 C--O 1.245 0.829 0 CA-C-N 119.643 0.908 . . . . 0.0 111.362 0.245 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 3.4 Cg_exo -72.63 124.5 9.83 Favored 'Trans proline' 0 N--CA 1.457 -0.623 0 C-N-CA 122.42 2.08 . . . . 0.0 111.87 -178.11 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 48.7 mm -106.75 130.35 58.8 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.212 0 N-CA-C 108.377 -0.971 . . . . 0.0 108.377 179.64 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -134.33 153.99 51.58 Favored 'General case' 0 CA--C 1.508 -0.667 0 CA-C-O 121.251 0.548 . . . . 0.0 110.667 -178.263 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 97.6 m-85 -125.11 131.77 24.16 Favored Pre-proline 0 C--N 1.291 -1.973 0 N-CA-C 106.918 -1.512 . . . . 0.0 106.918 175.098 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 31.3 Cg_exo -59.57 4.13 0.17 Allowed 'Trans proline' 0 N--CA 1.497 1.734 0 C-N-CA 124.444 3.43 . . . . 0.0 115.262 -174.944 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . 0.451 ' HB2' ' HE ' ' A' ' 2' ' ' ARG . 8.5 m-20 . . . . . 0 C--N 1.307 -1.281 0 N-CA-C 108.854 -0.795 . . . . 0.0 108.854 174.338 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 101' ' ' WMH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.485 -1.784 0 N-CA-C 108.767 -1.733 . . . . 0.0 108.767 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 6.9 tpp180 -130.1 103.1 6.55 Favored 'General case' 0 N--CA 1.431 -1.389 0 N-CA-C 108.535 -0.913 . . . . 0.0 108.535 -174.93 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -108.99 133.83 52.45 Favored 'General case' 0 C--N 1.296 -1.732 0 CA-C-O 120.89 0.376 . . . . 0.0 111.816 -179.561 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 96.6 m-85 -119.15 103.76 9.82 Favored 'General case' 0 C--N 1.303 -1.418 0 N-CA-C 108.475 -0.935 . . . . 0.0 108.475 176.399 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 55.7 mtpt -87.05 76.15 9.38 Favored 'General case' 0 N--CA 1.426 -1.658 0 CA-C-O 122.503 1.144 . . . . 0.0 110.827 -178.71 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 56.8 m -150.09 170.77 18.12 Favored 'General case' 0 C--N 1.279 -2.491 0 N-CA-C 104.578 -2.378 . . . . 0.0 104.578 178.25 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 12.0 mptt -91.91 130.19 39.39 Favored Pre-proline 0 C--N 1.299 -1.63 0 CA-C-N 118.789 0.722 . . . . 0.0 110.837 -177.776 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 96.7 Cg_endo -82.66 150.6 71.12 Favored 'Cis proline' 0 C--O 1.245 0.873 0 C-N-CA 123.993 -1.253 . . . . 0.0 111.083 -4.954 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 28.2 Cg_exo -62.2 109.59 0.86 Allowed 'Trans proline' 0 C--N 1.354 0.83 0 C-N-CA 122.355 2.037 . . . . 0.0 111.207 -179.069 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 8.1 tp -118.36 122.53 69.78 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.755 0 CA-C-O 121.341 0.591 . . . . 0.0 110.262 -179.384 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -126.22 126.84 44.71 Favored 'General case' 0 N--CA 1.433 -1.316 0 CA-C-N 115.601 -0.727 . . . . 0.0 109.177 178.728 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 90.7 m-85 -97.69 132.69 24.57 Favored Pre-proline 0 C--N 1.282 -2.352 0 CA-C-N 114.956 -1.02 . . . . 0.0 109.494 -178.676 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 78.4 Cg_exo -49.68 -16.28 1.37 Allowed 'Trans proline' 0 N--CA 1.502 1.982 0 C-N-CA 124.743 3.629 . . . . 0.0 115.036 179.547 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 28.2 t70 . . . . . 0 N--CA 1.479 0.98 0 CA-C-O 121.818 0.818 . . . . 0.0 109.897 175.259 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 101' ' ' WMH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.496 -1.137 0 N-CA-C 110.161 -1.176 . . . . 0.0 110.161 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . 0.48 ' HB3' ' HB2' ' A' ' 12' ' ' PHE . 24.4 ttm180 -132.72 135.07 45.54 Favored 'General case' 0 C--N 1.31 -1.128 0 N-CA-C 107.532 -1.284 . . . . 0.0 107.532 -175.125 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -148.81 134.66 18.95 Favored 'General case' 0 C--N 1.304 -1.406 0 CA-C-O 121.112 0.482 . . . . 0.0 112.005 -175.898 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 80.9 m-85 -90.24 154.59 19.62 Favored 'General case' 0 C--N 1.302 -1.462 0 CA-C-N 115.569 -0.741 . . . . 0.0 109.648 175.964 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 75.2 mmtt -102.87 -0.36 31.34 Favored 'General case' 0 C--N 1.316 -0.869 0 CA-C-O 121.522 0.677 . . . . 0.0 109.739 178.743 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 34.9 m -95.86 170.1 9.54 Favored 'General case' 0 C--N 1.308 -1.212 0 CA-C-N 115.527 -0.76 . . . . 0.0 110.19 179.208 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 35.4 mmtp -98.02 137.15 20.85 Favored Pre-proline 0 C--N 1.308 -1.23 0 N-CA-C 108.538 -0.912 . . . . 0.0 108.538 177.307 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 3.0 Cg_exo -77.83 156.26 95.08 Favored 'Cis proline' 0 C--O 1.251 1.148 0 C-N-CA 124.032 -1.236 . . . . 0.0 111.58 0.164 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 15.0 Cg_exo -66.67 92.11 0.3 Allowed 'Trans proline' 0 N--CA 1.452 -0.929 0 C-N-CA 122.411 2.074 . . . . 0.0 110.596 177.267 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 71.3 mt -98.37 118.22 44.56 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.665 0 CA-C-N 115.472 -0.786 . . . . 0.0 108.96 179.902 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -127.36 150.95 49.37 Favored 'General case' 0 N--CA 1.432 -1.355 0 N-CA-C 109.735 -0.468 . . . . 0.0 109.735 -179.25 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . 0.48 ' HB2' ' HB3' ' A' ' 2' ' ' ARG . 43.2 m-85 -117.82 132.86 23.45 Favored Pre-proline 0 C--N 1.296 -1.754 0 C-N-CA 124.413 1.085 . . . . 0.0 108.406 -179.242 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 37.1 Cg_exo -61.53 -2.74 2.8 Favored 'Trans proline' 0 N--CA 1.494 1.523 0 C-N-CA 123.871 3.047 . . . . 0.0 113.44 -178.527 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 33.6 t70 . . . . . 0 C--N 1.32 -0.697 0 C-N-CA 123.802 0.841 . . . . 0.0 109.035 174.0 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 101' ' ' WMH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.432 -1.618 0 CA-C-O 119.771 -0.461 . . . . 0.0 113.43 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . 0.474 ' HG3' ' OD1' ' A' ' 14' ' ' ASP . 65.4 mtp180 -72.39 95.03 1.69 Allowed 'General case' 0 N--CA 1.464 0.256 0 N-CA-C 108.885 -0.783 . . . . 0.0 108.885 176.93 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -107.21 135.1 49.31 Favored 'General case' 0 C--N 1.299 -1.589 0 CA-C-O 121.132 0.492 . . . . 0.0 110.678 -178.927 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 97.2 m-85 -120.86 115.85 24.03 Favored 'General case' 0 C--N 1.293 -1.856 0 CA-C-N 115.168 -0.924 . . . . 0.0 109.552 179.023 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 98.0 mttt -83.06 83.74 7.73 Favored 'General case' 0 N--CA 1.43 -1.454 0 CA-C-O 122.325 1.06 . . . . 0.0 109.051 177.645 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 27.7 m -146.94 171.5 15.14 Favored 'General case' 0 C--N 1.282 -2.349 0 N-CA-C 105.573 -2.01 . . . . 0.0 105.573 -178.914 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 63.7 mttp -108.9 119.79 47.91 Favored Pre-proline 0 C--N 1.297 -1.68 0 CA-C-N 118.413 0.551 . . . . 0.0 110.642 177.434 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 88.0 Cg_endo -78.53 152.85 90.79 Favored 'Cis proline' 0 CA--C 1.545 1.069 0 C-N-CA 124.662 -0.974 . . . . 0.0 112.712 -2.084 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 37.5 Cg_endo -71.23 107.14 2.06 Favored 'Trans proline' 0 C--O 1.252 1.211 0 C-N-CA 122.504 2.136 . . . . 0.0 112.088 179.107 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 5.7 tp -100.89 128.89 52.6 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.317 0 CA-C-N 115.356 -0.838 . . . . 0.0 110.116 179.766 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . 0.43 ' HA ' ' O ' ' A' ' 2' ' ' ARG . . . -129.62 118.18 21.56 Favored 'General case' 0 N--CA 1.428 -1.565 0 N-CA-C 108.638 -0.875 . . . . 0.0 108.638 177.496 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . 0.453 ' HB2' ' HB2' ' A' ' 2' ' ' ARG . 91.0 m-85 -84.56 132.26 47.37 Favored Pre-proline 0 C--N 1.294 -1.835 0 N-CA-C 108.22 -1.03 . . . . 0.0 108.22 178.168 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 0.4 OUTLIER -25.24 -46.22 0.05 OUTLIER 'Trans proline' 0 C--N 1.356 0.971 1 C-N-CA 126.795 4.996 . . . . 0.0 118.343 -174.275 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . 0.474 ' OD1' ' HG3' ' A' ' 2' ' ' ARG . 5.7 p-10 . . . . . 0 N--CA 1.474 0.771 0 N-CA-C 111.693 0.257 . . . . 0.0 111.693 -176.344 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 101' ' ' WMH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.486 -1.773 0 N-CA-C 108.995 -1.642 . . . . 0.0 108.995 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . 0.442 ' HB3' ' HB2' ' A' ' 12' ' ' PHE . 27.4 ttm180 -137.68 92.41 2.68 Favored 'General case' 0 N--CA 1.431 -1.399 0 N-CA-C 109.289 -0.634 . . . . 0.0 109.289 -175.168 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -109.3 134.46 51.76 Favored 'General case' 0 C--N 1.29 -2.009 0 CA-C-N 115.894 -0.594 . . . . 0.0 111.411 176.817 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 94.4 m-85 -106.61 151.29 25.24 Favored 'General case' 0 C--N 1.298 -1.637 0 CA-C-N 114.994 -1.003 . . . . 0.0 108.415 177.36 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 18.6 ptpt -93.01 -1.73 56.37 Favored 'General case' 0 C--N 1.312 -1.059 0 CA-C-O 121.696 0.76 . . . . 0.0 110.209 -179.223 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 23.5 m -81.66 167.18 19.46 Favored 'General case' 0 N--CA 1.429 -1.496 0 CA-C-N 115.051 -0.977 . . . . 0.0 110.283 179.672 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . 0.458 ' HA ' ' C ' ' A' ' 8' ' ' PRO . 20.0 ptmt -113.56 141.66 26.32 Favored Pre-proline 0 C--N 1.308 -1.222 0 CA-C-N 115.953 -0.567 . . . . 0.0 109.915 179.827 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . 0.458 ' C ' ' HA ' ' A' ' 7' ' ' LYS . 59.3 Cg_endo -68.56 165.45 72.83 Favored 'Cis proline' 0 N--CA 1.483 0.903 0 C-N-CA 124.17 -1.179 . . . . 0.0 112.007 1.394 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 16.1 Cg_exo -63.35 96.88 0.19 Allowed 'Trans proline' 0 C--N 1.354 0.823 0 C-N-CA 122.198 1.932 . . . . 0.0 112.04 179.873 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 10' ' ' ILE . . . . . 0.425 HG13 ' O ' ' A' ' 8' ' ' PRO . 72.8 mt -93.97 107.2 18.98 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.326 0 CA-C-N 115.33 -0.85 . . . . 0.0 109.093 179.281 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . 0.422 ' HA ' ' O ' ' A' ' 2' ' ' ARG . . . -132.41 132.44 42.8 Favored 'General case' 0 N--CA 1.441 -0.884 0 CA-C-O 121.343 0.592 . . . . 0.0 110.355 178.327 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . 0.442 ' HB2' ' HB3' ' A' ' 2' ' ' ARG . 87.8 m-85 -108.96 131.9 21.51 Favored Pre-proline 0 C--N 1.277 -2.556 0 N-CA-C 108.312 -0.995 . . . . 0.0 108.312 176.403 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 11.8 Cg_endo -58.36 -7.99 4.65 Favored 'Trans proline' 0 C--N 1.359 1.124 0 C-N-CA 123.529 2.819 . . . . 0.0 112.956 177.543 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 10.2 t70 . . . . . 0 C--N 1.322 -0.593 0 C-N-CA 123.589 0.756 . . . . 0.0 109.315 171.904 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 101' ' ' WMH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.445 -0.701 0 N-CA-C 114.489 0.555 . . . . 0.0 114.489 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . 0.495 ' O ' ' HA ' ' A' ' 11' ' ' ALA . 26.9 mmm180 -125.09 98.81 5.83 Favored 'General case' 0 C--N 1.31 -1.115 0 CA-C-N 117.51 0.655 . . . . 0.0 110.667 178.592 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -108.08 134.73 50.54 Favored 'General case' 0 C--N 1.306 -1.314 0 N-CA-C 109.719 -0.474 . . . . 0.0 109.719 174.775 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 95.7 m-85 -114.08 125.78 54.35 Favored 'General case' 0 C--N 1.288 -2.098 0 N-CA-C 109.467 -0.568 . . . . 0.0 109.467 178.46 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -72.44 -20.72 61.36 Favored 'General case' 0 C--N 1.316 -0.87 0 O-C-N 123.878 0.736 . . . . 0.0 111.276 -179.694 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 60.6 m -73.86 135.59 43.4 Favored 'General case' 0 N--CA 1.433 -1.292 0 CA-C-O 120.757 0.313 . . . . 0.0 110.24 178.854 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 8.4 mtmp? -82.32 141.3 45.84 Favored Pre-proline 0 C--N 1.313 -1.021 0 CA-C-N 115.756 -0.656 . . . . 0.0 110.926 -175.686 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 14.2 Cg_exo -72.46 132.09 24.61 Favored 'Cis proline' 0 C--O 1.242 0.688 0 C-N-CA 123.776 -1.343 . . . . 0.0 110.902 -1.692 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 22.5 Cg_exo -65.68 110.45 1.66 Allowed 'Trans proline' 0 N--CA 1.456 -0.694 0 C-N-CA 122.239 1.959 . . . . 0.0 111.296 -178.761 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 6.6 tp -104.68 127.34 59.19 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.736 0 N-CA-C 108.788 -0.819 . . . . 0.0 108.788 178.856 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . 0.495 ' HA ' ' O ' ' A' ' 2' ' ' ARG . . . -122.58 121.41 36.41 Favored 'General case' 0 N--CA 1.429 -1.489 0 CA-C-N 115.981 -0.554 . . . . 0.0 109.854 -179.731 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 86.6 m-85 -94.19 131.65 31.0 Favored Pre-proline 0 C--N 1.282 -2.339 0 CA-C-N 114.996 -1.002 . . . . 0.0 108.451 178.605 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 63.5 Cg_exo -54.97 -13.3 6.15 Favored 'Trans proline' 0 N--CA 1.494 1.522 0 C-N-CA 124.344 3.362 . . . . 0.0 114.673 -177.852 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 5.2 p-10 . . . . . 0 C--N 1.315 -0.899 0 O-C-N 122.098 -0.376 . . . . 0.0 111.779 178.05 . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 101' ' ' WMH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.433 -1.557 0 N-CA-C 110.776 -0.93 . . . . 0.0 110.776 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . 0.52 ' O ' ' HA ' ' A' ' 11' ' ' ALA . 20.3 mmm180 -123.64 97.19 5.27 Favored 'General case' 0 C--N 1.311 -1.081 0 N-CA-C 110.171 -0.307 . . . . 0.0 110.171 -177.646 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -107.2 134.64 49.99 Favored 'General case' 0 C--N 1.293 -1.857 0 CA-C-O 121.116 0.484 . . . . 0.0 110.048 177.507 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 88.9 m-85 -118.93 126.75 52.49 Favored 'General case' 0 C--N 1.302 -1.459 0 CA-C-N 115.444 -0.798 . . . . 0.0 109.303 -179.492 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 54.1 mtmt -88.91 82.91 6.64 Favored 'General case' 0 C--N 1.3 -1.555 0 CA-C-O 121.966 0.889 . . . . 0.0 112.157 -175.163 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 49.8 m -150.49 170.32 19.38 Favored 'General case' 0 C--N 1.292 -1.923 0 N-CA-C 105.938 -1.875 . . . . 0.0 105.938 175.93 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 28.7 mtpp -113.27 125.48 29.62 Favored Pre-proline 0 C--N 1.303 -1.42 0 N-CA-C 108.891 -0.781 . . . . 0.0 108.891 176.951 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 5.6 Cg_exo -75.11 147.08 88.24 Favored 'Cis proline' 0 C--O 1.246 0.922 0 C-N-CA 124.304 -1.123 . . . . 0.0 111.898 0.406 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . 0.431 ' HB2' ' N1 ' ' A' ' 101' ' ' WMH . 36.1 Cg_endo -67.41 114.45 3.27 Favored 'Trans proline' 0 N--CA 1.455 -0.773 0 C-N-CA 122.556 2.17 . . . . 0.0 111.702 179.095 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 51.0 mm -99.5 117.61 44.9 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.512 0 N-CA-C 108.683 -0.858 . . . . 0.0 108.683 -179.956 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . 0.52 ' HA ' ' O ' ' A' ' 2' ' ' ARG . . . -128.2 128.42 44.72 Favored 'General case' 0 N--CA 1.441 -0.888 0 N-CA-C 109.496 -0.557 . . . . 0.0 109.496 178.787 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . 0.407 ' HB2' ' HB2' ' A' ' 2' ' ' ARG . 98.1 m-85 -99.35 131.67 24.66 Favored Pre-proline 0 C--N 1.289 -2.058 0 N-CA-C 108.75 -0.833 . . . . 0.0 108.75 177.072 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 82.5 Cg_exo -50.31 -15.91 1.69 Allowed 'Trans proline' 0 N--CA 1.497 1.716 0 C-N-CA 124.949 3.766 . . . . 0.0 116.113 -176.68 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 24.5 t70 . . . . . 0 N--CA 1.474 0.749 0 CA-C-O 121.351 0.595 . . . . 0.0 110.212 175.483 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 101' ' ' WMH . . . . . 0.431 ' N1 ' ' HB2' ' A' ' 9' ' ' PRO . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.435 -1.389 0 N-CA-C 109.575 -1.41 . . . . 0.0 109.575 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 38.7 ttm180 -150.98 120.08 6.73 Favored 'General case' 0 C--N 1.303 -1.439 0 N-CA-C 108.744 -0.836 . . . . 0.0 108.744 -175.969 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -129.76 135.49 48.51 Favored 'General case' 0 C--N 1.305 -1.365 0 CA-C-O 121.066 0.46 . . . . 0.0 110.885 -178.734 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 56.7 m-85 -89.18 115.97 27.09 Favored 'General case' 0 C--N 1.297 -1.715 0 CA-C-N 115.321 -0.854 . . . . 0.0 108.793 176.243 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 95.2 mttt -82.04 72.06 9.09 Favored 'General case' 0 C--N 1.317 -0.806 0 CA-C-O 121.76 0.79 . . . . 0.0 110.034 -179.171 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 26.9 m -146.56 166.66 25.82 Favored 'General case' 0 C--N 1.29 -2.011 0 N-CA-C 106.627 -1.62 . . . . 0.0 106.627 179.858 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 28.1 mtpp -114.11 116.36 44.72 Favored Pre-proline 0 C--N 1.291 -1.944 0 N-CA-C 108.949 -0.76 . . . . 0.0 108.949 175.849 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 3.2 Cg_exo -81.87 147.48 68.31 Favored 'Cis proline' 0 CA--C 1.541 0.861 0 C-N-CA 124.813 -0.911 . . . . 0.0 112.987 2.755 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . 0.427 ' HB2' ' N1 ' ' A' ' 101' ' ' WMH . 74.1 Cg_endo -82.47 126.94 4.91 Favored 'Trans proline' 0 N--CA 1.447 -1.211 0 C-N-CA 122.467 2.111 . . . . 0.0 112.887 -179.214 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 68.4 mt -102.92 130.46 52.98 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.796 0 N-CA-C 107.289 -1.375 . . . . 0.0 107.289 175.898 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -127.22 153.94 45.47 Favored 'General case' 0 C--N 1.311 -1.087 0 N-CA-C 109.555 -0.535 . . . . 0.0 109.555 179.46 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 89.9 m-85 -124.47 131.73 24.21 Favored Pre-proline 0 C--N 1.295 -1.762 0 CA-C-N 115.627 -0.715 . . . . 0.0 109.324 178.496 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 77.9 Cg_exo -46.5 -19.49 0.7 Allowed 'Trans proline' 0 N--CA 1.501 1.915 1 C-N-CA 125.372 4.048 . . . . 0.0 115.858 -177.565 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 32.1 t70 . . . . . 0 C--N 1.319 -0.753 0 CA-C-O 121.162 0.506 . . . . 0.0 110.765 177.335 . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 101' ' ' WMH . . . . . 0.427 ' N1 ' ' HB2' ' A' ' 9' ' ' PRO . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.435 -1.379 0 N-CA-C 112.094 -0.402 . . . . 0.0 112.094 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 33.4 ttm180 -143.9 128.09 17.68 Favored 'General case' 0 C--N 1.312 -1.051 0 N-CA-C 109.101 -0.703 . . . . 0.0 109.101 179.146 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -120.91 135.52 55.17 Favored 'General case' 0 C--N 1.293 -1.857 0 CA-C-O 120.487 0.184 . . . . 0.0 111.297 178.78 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 96.8 m-85 -101.52 118.78 37.65 Favored 'General case' 0 C--N 1.306 -1.303 0 N-CA-C 108.838 -0.801 . . . . 0.0 108.838 175.716 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 30.2 mmmt -88.18 72.1 9.14 Favored 'General case' 0 N--CA 1.427 -1.595 0 CA-C-O 122.589 1.185 . . . . 0.0 110.913 179.188 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 35.0 m -151.07 170.87 18.34 Favored 'General case' 0 C--N 1.293 -1.852 0 CA-C-N 113.308 -1.769 . . . . 0.0 106.324 178.795 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 19.7 ptpt -98.51 135.65 21.07 Favored Pre-proline 0 C--N 1.295 -1.798 0 N-CA-C 107.406 -1.331 . . . . 0.0 107.406 170.949 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 74.3 Cg_endo -81.25 160.56 82.0 Favored 'Cis proline' 0 CA--C 1.54 0.8 0 C-N-CA 123.533 -1.444 . . . . 0.0 111.277 0.473 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 33.6 Cg_endo -66.41 95.43 0.32 Allowed 'Trans proline' 0 N--CA 1.452 -0.917 0 C-N-CA 121.909 1.739 . . . . 0.0 111.202 177.927 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 49.7 mm -106.72 115.21 47.76 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.46 0 N-CA-C 108.487 -0.931 . . . . 0.0 108.487 179.633 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -125.89 138.97 53.83 Favored 'General case' 0 C--N 1.295 -1.792 0 N-CA-C 107.447 -1.316 . . . . 0.0 107.447 178.196 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 22.2 m-30 -96.11 131.97 27.78 Favored Pre-proline 0 C--N 1.288 -2.077 0 N-CA-C 108.758 -0.83 . . . . 0.0 108.758 179.841 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 13.7 Cg_endo -57.92 -10.77 8.29 Favored 'Trans proline' 0 C--N 1.356 0.925 0 C-N-CA 123.84 3.026 . . . . 0.0 113.704 -179.032 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 24.4 t70 . . . . . 0 C--N 1.317 -0.812 0 CA-C-O 121.446 0.641 . . . . 0.0 110.123 174.754 . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 101' ' ' WMH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.44 -1.074 0 N-CA-C 111.986 -0.446 . . . . 0.0 111.986 . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 21.4 ttm180 -115.94 114.03 24.1 Favored 'General case' 0 C--N 1.316 -0.862 0 C-N-CA 120.713 -0.395 . . . . 0.0 110.053 -178.869 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -108.25 135.51 49.45 Favored 'General case' 0 C--N 1.304 -1.379 0 C-N-CA 123.169 0.587 . . . . 0.0 111.694 -178.542 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 12.1 m-85 -89.81 122.14 32.61 Favored 'General case' 0 C--N 1.301 -1.523 0 N-CA-C 108.641 -0.874 . . . . 0.0 108.641 173.43 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . 0.478 ' HD2' ' N ' ' A' ' 5' ' ' LYS . 0.1 OUTLIER -84.0 -22.61 31.31 Favored 'General case' 0 C--N 1.303 -1.425 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.058 -177.218 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 41.4 m -84.5 141.73 30.54 Favored 'General case' 0 N--CA 1.43 -1.464 0 N-CA-C 109.081 -0.711 . . . . 0.0 109.081 176.245 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 38.1 ttpt -67.82 138.98 93.21 Favored Pre-proline 0 C--N 1.308 -1.214 0 C-N-CA 123.504 0.722 . . . . 0.0 109.407 178.581 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 74.3 Cg_endo -77.15 134.22 34.36 Favored 'Cis proline' 0 C--N 1.351 0.671 0 C-N-CA 123.882 -1.299 . . . . 0.0 111.566 -0.965 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 21.9 Cg_exo -65.58 105.1 0.72 Allowed 'Trans proline' 0 N--CA 1.457 -0.655 0 C-N-CA 122.017 1.811 . . . . 0.0 111.081 179.916 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 67.8 mt -108.58 128.26 64.38 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.554 0 N-CA-C 107.725 -1.213 . . . . 0.0 107.725 178.207 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -123.09 112.51 17.83 Favored 'General case' 0 N--CA 1.433 -1.278 0 CA-C-O 121.249 0.547 . . . . 0.0 109.764 -179.808 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 92.6 m-85 -79.5 132.1 63.03 Favored Pre-proline 0 C--N 1.289 -2.025 0 CA-C-N 115.039 -0.982 . . . . 0.0 109.487 -179.962 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 84.5 Cg_exo -48.8 -21.32 3.54 Favored 'Trans proline' 0 N--CA 1.495 1.575 0 C-N-CA 124.696 3.597 . . . . 0.0 114.65 -177.2 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 19.2 t70 . . . . . 0 N--CA 1.469 0.486 0 C-N-CA 123.14 0.576 . . . . 0.0 110.376 177.345 . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 101' ' ' WMH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.436 -1.366 0 N-CA-C 111.542 -0.623 . . . . 0.0 111.542 . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . 0.49 ' O ' ' HA ' ' A' ' 11' ' ' ALA . 78.5 mtp180 -117.83 102.35 9.03 Favored 'General case' 0 C--N 1.313 -0.995 0 O-C-N 122.568 -0.372 . . . . 0.0 110.521 -179.019 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -107.9 134.56 50.65 Favored 'General case' 0 C--N 1.3 -1.55 0 CA-C-N 115.634 -0.712 . . . . 0.0 109.195 179.002 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 62.9 m-85 -103.75 154.55 19.44 Favored 'General case' 0 C--N 1.295 -1.79 0 CA-C-N 115.726 -0.67 . . . . 0.0 110.936 179.749 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -88.19 -27.66 21.68 Favored 'General case' 0 C--N 1.313 -0.991 0 N-CA-C 108.615 -0.883 . . . . 0.0 108.615 -178.467 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 11.8 p -62.79 135.53 57.39 Favored 'General case' 0 N--CA 1.433 -1.283 0 CA-C-N 115.093 -0.958 . . . . 0.0 111.021 -179.572 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 96.6 mttt -90.97 139.67 25.94 Favored Pre-proline 0 C--N 1.309 -1.164 0 N-CA-C 110.164 -0.31 . . . . 0.0 110.164 -178.66 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 57.1 Cg_endo -73.16 133.11 29.04 Favored 'Cis proline' 0 C--O 1.245 0.855 0 C-N-CA 123.73 -1.363 . . . . 0.0 110.948 -3.005 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 22.1 Cg_exo -65.65 115.21 3.26 Favored 'Trans proline' 0 N--CA 1.453 -0.861 0 C-N-CA 122.053 1.835 . . . . 0.0 111.636 -178.231 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 7.9 tp -97.9 136.3 29.27 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.741 0 N-CA-C 107.815 -1.18 . . . . 0.0 107.815 177.212 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . 0.49 ' HA ' ' O ' ' A' ' 2' ' ' ARG . . . -123.74 112.37 17.26 Favored 'General case' 0 N--CA 1.436 -1.163 0 N-CA-C 109.333 -0.617 . . . . 0.0 109.333 177.527 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 93.9 m-85 -79.48 132.57 61.7 Favored Pre-proline 0 C--N 1.294 -1.816 0 N-CA-C 108.341 -0.985 . . . . 0.0 108.341 178.55 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 8.5 Cg_endo -48.3 -21.17 2.85 Favored 'Trans proline' 0 N--CA 1.496 1.649 0 C-N-CA 124.975 3.784 . . . . 0.0 115.561 -175.558 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 34.0 t70 . . . . . 0 N--CA 1.473 0.715 0 CA-C-O 121.668 0.747 . . . . 0.0 110.375 177.908 . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 101' ' ' WMH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.436 -1.305 0 CA-C-O 120.242 -0.199 . . . . 0.0 112.695 . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 71.6 ttt180 -152.64 129.88 11.24 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 116.79 0.295 . . . . 0.0 110.252 177.843 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -130.56 134.71 47.24 Favored 'General case' 0 C--N 1.305 -1.345 0 C-N-CA 123.078 0.551 . . . . 0.0 111.298 178.711 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 58.7 m-85 -92.77 137.85 32.0 Favored 'General case' 0 C--N 1.31 -1.144 0 CA-C-N 115.908 -0.587 . . . . 0.0 110.151 177.047 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 75.7 mmtt -88.53 -43.94 11.04 Favored 'General case' 0 C--N 1.303 -1.445 0 N-CA-C 109.094 -0.706 . . . . 0.0 109.094 179.322 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 37.5 m -79.9 155.78 27.6 Favored 'General case' 0 N--CA 1.437 -1.084 0 CA-C-N 115.42 -0.809 . . . . 0.0 110.502 179.74 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 53.0 mtmt -79.74 136.88 54.74 Favored Pre-proline 0 C--N 1.313 -1.019 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.144 -178.238 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 78.1 Cg_endo -75.28 127.81 15.24 Favored 'Cis proline' 0 CA--C 1.54 0.822 0 C-N-CA 123.988 -1.255 . . . . 0.0 112.84 2.774 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 3.4 Cg_exo -79.44 87.69 1.52 Allowed 'Trans proline' 0 N--CA 1.436 -1.896 0 C-N-CA 121.748 1.632 . . . . 0.0 109.79 178.574 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 13.3 tt -105.61 140.15 24.57 Favored 'Isoleucine or valine' 0 C--N 1.291 -1.964 0 N-CA-C 108.57 -0.9 . . . . 0.0 108.57 179.029 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -118.15 145.49 44.88 Favored 'General case' 0 N--CA 1.422 -1.861 0 N-CA-C 108.41 -0.959 . . . . 0.0 108.41 178.955 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 48.0 m-85 -110.12 131.7 21.85 Favored Pre-proline 0 C--N 1.276 -2.588 0 N-CA-C 108.038 -1.097 . . . . 0.0 108.038 178.487 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 37.2 Cg_endo -65.87 3.17 1.31 Allowed 'Trans proline' 0 N--CA 1.486 1.033 0 C-N-CA 123.592 2.861 . . . . 0.0 112.716 -179.969 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 51.3 m-20 . . . . . 0 C--N 1.321 -0.667 0 N-CA-C 108.993 -0.743 . . . . 0.0 108.993 176.827 . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 101' ' ' WMH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.433 -1.524 0 N-CA-C 111.212 -0.755 . . . . 0.0 111.212 . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 4.4 tpp180 -143.34 105.24 4.36 Favored 'General case' 0 C--N 1.31 -1.119 0 N-CA-C 109.781 -0.451 . . . . 0.0 109.781 179.236 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -108.14 135.26 49.78 Favored 'General case' 0 C--N 1.294 -1.823 0 CA-C-N 115.868 -0.606 . . . . 0.0 110.286 179.003 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 47.0 m-85 -98.16 139.68 33.6 Favored 'General case' 0 C--N 1.298 -1.654 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.66 178.561 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 18.8 ptmt -94.44 12.4 27.32 Favored 'General case' 0 C--N 1.309 -1.188 0 CA-C-O 122.006 0.908 . . . . 0.0 109.702 -179.955 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 41.5 m -75.75 171.02 15.08 Favored 'General case' 0 C--N 1.308 -1.219 0 CA-C-N 114.185 -1.371 . . . . 0.0 109.734 176.097 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 24.1 ttmm -108.15 118.24 53.0 Favored Pre-proline 0 C--N 1.304 -1.373 0 N-CA-C 109.673 -0.492 . . . . 0.0 109.673 177.581 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 93.7 Cg_endo -83.49 159.54 73.03 Favored 'Cis proline' 0 C--O 1.243 0.771 0 C-N-CA 124.327 -1.114 . . . . 0.0 111.218 -2.469 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 28.8 Cg_endo -67.41 104.43 0.91 Allowed 'Trans proline' 0 N--CA 1.451 -1.012 0 C-N-CA 121.818 1.679 . . . . 0.0 111.56 178.905 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 7.6 tp -100.72 138.61 24.41 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.284 0 N-CA-C 108.185 -1.042 . . . . 0.0 108.185 176.891 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -128.65 150.39 50.25 Favored 'General case' 0 N--CA 1.43 -1.433 0 N-CA-C 109.311 -0.626 . . . . 0.0 109.311 -177.797 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 90.3 m-85 -107.94 132.05 21.31 Favored Pre-proline 0 C--N 1.288 -2.075 0 N-CA-C 107.414 -1.328 . . . . 0.0 107.414 174.548 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 21.1 Cg_endo -61.34 -5.68 5.66 Favored 'Trans proline' 0 N--CA 1.485 0.988 0 C-N-CA 123.73 2.953 . . . . 0.0 114.501 -175.758 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 8.7 m-20 . . . . . 0 C--N 1.309 -1.169 0 CA-C-N 116.109 -0.496 . . . . 0.0 109.749 175.087 . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 101' ' ' WMH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.438 -1.199 0 N-CA-C 111.698 -0.561 . . . . 0.0 111.698 . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . 0.428 ' HB2' ' HB2' ' A' ' 12' ' ' PHE . 95.7 mtt180 -132.53 93.58 3.26 Favored 'General case' 0 C--N 1.317 -0.837 0 CA-C-O 120.92 0.39 . . . . 0.0 110.828 -179.109 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -107.89 137.2 46.3 Favored 'General case' 0 C--N 1.294 -1.834 0 CA-C-N 115.417 -0.811 . . . . 0.0 110.412 177.056 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 53.6 m-85 -115.47 126.2 54.02 Favored 'General case' 0 C--N 1.295 -1.778 0 N-CA-C 107.65 -1.241 . . . . 0.0 107.65 178.944 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -83.66 70.4 10.31 Favored 'General case' 0 C--N 1.309 -1.191 0 CA-C-O 122.751 1.263 . . . . 0.0 111.221 -177.362 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 53.7 m -148.33 158.08 43.88 Favored 'General case' 0 C--N 1.301 -1.505 0 CA-C-N 114.634 -1.166 . . . . 0.0 108.295 179.422 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . 0.42 ' HA ' ' C ' ' A' ' 8' ' ' PRO . 7.8 ptpp? -112.95 133.62 21.95 Favored Pre-proline 0 C--N 1.31 -1.123 0 N-CA-C 110.05 -0.352 . . . . 0.0 110.05 179.474 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . 0.42 ' C ' ' HA ' ' A' ' 7' ' ' LYS . 12.8 Cg_exo -69.05 138.11 45.56 Favored 'Cis proline' 0 C--N 1.356 0.969 0 C-N-CA 124.334 -1.111 . . . . 0.0 111.814 1.42 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 35.3 Cg_endo -66.01 121.47 8.8 Favored 'Trans proline' 0 C--O 1.24 0.613 0 C-N-CA 122.655 2.236 . . . . 0.0 112.537 -177.163 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 48.6 mm -110.24 121.74 63.59 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.618 0 N-CA-C 107.808 -1.182 . . . . 0.0 107.808 178.564 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -134.29 120.54 20.07 Favored 'General case' 0 CA--C 1.491 -1.327 0 N-CA-C 109.609 -0.515 . . . . 0.0 109.609 179.765 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . 0.428 ' HB2' ' HB2' ' A' ' 2' ' ' ARG . 99.9 m-85 -90.47 128.25 49.65 Favored Pre-proline 0 C--N 1.288 -2.07 0 N-CA-C 107.411 -1.329 . . . . 0.0 107.411 175.082 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 12.5 Cg_endo -53.8 -20.43 17.37 Favored 'Trans proline' 0 N--CA 1.484 0.927 0 C-N-CA 124.307 3.338 . . . . 0.0 114.593 -172.627 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 17.5 m-20 . . . . . 0 C--N 1.316 -0.866 0 C-N-CA 123.303 0.641 . . . . 0.0 111.73 -179.091 . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 101' ' ' WMH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.436 -1.36 0 N-CA-C 110.682 -0.967 . . . . 0.0 110.682 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 2' ' ' ARG . . . . . 0.458 ' O ' ' HA ' ' A' ' 11' ' ' ALA . 26.7 mtt180 -124.26 93.65 3.98 Favored 'General case' 0 C--N 1.315 -0.917 0 N-CA-C 108.268 -1.012 . . . . 0.0 108.268 -178.958 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -108.1 134.76 50.52 Favored 'General case' 0 C--N 1.293 -1.872 0 CA-C-O 120.999 0.428 . . . . 0.0 110.959 178.091 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 4' ' ' TYR . . . . . 0.455 ' HD1' ' O ' ' A' ' 10' ' ' ILE . 96.3 m-85 -104.05 142.42 34.48 Favored 'General case' 0 C--N 1.302 -1.463 0 CA-C-N 115.536 -0.757 . . . . 0.0 110.218 -179.698 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 12.8 mptt -82.63 -30.08 29.67 Favored 'General case' 0 C--O 1.246 0.891 0 CA-C-N 115.852 -0.613 . . . . 0.0 111.549 -177.23 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 10.6 m -66.24 155.28 37.56 Favored 'General case' 0 N--CA 1.442 -0.862 0 CA-C-N 115.587 -0.733 . . . . 0.0 110.237 -178.589 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 7' ' ' LYS . . . . . 0.45 ' HD2' ' N ' ' A' ' 7' ' ' LYS . 3.5 mptp? -104.56 135.39 19.32 Favored Pre-proline 0 N--CA 1.437 -1.121 0 N-CA-C 109.183 -0.673 . . . . 0.0 109.183 179.294 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 67.2 Cg_endo -70.54 136.15 38.99 Favored 'Cis proline' 0 N--CA 1.484 0.912 0 C-N-CA 124.373 -1.094 . . . . 0.0 112.374 1.384 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 42.9 Cg_endo -71.68 107.32 2.16 Favored 'Trans proline' 0 N--CA 1.447 -1.207 0 C-N-CA 122.049 1.833 . . . . 0.0 111.52 179.63 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 10' ' ' ILE . . . . . 0.455 ' O ' ' HD1' ' A' ' 4' ' ' TYR . 50.6 mm -93.7 129.69 43.73 Favored 'Isoleucine or valine' 0 C--N 1.291 -1.952 0 N-CA-C 108.35 -0.981 . . . . 0.0 108.35 179.616 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 11' ' ' ALA . . . . . 0.458 ' HA ' ' O ' ' A' ' 2' ' ' ARG . . . -126.8 126.52 43.53 Favored 'General case' 0 N--CA 1.434 -1.249 0 N-CA-C 109.582 -0.525 . . . . 0.0 109.582 177.702 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 74.6 m-85 -98.66 132.19 24.42 Favored Pre-proline 0 C--N 1.291 -1.956 0 N-CA-C 107.181 -1.414 . . . . 0.0 107.181 175.809 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 26.5 Cg_endo -57.67 -8.98 4.77 Favored 'Trans proline' 0 N--CA 1.485 1.002 0 C-N-CA 124.169 3.246 . . . . 0.0 115.064 -173.035 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 14' ' ' ASP . . . . . 0.402 ' HB2' ' HE ' ' A' ' 2' ' ' ARG . 45.3 m-20 . . . . . 0 C--N 1.319 -0.742 0 CA-C-O 120.729 0.3 . . . . 0.0 110.308 178.131 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.434 -1.483 0 N-CA-C 112.664 -0.175 . . . . 0.0 112.664 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 73.8 mtm180 -134.97 102.78 5.34 Favored 'General case' 0 C--N 1.305 -1.363 0 N-CA-C 109.968 -0.382 . . . . 0.0 109.968 177.634 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -118.49 134.41 55.1 Favored 'General case' 0 C--N 1.287 -2.151 0 CA-C-N 115.802 -0.635 . . . . 0.0 111.44 178.764 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 92.2 m-85 -88.25 122.18 31.49 Favored 'General case' 0 N--CA 1.421 -1.881 0 N-CA-C 106.263 -1.755 . . . . 0.0 106.263 171.92 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 10.5 mtmp? -80.94 -5.63 57.71 Favored 'General case' 0 C--N 1.311 -1.098 0 CA-C-O 121.237 0.541 . . . . 0.0 111.106 -176.314 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 11.5 p -83.95 148.33 26.97 Favored 'General case' 0 N--CA 1.425 -1.717 0 CA-C-N 115.423 -0.808 . . . . 0.0 109.361 175.977 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 55.3 mtpt -97.7 141.34 22.84 Favored Pre-proline 0 C--N 1.304 -1.385 0 N-CA-C 108.071 -1.085 . . . . 0.0 108.071 177.248 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 24.7 Cg_exo -66.74 140.54 50.5 Favored 'Cis proline' 0 N--CA 1.486 1.039 0 CA-C-N 119.813 0.969 . . . . 0.0 113.435 2.11 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 57.6 Cg_endo -70.73 109.25 2.45 Favored 'Trans proline' 0 C--O 1.244 0.78 0 C-N-CA 123.251 2.634 . . . . 0.0 113.542 -177.837 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 64.1 mt -109.09 122.29 63.52 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.346 0 N-CA-C 107.659 -1.238 . . . . 0.0 107.659 175.87 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -133.52 154.04 51.15 Favored 'General case' 0 C--N 1.317 -0.819 0 CA-C-O 121.175 0.512 . . . . 0.0 110.926 -177.307 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 99.8 m-85 -121.63 131.36 24.46 Favored Pre-proline 0 C--N 1.297 -1.698 0 N-CA-C 107.052 -1.462 . . . . 0.0 107.052 173.916 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 37.5 Cg_exo -58.83 -12.66 15.53 Favored 'Trans proline' 0 N--CA 1.489 1.215 0 C-N-CA 123.965 3.11 . . . . 0.0 115.188 -174.514 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 5.8 p-10 . . . . . 0 C--N 1.318 -0.77 0 CA-C-O 120.93 0.395 . . . . 0.0 110.832 178.203 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.492 -1.403 0 N-CA-C 110.424 -1.071 . . . . 0.0 110.424 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 82.0 mtt180 -128.61 100.62 5.82 Favored 'General case' 0 C--N 1.315 -0.913 0 N-CA-C 108.379 -0.971 . . . . 0.0 108.379 -178.8 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -110.71 135.5 51.22 Favored 'General case' 0 C--N 1.29 -1.985 0 CA-C-N 116.351 -0.386 . . . . 0.0 111.12 -179.428 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 4' ' ' TYR . . . . . 0.469 ' HD1' ' O ' ' A' ' 10' ' ' ILE . 94.8 m-85 -88.91 141.16 28.73 Favored 'General case' 0 C--N 1.301 -1.533 0 CA-C-N 115.92 -0.582 . . . . 0.0 109.568 176.325 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 66.2 mttm -92.54 -42.1 9.88 Favored 'General case' 0 C--N 1.3 -1.564 0 N-CA-C 108.895 -0.78 . . . . 0.0 108.895 -179.106 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 24.9 m -65.42 127.13 30.54 Favored 'General case' 0 N--CA 1.424 -1.725 0 N-CA-C 108.668 -0.864 . . . . 0.0 108.668 176.867 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 42.7 mmtm -75.12 146.07 81.52 Favored Pre-proline 0 C--N 1.306 -1.302 0 CA-C-N 115.741 -0.663 . . . . 0.0 110.643 -173.773 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 56.7 Cg_endo -71.29 144.33 79.21 Favored 'Cis proline' 0 C--N 1.352 0.711 0 C-N-CA 123.979 -1.259 . . . . 0.0 112.729 1.63 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 55.4 Cg_endo -73.16 96.03 0.86 Allowed 'Trans proline' 0 N--CA 1.446 -1.3 0 C-N-CA 122.22 1.947 . . . . 0.0 111.574 -179.178 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 10' ' ' ILE . . . . . 0.469 ' O ' ' HD1' ' A' ' 4' ' ' TYR . 50.4 mm -92.32 134.4 30.58 Favored 'Isoleucine or valine' 0 C--N 1.294 -1.814 0 N-CA-C 106.642 -1.614 . . . . 0.0 106.642 177.64 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -130.98 144.32 51.39 Favored 'General case' 0 C--N 1.303 -1.434 0 C-N-CA 119.925 -0.71 . . . . 0.0 109.323 179.081 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 80.1 m-85 -109.46 129.54 23.79 Favored Pre-proline 0 C--N 1.288 -2.093 0 N-CA-C 107.311 -1.366 . . . . 0.0 107.311 173.264 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 3.4 Cg_exo -49.18 -17.06 1.22 Allowed 'Trans proline' 0 C--N 1.361 1.226 0 C-N-CA 124.522 3.481 . . . . 0.0 114.689 179.599 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 25.5 t70 . . . . . 0 C--N 1.318 -0.763 0 CA-C-O 121.672 0.749 . . . . 0.0 110.569 175.703 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.431 -1.658 0 N-CA-C 109.804 -1.319 . . . . 0.0 109.804 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 2' ' ' ARG . . . . . 0.462 ' HB3' ' HB2' ' A' ' 12' ' ' PHE . 9.6 ttm180 -135.76 98.28 3.87 Favored 'General case' 0 N--CA 1.431 -1.378 0 N-CA-C 109.57 -0.53 . . . . 0.0 109.57 -177.67 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -107.56 134.99 49.77 Favored 'General case' 0 C--N 1.289 -2.058 0 CA-C-O 121.639 0.733 . . . . 0.0 112.001 179.839 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 66.9 m-85 -101.18 105.49 16.63 Favored 'General case' 0 C--N 1.287 -2.121 0 N-CA-C 107.182 -1.414 . . . . 0.0 107.182 172.137 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 56.5 mtmt -86.1 -7.29 58.7 Favored 'General case' 0 C--N 1.31 -1.109 0 CA-C-N 115.36 -0.836 . . . . 0.0 109.945 -178.652 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 14.9 m -85.88 168.15 14.48 Favored 'General case' 0 N--CA 1.432 -1.364 0 N-CA-C 106.052 -1.833 . . . . 0.0 106.052 171.931 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 18.2 ptpt -95.44 146.34 31.14 Favored Pre-proline 0 C--N 1.301 -1.534 0 C-N-CA 118.998 -1.081 . . . . 0.0 111.262 -179.601 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 6.0 Cg_exo -76.58 138.88 56.87 Favored 'Cis proline' 0 C--N 1.349 0.596 0 C-N-CA 124.045 -1.231 . . . . 0.0 112.235 0.531 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 32.4 Cg_endo -65.74 114.96 3.15 Favored 'Trans proline' 0 C--O 1.239 0.546 0 C-N-CA 122.489 2.126 . . . . 0.0 111.441 -179.896 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 7.3 tp -142.29 132.58 24.08 Favored 'Isoleucine or valine' 0 C--N 1.293 -1.871 0 N-CA-C 108.529 -0.915 . . . . 0.0 108.529 179.219 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -124.23 123.2 39.73 Favored 'General case' 0 N--CA 1.434 -1.267 0 CA-C-O 121.333 0.587 . . . . 0.0 110.006 -178.858 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 12' ' ' PHE . . . . . 0.465 ' HA ' ' HD3' ' A' ' 13' ' ' PRO . 82.6 m-85 -95.69 132.3 27.65 Favored Pre-proline 0 C--N 1.282 -2.349 0 N-CA-C 108.282 -1.007 . . . . 0.0 108.282 -179.877 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 13' ' ' PRO . . . . . 0.465 ' HD3' ' HA ' ' A' ' 12' ' ' PHE . 25.6 Cg_exo -60.91 9.33 0.08 OUTLIER 'Trans proline' 0 N--CA 1.491 1.335 0 C-N-CA 124.497 3.464 . . . . 0.0 116.112 -174.047 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 6.7 p-10 . . . . . 0 C--N 1.3 -1.573 0 N-CA-C 108.82 -0.807 . . . . 0.0 108.82 176.48 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.44 -1.082 0 N-CA-C 110.856 -0.898 . . . . 0.0 110.856 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 90.7 mtt180 -110.19 97.54 7.0 Favored 'General case' 0 C--N 1.315 -0.912 0 N-CA-C 109.329 -0.619 . . . . 0.0 109.329 -177.744 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -108.59 135.28 50.11 Favored 'General case' 0 C--N 1.303 -1.437 0 CA-C-N 115.356 -0.838 . . . . 0.0 112.862 -179.437 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 55.8 m-85 -92.22 151.93 20.1 Favored 'General case' 0 C--N 1.3 -1.548 0 CA-C-N 114.684 -1.144 . . . . 0.0 109.109 173.718 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -101.95 -1.48 31.85 Favored 'General case' 0 C--N 1.308 -1.219 0 CA-C-O 121.797 0.808 . . . . 0.0 110.59 175.04 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 25.5 m -89.13 130.94 35.49 Favored 'General case' 0 N--CA 1.425 -1.712 0 CA-C-N 115.057 -0.974 . . . . 0.0 108.716 177.29 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 7' ' ' LYS . . . . . 0.494 ' HA ' ' C ' ' A' ' 8' ' ' PRO . 2.9 mppt? -92.63 141.16 24.22 Favored Pre-proline 0 C--N 1.315 -0.905 0 N-CA-C 109.495 -0.557 . . . . 0.0 109.495 179.486 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 8' ' ' PRO . . . . . 0.494 ' C ' ' HA ' ' A' ' 7' ' ' LYS . 38.4 Cg_exo -63.1 132.98 12.86 Favored 'Cis proline' 0 C--N 1.353 0.797 0 C-N-CA 124.312 -1.12 . . . . 0.0 111.066 -1.261 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 70.6 Cg_endo -76.86 119.14 5.01 Favored 'Trans proline' 0 N--CA 1.445 -1.33 0 C-N-CA 122.377 2.051 . . . . 0.0 112.718 -173.878 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 73.7 mt -98.29 121.97 49.44 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.708 0 CA-C-N 115.242 -0.89 . . . . 0.0 108.859 178.435 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -127.63 119.18 25.35 Favored 'General case' 0 N--CA 1.439 -0.986 0 CA-C-O 121.095 0.474 . . . . 0.0 109.964 178.182 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 97.3 m-85 -89.6 131.38 40.14 Favored Pre-proline 0 C--N 1.288 -2.092 0 N-CA-C 107.917 -1.142 . . . . 0.0 107.917 175.989 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 81.4 Cg_exo -52.54 -7.73 0.34 Allowed 'Trans proline' 0 N--CA 1.505 2.205 0 C-N-CA 124.932 3.754 . . . . 0.0 115.067 -178.763 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 25.8 t70 . . . . . 0 C--N 1.314 -0.955 0 CA-C-O 121.579 0.704 . . . . 0.0 109.583 174.306 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.423 -2.214 0 N-CA-C 110.677 -0.969 . . . . 0.0 110.677 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 54.5 mtt180 -134.01 105.53 6.76 Favored 'General case' 0 C--N 1.312 -1.026 0 N-CA-C 108.539 -0.911 . . . . 0.0 108.539 -178.048 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -118.98 134.59 55.1 Favored 'General case' 0 C--N 1.298 -1.667 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.631 177.635 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 80.2 m-85 -96.66 129.09 44.13 Favored 'General case' 0 C--N 1.298 -1.647 0 CA-C-N 115.305 -0.861 . . . . 0.0 110.352 177.425 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 34.5 mtmm -90.05 -16.1 30.42 Favored 'General case' 0 C--N 1.306 -1.312 0 CA-C-O 121.71 0.767 . . . . 0.0 109.643 177.674 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 23.0 m -81.12 135.65 35.82 Favored 'General case' 0 N--CA 1.419 -2.014 0 N-CA-C 108.032 -1.099 . . . . 0.0 108.032 175.534 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 2.0 mppt? -80.49 135.84 52.96 Favored Pre-proline 0 C--N 1.305 -1.335 0 N-CA-C 109.681 -0.488 . . . . 0.0 109.681 -176.72 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 8' ' ' PRO . . . . . 0.46 ' HA ' ' HD3' ' A' ' 9' ' ' PRO . 61.1 Cg_endo -73.43 132.19 25.83 Favored 'Cis proline' 0 CA--C 1.542 0.922 0 C-N-CA 124.131 -1.195 . . . . 0.0 112.848 1.694 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 9' ' ' PRO . . . . . 0.46 ' HD3' ' HA ' ' A' ' 8' ' ' PRO . 8.9 Cg_exo -72.08 97.11 0.81 Allowed 'Trans proline' 0 N--CA 1.455 -0.766 0 C-N-CA 122.432 2.088 . . . . 0.0 111.272 -179.351 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 61.4 mt -94.69 136.01 27.18 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.798 0 CA-C-N 115.895 -0.593 . . . . 0.0 109.678 179.336 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -124.2 151.81 43.63 Favored 'General case' 0 N--CA 1.437 -1.11 0 CA-C-O 121.407 0.623 . . . . 0.0 110.947 179.22 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 96.4 m-85 -130.09 132.92 24.4 Favored Pre-proline 0 C--N 1.297 -1.683 0 C-N-CA 124.935 1.294 . . . . 0.0 108.301 179.205 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 33.6 Cg_exo -58.84 -12.2 14.24 Favored 'Trans proline' 0 N--CA 1.497 1.733 0 C-N-CA 123.715 2.943 . . . . 0.0 113.135 -178.899 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 11.1 t70 . . . . . 0 C--O 1.241 0.61 0 C-N-CA 124.227 1.011 . . . . 0.0 109.305 175.419 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.437 -1.274 0 N-CA-C 110.811 -0.915 . . . . 0.0 110.811 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 2' ' ' ARG . . . . . 0.475 ' HE ' ' HB2' ' A' ' 14' ' ' ASP . 73.2 mtm180 -103.63 107.27 18.05 Favored 'General case' 0 C--N 1.313 -0.986 0 N-CA-C 109.899 -0.408 . . . . 0.0 109.899 -176.51 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -122.11 146.31 47.34 Favored 'General case' 0 C--N 1.3 -1.566 0 C-N-CA 123.325 0.65 . . . . 0.0 111.573 -179.538 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 97.5 m-85 -115.11 130.56 56.96 Favored 'General case' 0 C--N 1.301 -1.533 0 N-CA-C 108.674 -0.861 . . . . 0.0 108.674 174.758 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 2.6 mppt? -92.88 85.99 5.34 Favored 'General case' 0 N--CA 1.431 -1.384 0 N-CA-C 106.923 -1.51 . . . . 0.0 106.923 176.511 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 13.5 p -139.54 171.28 14.48 Favored 'General case' 0 C--N 1.285 -2.227 0 CA-C-N 114.139 -1.391 . . . . 0.0 108.572 -176.572 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 7' ' ' LYS . . . . . 0.408 ' HA ' ' HA ' ' A' ' 8' ' ' PRO . 4.8 mptp? -113.5 108.7 51.75 Favored Pre-proline 0 C--N 1.309 -1.167 0 N-CA-C 109.211 -0.663 . . . . 0.0 109.211 174.207 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 8' ' ' PRO . . . . . 0.429 ' HA ' ' HD3' ' A' ' 9' ' ' PRO . 1.3 Cg_endo -85.21 154.36 59.56 Favored 'Cis proline' 0 C--O 1.245 0.829 0 CA-C-N 119.643 0.908 . . . . 0.0 111.362 0.245 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 9' ' ' PRO . . . . . 0.429 ' HD3' ' HA ' ' A' ' 8' ' ' PRO . 3.4 Cg_exo -72.63 124.5 9.83 Favored 'Trans proline' 0 N--CA 1.457 -0.623 0 C-N-CA 122.42 2.08 . . . . 0.0 111.87 -178.11 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 48.7 mm -106.75 130.35 58.8 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.212 0 N-CA-C 108.377 -0.971 . . . . 0.0 108.377 179.64 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -134.33 153.99 51.58 Favored 'General case' 0 CA--C 1.508 -0.667 0 CA-C-O 121.251 0.548 . . . . 0.0 110.667 -178.263 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 97.6 m-85 -125.11 131.77 24.16 Favored Pre-proline 0 C--N 1.291 -1.973 0 N-CA-C 106.918 -1.512 . . . . 0.0 106.918 175.098 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 31.3 Cg_exo -59.57 4.13 0.17 Allowed 'Trans proline' 0 N--CA 1.497 1.734 0 C-N-CA 124.444 3.43 . . . . 0.0 115.262 -174.944 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 14' ' ' ASP . . . . . 0.475 ' HB2' ' HE ' ' A' ' 2' ' ' ARG . 8.5 m-20 . . . . . 0 C--N 1.307 -1.281 0 N-CA-C 108.854 -0.795 . . . . 0.0 108.854 174.338 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.485 -1.784 0 N-CA-C 108.767 -1.733 . . . . 0.0 108.767 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 6.9 tpp180 -130.1 103.1 6.55 Favored 'General case' 0 N--CA 1.431 -1.389 0 N-CA-C 108.535 -0.913 . . . . 0.0 108.535 -174.93 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -108.99 133.83 52.45 Favored 'General case' 0 C--N 1.296 -1.732 0 CA-C-O 120.89 0.376 . . . . 0.0 111.816 -179.561 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 96.6 m-85 -119.15 103.76 9.82 Favored 'General case' 0 C--N 1.303 -1.418 0 N-CA-C 108.475 -0.935 . . . . 0.0 108.475 176.399 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 55.7 mtpt -87.05 76.15 9.38 Favored 'General case' 0 N--CA 1.426 -1.658 0 CA-C-O 122.503 1.144 . . . . 0.0 110.827 -178.71 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 56.8 m -150.09 170.77 18.12 Favored 'General case' 0 C--N 1.279 -2.491 0 N-CA-C 104.578 -2.378 . . . . 0.0 104.578 178.25 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 12.0 mptt -91.91 130.19 39.39 Favored Pre-proline 0 C--N 1.299 -1.63 0 CA-C-N 118.789 0.722 . . . . 0.0 110.837 -177.776 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 96.7 Cg_endo -82.66 150.6 71.12 Favored 'Cis proline' 0 C--O 1.245 0.873 0 C-N-CA 123.993 -1.253 . . . . 0.0 111.083 -4.954 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 28.2 Cg_exo -62.2 109.59 0.86 Allowed 'Trans proline' 0 C--N 1.354 0.83 0 C-N-CA 122.355 2.037 . . . . 0.0 111.207 -179.069 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 8.1 tp -118.36 122.53 69.78 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.755 0 CA-C-O 121.341 0.591 . . . . 0.0 110.262 -179.384 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -126.22 126.84 44.71 Favored 'General case' 0 N--CA 1.433 -1.316 0 CA-C-N 115.601 -0.727 . . . . 0.0 109.177 178.728 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 90.7 m-85 -97.69 132.69 24.57 Favored Pre-proline 0 C--N 1.282 -2.352 0 CA-C-N 114.956 -1.02 . . . . 0.0 109.494 -178.676 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 78.4 Cg_exo -49.68 -16.28 1.37 Allowed 'Trans proline' 0 N--CA 1.502 1.982 0 C-N-CA 124.743 3.629 . . . . 0.0 115.036 179.547 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 28.2 t70 . . . . . 0 N--CA 1.479 0.98 0 CA-C-O 121.818 0.818 . . . . 0.0 109.897 175.259 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.496 -1.137 0 N-CA-C 110.161 -1.176 . . . . 0.0 110.161 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 2' ' ' ARG . . . . . 0.549 ' HB3' ' HB2' ' A' ' 12' ' ' PHE . 24.4 ttm180 -132.72 135.07 45.54 Favored 'General case' 0 C--N 1.31 -1.128 0 N-CA-C 107.532 -1.284 . . . . 0.0 107.532 -175.125 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -148.81 134.66 18.95 Favored 'General case' 0 C--N 1.304 -1.406 0 CA-C-O 121.112 0.482 . . . . 0.0 112.005 -175.898 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 80.9 m-85 -90.24 154.59 19.62 Favored 'General case' 0 C--N 1.302 -1.462 0 CA-C-N 115.569 -0.741 . . . . 0.0 109.648 175.964 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 75.2 mmtt -102.87 -0.36 31.34 Favored 'General case' 0 C--N 1.316 -0.869 0 CA-C-O 121.522 0.677 . . . . 0.0 109.739 178.743 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 34.9 m -95.86 170.1 9.54 Favored 'General case' 0 C--N 1.308 -1.212 0 CA-C-N 115.527 -0.76 . . . . 0.0 110.19 179.208 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 35.4 mmtp -98.02 137.15 20.85 Favored Pre-proline 0 C--N 1.308 -1.23 0 N-CA-C 108.538 -0.912 . . . . 0.0 108.538 177.307 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 3.0 Cg_exo -77.83 156.26 95.08 Favored 'Cis proline' 0 C--O 1.251 1.148 0 C-N-CA 124.032 -1.236 . . . . 0.0 111.58 0.164 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 15.0 Cg_exo -66.67 92.11 0.3 Allowed 'Trans proline' 0 N--CA 1.452 -0.929 0 C-N-CA 122.411 2.074 . . . . 0.0 110.596 177.267 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 71.3 mt -98.37 118.22 44.56 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.665 0 CA-C-N 115.472 -0.786 . . . . 0.0 108.96 179.902 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -127.36 150.95 49.37 Favored 'General case' 0 N--CA 1.432 -1.355 0 N-CA-C 109.735 -0.468 . . . . 0.0 109.735 -179.25 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 12' ' ' PHE . . . . . 0.549 ' HB2' ' HB3' ' A' ' 2' ' ' ARG . 43.2 m-85 -117.82 132.86 23.45 Favored Pre-proline 0 C--N 1.296 -1.754 0 C-N-CA 124.413 1.085 . . . . 0.0 108.406 -179.242 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 13' ' ' PRO . . . . . 0.402 ' HD3' ' HA ' ' A' ' 12' ' ' PHE . 37.1 Cg_exo -61.53 -2.74 2.8 Favored 'Trans proline' 0 N--CA 1.494 1.523 0 C-N-CA 123.871 3.047 . . . . 0.0 113.44 -178.527 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 33.6 t70 . . . . . 0 C--N 1.32 -0.697 0 C-N-CA 123.802 0.841 . . . . 0.0 109.035 174.0 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.432 -1.618 0 CA-C-O 119.771 -0.461 . . . . 0.0 113.43 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 2' ' ' ARG . . . . . 0.482 ' HB2' ' HB2' ' A' ' 12' ' ' PHE . 65.4 mtp180 -72.39 95.03 1.69 Allowed 'General case' 0 N--CA 1.464 0.256 0 N-CA-C 108.885 -0.783 . . . . 0.0 108.885 176.93 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -107.21 135.1 49.31 Favored 'General case' 0 C--N 1.299 -1.589 0 CA-C-O 121.132 0.492 . . . . 0.0 110.678 -178.927 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 97.2 m-85 -120.86 115.85 24.03 Favored 'General case' 0 C--N 1.293 -1.856 0 CA-C-N 115.168 -0.924 . . . . 0.0 109.552 179.023 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 98.0 mttt -83.06 83.74 7.73 Favored 'General case' 0 N--CA 1.43 -1.454 0 CA-C-O 122.325 1.06 . . . . 0.0 109.051 177.645 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 27.7 m -146.94 171.5 15.14 Favored 'General case' 0 C--N 1.282 -2.349 0 N-CA-C 105.573 -2.01 . . . . 0.0 105.573 -178.914 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 7' ' ' LYS . . . . . 0.414 ' HA ' ' HA ' ' A' ' 8' ' ' PRO . 63.7 mttp -108.9 119.79 47.91 Favored Pre-proline 0 C--N 1.297 -1.68 0 CA-C-N 118.413 0.551 . . . . 0.0 110.642 177.434 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 8' ' ' PRO . . . . . 0.414 ' HA ' ' HA ' ' A' ' 7' ' ' LYS . 88.0 Cg_endo -78.53 152.85 90.79 Favored 'Cis proline' 0 CA--C 1.545 1.069 0 C-N-CA 124.662 -0.974 . . . . 0.0 112.712 -2.084 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 37.5 Cg_endo -71.23 107.14 2.06 Favored 'Trans proline' 0 C--O 1.252 1.211 0 C-N-CA 122.504 2.136 . . . . 0.0 112.088 179.107 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 5.7 tp -100.89 128.89 52.6 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.317 0 CA-C-N 115.356 -0.838 . . . . 0.0 110.116 179.766 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 11' ' ' ALA . . . . . 0.424 ' HA ' ' O ' ' A' ' 2' ' ' ARG . . . -129.62 118.18 21.56 Favored 'General case' 0 N--CA 1.428 -1.565 0 N-CA-C 108.638 -0.875 . . . . 0.0 108.638 177.496 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 12' ' ' PHE . . . . . 0.482 ' HB2' ' HB2' ' A' ' 2' ' ' ARG . 91.0 m-85 -84.56 132.26 47.37 Favored Pre-proline 0 C--N 1.294 -1.835 0 N-CA-C 108.22 -1.03 . . . . 0.0 108.22 178.168 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 0.4 OUTLIER -25.24 -46.22 0.05 OUTLIER 'Trans proline' 0 C--N 1.356 0.971 1 C-N-CA 126.795 4.996 . . . . 0.0 118.343 -174.275 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 14' ' ' ASP . . . . . 0.47 ' OD1' ' HG3' ' A' ' 2' ' ' ARG . 5.7 p-10 . . . . . 0 N--CA 1.474 0.771 0 N-CA-C 111.693 0.257 . . . . 0.0 111.693 -176.344 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.486 -1.773 0 N-CA-C 108.995 -1.642 . . . . 0.0 108.995 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 2' ' ' ARG . . . . . 0.502 ' HB3' ' HB2' ' A' ' 12' ' ' PHE . 27.4 ttm180 -137.68 92.41 2.68 Favored 'General case' 0 N--CA 1.431 -1.399 0 N-CA-C 109.289 -0.634 . . . . 0.0 109.289 -175.168 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -109.3 134.46 51.76 Favored 'General case' 0 C--N 1.29 -2.009 0 CA-C-N 115.894 -0.594 . . . . 0.0 111.411 176.817 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 94.4 m-85 -106.61 151.29 25.24 Favored 'General case' 0 C--N 1.298 -1.637 0 CA-C-N 114.994 -1.003 . . . . 0.0 108.415 177.36 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 18.6 ptpt -93.01 -1.73 56.37 Favored 'General case' 0 C--N 1.312 -1.059 0 CA-C-O 121.696 0.76 . . . . 0.0 110.209 -179.223 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 23.5 m -81.66 167.18 19.46 Favored 'General case' 0 N--CA 1.429 -1.496 0 CA-C-N 115.051 -0.977 . . . . 0.0 110.283 179.672 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 7' ' ' LYS . . . . . 0.458 ' HA ' ' C ' ' A' ' 8' ' ' PRO . 20.0 ptmt -113.56 141.66 26.32 Favored Pre-proline 0 C--N 1.308 -1.222 0 CA-C-N 115.953 -0.567 . . . . 0.0 109.915 179.827 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 8' ' ' PRO . . . . . 0.458 ' C ' ' HA ' ' A' ' 7' ' ' LYS . 59.3 Cg_endo -68.56 165.45 72.83 Favored 'Cis proline' 0 N--CA 1.483 0.903 0 C-N-CA 124.17 -1.179 . . . . 0.0 112.007 1.394 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 16.1 Cg_exo -63.35 96.88 0.19 Allowed 'Trans proline' 0 C--N 1.354 0.823 0 C-N-CA 122.198 1.932 . . . . 0.0 112.04 179.873 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 10' ' ' ILE . . . . . 0.434 HG13 ' O ' ' A' ' 8' ' ' PRO . 72.8 mt -93.97 107.2 18.98 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.326 0 CA-C-N 115.33 -0.85 . . . . 0.0 109.093 179.281 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -132.41 132.44 42.8 Favored 'General case' 0 N--CA 1.441 -0.884 0 CA-C-O 121.343 0.592 . . . . 0.0 110.355 178.327 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 12' ' ' PHE . . . . . 0.502 ' HB2' ' HB3' ' A' ' 2' ' ' ARG . 87.8 m-85 -108.96 131.9 21.51 Favored Pre-proline 0 C--N 1.277 -2.556 0 N-CA-C 108.312 -0.995 . . . . 0.0 108.312 176.403 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 11.8 Cg_endo -58.36 -7.99 4.65 Favored 'Trans proline' 0 C--N 1.359 1.124 0 C-N-CA 123.529 2.819 . . . . 0.0 112.956 177.543 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 10.2 t70 . . . . . 0 C--N 1.322 -0.593 0 C-N-CA 123.589 0.756 . . . . 0.0 109.315 171.904 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.445 -0.701 0 N-CA-C 114.489 0.555 . . . . 0.0 114.489 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 2' ' ' ARG . . . . . 0.482 ' O ' ' HA ' ' A' ' 11' ' ' ALA . 26.9 mmm180 -125.09 98.81 5.83 Favored 'General case' 0 C--N 1.31 -1.115 0 CA-C-N 117.51 0.655 . . . . 0.0 110.667 178.592 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -108.08 134.73 50.54 Favored 'General case' 0 C--N 1.306 -1.314 0 N-CA-C 109.719 -0.474 . . . . 0.0 109.719 174.775 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 95.7 m-85 -114.08 125.78 54.35 Favored 'General case' 0 C--N 1.288 -2.098 0 N-CA-C 109.467 -0.568 . . . . 0.0 109.467 178.46 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 5' ' ' LYS . . . . . 0.493 ' H ' ' HD3' ' A' ' 5' ' ' LYS . 0.0 OUTLIER -72.44 -20.72 61.36 Favored 'General case' 0 C--N 1.316 -0.87 0 O-C-N 123.878 0.736 . . . . 0.0 111.276 -179.694 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 60.6 m -73.86 135.59 43.4 Favored 'General case' 0 N--CA 1.433 -1.292 0 CA-C-O 120.757 0.313 . . . . 0.0 110.24 178.854 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 8.4 mtmp? -82.32 141.3 45.84 Favored Pre-proline 0 C--N 1.313 -1.021 0 CA-C-N 115.756 -0.656 . . . . 0.0 110.926 -175.686 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 8' ' ' PRO . . . . . 0.465 ' HA ' ' HD3' ' A' ' 9' ' ' PRO . 14.2 Cg_exo -72.46 132.09 24.61 Favored 'Cis proline' 0 C--O 1.242 0.688 0 C-N-CA 123.776 -1.343 . . . . 0.0 110.902 -1.692 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 9' ' ' PRO . . . . . 0.465 ' HD3' ' HA ' ' A' ' 8' ' ' PRO . 22.5 Cg_exo -65.68 110.45 1.66 Allowed 'Trans proline' 0 N--CA 1.456 -0.694 0 C-N-CA 122.239 1.959 . . . . 0.0 111.296 -178.761 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 6.6 tp -104.68 127.34 59.19 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.736 0 N-CA-C 108.788 -0.819 . . . . 0.0 108.788 178.856 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 11' ' ' ALA . . . . . 0.482 ' HA ' ' O ' ' A' ' 2' ' ' ARG . . . -122.58 121.41 36.41 Favored 'General case' 0 N--CA 1.429 -1.489 0 CA-C-N 115.981 -0.554 . . . . 0.0 109.854 -179.731 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 12' ' ' PHE . . . . . 0.42 ' HA ' ' HD3' ' A' ' 13' ' ' PRO . 86.6 m-85 -94.19 131.65 31.0 Favored Pre-proline 0 C--N 1.282 -2.339 0 CA-C-N 114.996 -1.002 . . . . 0.0 108.451 178.605 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 13' ' ' PRO . . . . . 0.42 ' HD3' ' HA ' ' A' ' 12' ' ' PHE . 63.5 Cg_exo -54.97 -13.3 6.15 Favored 'Trans proline' 0 N--CA 1.494 1.522 0 C-N-CA 124.344 3.362 . . . . 0.0 114.673 -177.852 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 5.2 p-10 . . . . . 0 C--N 1.315 -0.899 0 O-C-N 122.098 -0.376 . . . . 0.0 111.779 178.05 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.433 -1.557 0 N-CA-C 110.776 -0.93 . . . . 0.0 110.776 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 2' ' ' ARG . . . . . 0.495 ' O ' ' HA ' ' A' ' 11' ' ' ALA . 20.3 mmm180 -123.64 97.19 5.27 Favored 'General case' 0 C--N 1.311 -1.081 0 N-CA-C 110.171 -0.307 . . . . 0.0 110.171 -177.646 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -107.2 134.64 49.99 Favored 'General case' 0 C--N 1.293 -1.857 0 CA-C-O 121.116 0.484 . . . . 0.0 110.048 177.507 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 88.9 m-85 -118.93 126.75 52.49 Favored 'General case' 0 C--N 1.302 -1.459 0 CA-C-N 115.444 -0.798 . . . . 0.0 109.303 -179.492 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 54.1 mtmt -88.91 82.91 6.64 Favored 'General case' 0 C--N 1.3 -1.555 0 CA-C-O 121.966 0.889 . . . . 0.0 112.157 -175.163 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 49.8 m -150.49 170.32 19.38 Favored 'General case' 0 C--N 1.292 -1.923 0 N-CA-C 105.938 -1.875 . . . . 0.0 105.938 175.93 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 28.7 mtpp -113.27 125.48 29.62 Favored Pre-proline 0 C--N 1.303 -1.42 0 N-CA-C 108.891 -0.781 . . . . 0.0 108.891 176.951 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 5.6 Cg_exo -75.11 147.08 88.24 Favored 'Cis proline' 0 C--O 1.246 0.922 0 C-N-CA 124.304 -1.123 . . . . 0.0 111.898 0.406 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 36.1 Cg_endo -67.41 114.45 3.27 Favored 'Trans proline' 0 N--CA 1.455 -0.773 0 C-N-CA 122.556 2.17 . . . . 0.0 111.702 179.095 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 51.0 mm -99.5 117.61 44.9 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.512 0 N-CA-C 108.683 -0.858 . . . . 0.0 108.683 -179.956 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 11' ' ' ALA . . . . . 0.495 ' HA ' ' O ' ' A' ' 2' ' ' ARG . . . -128.2 128.42 44.72 Favored 'General case' 0 N--CA 1.441 -0.888 0 N-CA-C 109.496 -0.557 . . . . 0.0 109.496 178.787 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 12' ' ' PHE . . . . . 0.433 ' HB2' ' HB2' ' A' ' 2' ' ' ARG . 98.1 m-85 -99.35 131.67 24.66 Favored Pre-proline 0 C--N 1.289 -2.058 0 N-CA-C 108.75 -0.833 . . . . 0.0 108.75 177.072 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 82.5 Cg_exo -50.31 -15.91 1.69 Allowed 'Trans proline' 0 N--CA 1.497 1.716 0 C-N-CA 124.949 3.766 . . . . 0.0 116.113 -176.68 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 24.5 t70 . . . . . 0 N--CA 1.474 0.749 0 CA-C-O 121.351 0.595 . . . . 0.0 110.212 175.483 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.435 -1.389 0 N-CA-C 109.575 -1.41 . . . . 0.0 109.575 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 38.7 ttm180 -150.98 120.08 6.73 Favored 'General case' 0 C--N 1.303 -1.439 0 N-CA-C 108.744 -0.836 . . . . 0.0 108.744 -175.969 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -129.76 135.49 48.51 Favored 'General case' 0 C--N 1.305 -1.365 0 CA-C-O 121.066 0.46 . . . . 0.0 110.885 -178.734 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 56.7 m-85 -89.18 115.97 27.09 Favored 'General case' 0 C--N 1.297 -1.715 0 CA-C-N 115.321 -0.854 . . . . 0.0 108.793 176.243 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 95.2 mttt -82.04 72.06 9.09 Favored 'General case' 0 C--N 1.317 -0.806 0 CA-C-O 121.76 0.79 . . . . 0.0 110.034 -179.171 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 26.9 m -146.56 166.66 25.82 Favored 'General case' 0 C--N 1.29 -2.011 0 N-CA-C 106.627 -1.62 . . . . 0.0 106.627 179.858 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 28.1 mtpp -114.11 116.36 44.72 Favored Pre-proline 0 C--N 1.291 -1.944 0 N-CA-C 108.949 -0.76 . . . . 0.0 108.949 175.849 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 3.2 Cg_exo -81.87 147.48 68.31 Favored 'Cis proline' 0 CA--C 1.541 0.861 0 C-N-CA 124.813 -0.911 . . . . 0.0 112.987 2.755 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 74.1 Cg_endo -82.47 126.94 4.91 Favored 'Trans proline' 0 N--CA 1.447 -1.211 0 C-N-CA 122.467 2.111 . . . . 0.0 112.887 -179.214 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 68.4 mt -102.92 130.46 52.98 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.796 0 N-CA-C 107.289 -1.375 . . . . 0.0 107.289 175.898 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -127.22 153.94 45.47 Favored 'General case' 0 C--N 1.311 -1.087 0 N-CA-C 109.555 -0.535 . . . . 0.0 109.555 179.46 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 89.9 m-85 -124.47 131.73 24.21 Favored Pre-proline 0 C--N 1.295 -1.762 0 CA-C-N 115.627 -0.715 . . . . 0.0 109.324 178.496 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 77.9 Cg_exo -46.5 -19.49 0.7 Allowed 'Trans proline' 0 N--CA 1.501 1.915 1 C-N-CA 125.372 4.048 . . . . 0.0 115.858 -177.565 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 32.1 t70 . . . . . 0 C--N 1.319 -0.753 0 CA-C-O 121.162 0.506 . . . . 0.0 110.765 177.335 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.435 -1.379 0 N-CA-C 112.094 -0.402 . . . . 0.0 112.094 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 33.4 ttm180 -143.9 128.09 17.68 Favored 'General case' 0 C--N 1.312 -1.051 0 N-CA-C 109.101 -0.703 . . . . 0.0 109.101 179.146 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -120.91 135.52 55.17 Favored 'General case' 0 C--N 1.293 -1.857 0 CA-C-O 120.487 0.184 . . . . 0.0 111.297 178.78 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 96.8 m-85 -101.52 118.78 37.65 Favored 'General case' 0 C--N 1.306 -1.303 0 N-CA-C 108.838 -0.801 . . . . 0.0 108.838 175.716 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 30.2 mmmt -88.18 72.1 9.14 Favored 'General case' 0 N--CA 1.427 -1.595 0 CA-C-O 122.589 1.185 . . . . 0.0 110.913 179.188 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 35.0 m -151.07 170.87 18.34 Favored 'General case' 0 C--N 1.293 -1.852 0 CA-C-N 113.308 -1.769 . . . . 0.0 106.324 178.795 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 19.7 ptpt -98.51 135.65 21.07 Favored Pre-proline 0 C--N 1.295 -1.798 0 N-CA-C 107.406 -1.331 . . . . 0.0 107.406 170.949 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 74.3 Cg_endo -81.25 160.56 82.0 Favored 'Cis proline' 0 CA--C 1.54 0.8 0 C-N-CA 123.533 -1.444 . . . . 0.0 111.277 0.473 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 33.6 Cg_endo -66.41 95.43 0.32 Allowed 'Trans proline' 0 N--CA 1.452 -0.917 0 C-N-CA 121.909 1.739 . . . . 0.0 111.202 177.927 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 49.7 mm -106.72 115.21 47.76 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.46 0 N-CA-C 108.487 -0.931 . . . . 0.0 108.487 179.633 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -125.89 138.97 53.83 Favored 'General case' 0 C--N 1.295 -1.792 0 N-CA-C 107.447 -1.316 . . . . 0.0 107.447 178.196 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 22.2 m-30 -96.11 131.97 27.78 Favored Pre-proline 0 C--N 1.288 -2.077 0 N-CA-C 108.758 -0.83 . . . . 0.0 108.758 179.841 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 13.7 Cg_endo -57.92 -10.77 8.29 Favored 'Trans proline' 0 C--N 1.356 0.925 0 C-N-CA 123.84 3.026 . . . . 0.0 113.704 -179.032 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 24.4 t70 . . . . . 0 C--N 1.317 -0.812 0 CA-C-O 121.446 0.641 . . . . 0.0 110.123 174.754 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.44 -1.074 0 N-CA-C 111.986 -0.446 . . . . 0.0 111.986 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 21.4 ttm180 -115.94 114.03 24.1 Favored 'General case' 0 C--N 1.316 -0.862 0 C-N-CA 120.713 -0.395 . . . . 0.0 110.053 -178.869 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -108.25 135.51 49.45 Favored 'General case' 0 C--N 1.304 -1.379 0 C-N-CA 123.169 0.587 . . . . 0.0 111.694 -178.542 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 4' ' ' TYR . . . . . 0.45 ' HB2' ' H ' ' A' ' 10' ' ' ILE . 12.1 m-85 -89.81 122.14 32.61 Favored 'General case' 0 C--N 1.301 -1.523 0 N-CA-C 108.641 -0.874 . . . . 0.0 108.641 173.43 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 5' ' ' LYS . . . . . 0.489 ' HD2' ' N ' ' A' ' 5' ' ' LYS . 0.1 OUTLIER -84.0 -22.61 31.31 Favored 'General case' 0 C--N 1.303 -1.425 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.058 -177.218 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 41.4 m -84.5 141.73 30.54 Favored 'General case' 0 N--CA 1.43 -1.464 0 N-CA-C 109.081 -0.711 . . . . 0.0 109.081 176.245 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 38.1 ttpt -67.82 138.98 93.21 Favored Pre-proline 0 C--N 1.308 -1.214 0 C-N-CA 123.504 0.722 . . . . 0.0 109.407 178.581 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 8' ' ' PRO . . . . . 0.445 ' HA ' ' HD3' ' A' ' 9' ' ' PRO . 74.3 Cg_endo -77.15 134.22 34.36 Favored 'Cis proline' 0 C--N 1.351 0.671 0 C-N-CA 123.882 -1.299 . . . . 0.0 111.566 -0.965 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 9' ' ' PRO . . . . . 0.445 ' HD3' ' HA ' ' A' ' 8' ' ' PRO . 21.9 Cg_exo -65.58 105.1 0.72 Allowed 'Trans proline' 0 N--CA 1.457 -0.655 0 C-N-CA 122.017 1.811 . . . . 0.0 111.081 179.916 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 10' ' ' ILE . . . . . 0.45 ' H ' ' HB2' ' A' ' 4' ' ' TYR . 67.8 mt -108.58 128.26 64.38 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.554 0 N-CA-C 107.725 -1.213 . . . . 0.0 107.725 178.207 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -123.09 112.51 17.83 Favored 'General case' 0 N--CA 1.433 -1.278 0 CA-C-O 121.249 0.547 . . . . 0.0 109.764 -179.808 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 92.6 m-85 -79.5 132.1 63.03 Favored Pre-proline 0 C--N 1.289 -2.025 0 CA-C-N 115.039 -0.982 . . . . 0.0 109.487 -179.962 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 84.5 Cg_exo -48.8 -21.32 3.54 Favored 'Trans proline' 0 N--CA 1.495 1.575 0 C-N-CA 124.696 3.597 . . . . 0.0 114.65 -177.2 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 19.2 t70 . . . . . 0 N--CA 1.469 0.486 0 C-N-CA 123.14 0.576 . . . . 0.0 110.376 177.345 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.436 -1.366 0 N-CA-C 111.542 -0.623 . . . . 0.0 111.542 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 2' ' ' ARG . . . . . 0.47 ' O ' ' HA ' ' A' ' 11' ' ' ALA . 78.5 mtp180 -117.83 102.35 9.03 Favored 'General case' 0 C--N 1.313 -0.995 0 O-C-N 122.568 -0.372 . . . . 0.0 110.521 -179.019 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -107.9 134.56 50.65 Favored 'General case' 0 C--N 1.3 -1.55 0 CA-C-N 115.634 -0.712 . . . . 0.0 109.195 179.002 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 62.9 m-85 -103.75 154.55 19.44 Favored 'General case' 0 C--N 1.295 -1.79 0 CA-C-N 115.726 -0.67 . . . . 0.0 110.936 179.749 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -88.19 -27.66 21.68 Favored 'General case' 0 C--N 1.313 -0.991 0 N-CA-C 108.615 -0.883 . . . . 0.0 108.615 -178.467 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 11.8 p -62.79 135.53 57.39 Favored 'General case' 0 N--CA 1.433 -1.283 0 CA-C-N 115.093 -0.958 . . . . 0.0 111.021 -179.572 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 96.6 mttt -90.97 139.67 25.94 Favored Pre-proline 0 C--N 1.309 -1.164 0 N-CA-C 110.164 -0.31 . . . . 0.0 110.164 -178.66 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 8' ' ' PRO . . . . . 0.492 ' HA ' ' HD3' ' A' ' 9' ' ' PRO . 57.1 Cg_endo -73.16 133.11 29.04 Favored 'Cis proline' 0 C--O 1.245 0.855 0 C-N-CA 123.73 -1.363 . . . . 0.0 110.948 -3.005 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 9' ' ' PRO . . . . . 0.492 ' HD3' ' HA ' ' A' ' 8' ' ' PRO . 22.1 Cg_exo -65.65 115.21 3.26 Favored 'Trans proline' 0 N--CA 1.453 -0.861 0 C-N-CA 122.053 1.835 . . . . 0.0 111.636 -178.231 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 7.9 tp -97.9 136.3 29.27 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.741 0 N-CA-C 107.815 -1.18 . . . . 0.0 107.815 177.212 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 11' ' ' ALA . . . . . 0.47 ' HA ' ' O ' ' A' ' 2' ' ' ARG . . . -123.74 112.37 17.26 Favored 'General case' 0 N--CA 1.436 -1.163 0 N-CA-C 109.333 -0.617 . . . . 0.0 109.333 177.527 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 93.9 m-85 -79.48 132.57 61.7 Favored Pre-proline 0 C--N 1.294 -1.816 0 N-CA-C 108.341 -0.985 . . . . 0.0 108.341 178.55 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 8.5 Cg_endo -48.3 -21.17 2.85 Favored 'Trans proline' 0 N--CA 1.496 1.649 0 C-N-CA 124.975 3.784 . . . . 0.0 115.561 -175.558 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 34.0 t70 . . . . . 0 N--CA 1.473 0.715 0 CA-C-O 121.668 0.747 . . . . 0.0 110.375 177.908 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.436 -1.305 0 CA-C-O 120.242 -0.199 . . . . 0.0 112.695 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 71.6 ttt180 -152.64 129.88 11.24 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 116.79 0.295 . . . . 0.0 110.252 177.843 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -130.56 134.71 47.24 Favored 'General case' 0 C--N 1.305 -1.345 0 C-N-CA 123.078 0.551 . . . . 0.0 111.298 178.711 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 58.7 m-85 -92.77 137.85 32.0 Favored 'General case' 0 C--N 1.31 -1.144 0 CA-C-N 115.908 -0.587 . . . . 0.0 110.151 177.047 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 75.7 mmtt -88.53 -43.94 11.04 Favored 'General case' 0 C--N 1.303 -1.445 0 N-CA-C 109.094 -0.706 . . . . 0.0 109.094 179.322 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 37.5 m -79.9 155.78 27.6 Favored 'General case' 0 N--CA 1.437 -1.084 0 CA-C-N 115.42 -0.809 . . . . 0.0 110.502 179.74 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 53.0 mtmt -79.74 136.88 54.74 Favored Pre-proline 0 C--N 1.313 -1.019 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.144 -178.238 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 8' ' ' PRO . . . . . 0.449 ' HA ' ' HD3' ' A' ' 9' ' ' PRO . 78.1 Cg_endo -75.28 127.81 15.24 Favored 'Cis proline' 0 CA--C 1.54 0.822 0 C-N-CA 123.988 -1.255 . . . . 0.0 112.84 2.774 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 9' ' ' PRO . . . . . 0.449 ' HD3' ' HA ' ' A' ' 8' ' ' PRO . 3.4 Cg_exo -79.44 87.69 1.52 Allowed 'Trans proline' 0 N--CA 1.436 -1.896 0 C-N-CA 121.748 1.632 . . . . 0.0 109.79 178.574 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 13.3 tt -105.61 140.15 24.57 Favored 'Isoleucine or valine' 0 C--N 1.291 -1.964 0 N-CA-C 108.57 -0.9 . . . . 0.0 108.57 179.029 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -118.15 145.49 44.88 Favored 'General case' 0 N--CA 1.422 -1.861 0 N-CA-C 108.41 -0.959 . . . . 0.0 108.41 178.955 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 48.0 m-85 -110.12 131.7 21.85 Favored Pre-proline 0 C--N 1.276 -2.588 0 N-CA-C 108.038 -1.097 . . . . 0.0 108.038 178.487 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 37.2 Cg_endo -65.87 3.17 1.31 Allowed 'Trans proline' 0 N--CA 1.486 1.033 0 C-N-CA 123.592 2.861 . . . . 0.0 112.716 -179.969 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 51.3 m-20 . . . . . 0 C--N 1.321 -0.667 0 N-CA-C 108.993 -0.743 . . . . 0.0 108.993 176.827 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.433 -1.524 0 N-CA-C 111.212 -0.755 . . . . 0.0 111.212 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 4.4 tpp180 -143.34 105.24 4.36 Favored 'General case' 0 C--N 1.31 -1.119 0 N-CA-C 109.781 -0.451 . . . . 0.0 109.781 179.236 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -108.14 135.26 49.78 Favored 'General case' 0 C--N 1.294 -1.823 0 CA-C-N 115.868 -0.606 . . . . 0.0 110.286 179.003 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 47.0 m-85 -98.16 139.68 33.6 Favored 'General case' 0 C--N 1.298 -1.654 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.66 178.561 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 18.8 ptmt -94.44 12.4 27.32 Favored 'General case' 0 C--N 1.309 -1.188 0 CA-C-O 122.006 0.908 . . . . 0.0 109.702 -179.955 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 41.5 m -75.75 171.02 15.08 Favored 'General case' 0 C--N 1.308 -1.219 0 CA-C-N 114.185 -1.371 . . . . 0.0 109.734 176.097 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 7' ' ' LYS . . . . . 0.428 ' HA ' ' HA ' ' A' ' 8' ' ' PRO . 24.1 ttmm -108.15 118.24 53.0 Favored Pre-proline 0 C--N 1.304 -1.373 0 N-CA-C 109.673 -0.492 . . . . 0.0 109.673 177.581 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 8' ' ' PRO . . . . . 0.428 ' HA ' ' HA ' ' A' ' 7' ' ' LYS . 93.7 Cg_endo -83.49 159.54 73.03 Favored 'Cis proline' 0 C--O 1.243 0.771 0 C-N-CA 124.327 -1.114 . . . . 0.0 111.218 -2.469 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 28.8 Cg_endo -67.41 104.43 0.91 Allowed 'Trans proline' 0 N--CA 1.451 -1.012 0 C-N-CA 121.818 1.679 . . . . 0.0 111.56 178.905 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 7.6 tp -100.72 138.61 24.41 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.284 0 N-CA-C 108.185 -1.042 . . . . 0.0 108.185 176.891 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -128.65 150.39 50.25 Favored 'General case' 0 N--CA 1.43 -1.433 0 N-CA-C 109.311 -0.626 . . . . 0.0 109.311 -177.797 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 90.3 m-85 -107.94 132.05 21.31 Favored Pre-proline 0 C--N 1.288 -2.075 0 N-CA-C 107.414 -1.328 . . . . 0.0 107.414 174.548 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 21.1 Cg_endo -61.34 -5.68 5.66 Favored 'Trans proline' 0 N--CA 1.485 0.988 0 C-N-CA 123.73 2.953 . . . . 0.0 114.501 -175.758 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 8.7 m-20 . . . . . 0 C--N 1.309 -1.169 0 CA-C-N 116.109 -0.496 . . . . 0.0 109.749 175.087 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.438 -1.199 0 N-CA-C 111.698 -0.561 . . . . 0.0 111.698 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 2' ' ' ARG . . . . . 0.451 ' HB2' ' HB2' ' A' ' 12' ' ' PHE . 95.7 mtt180 -132.53 93.58 3.26 Favored 'General case' 0 C--N 1.317 -0.837 0 CA-C-O 120.92 0.39 . . . . 0.0 110.828 -179.109 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -107.89 137.2 46.3 Favored 'General case' 0 C--N 1.294 -1.834 0 CA-C-N 115.417 -0.811 . . . . 0.0 110.412 177.056 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 53.6 m-85 -115.47 126.2 54.02 Favored 'General case' 0 C--N 1.295 -1.778 0 N-CA-C 107.65 -1.241 . . . . 0.0 107.65 178.944 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -83.66 70.4 10.31 Favored 'General case' 0 C--N 1.309 -1.191 0 CA-C-O 122.751 1.263 . . . . 0.0 111.221 -177.362 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 53.7 m -148.33 158.08 43.88 Favored 'General case' 0 C--N 1.301 -1.505 0 CA-C-N 114.634 -1.166 . . . . 0.0 108.295 179.422 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 7' ' ' LYS . . . . . 0.425 ' HA ' ' C ' ' A' ' 8' ' ' PRO . 7.8 ptpp? -112.95 133.62 21.95 Favored Pre-proline 0 C--N 1.31 -1.123 0 N-CA-C 110.05 -0.352 . . . . 0.0 110.05 179.474 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 8' ' ' PRO . . . . . 0.425 ' C ' ' HA ' ' A' ' 7' ' ' LYS . 12.8 Cg_exo -69.05 138.11 45.56 Favored 'Cis proline' 0 C--N 1.356 0.969 0 C-N-CA 124.334 -1.111 . . . . 0.0 111.814 1.42 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 35.3 Cg_endo -66.01 121.47 8.8 Favored 'Trans proline' 0 C--O 1.24 0.613 0 C-N-CA 122.655 2.236 . . . . 0.0 112.537 -177.163 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 48.6 mm -110.24 121.74 63.59 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.618 0 N-CA-C 107.808 -1.182 . . . . 0.0 107.808 178.564 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -134.29 120.54 20.07 Favored 'General case' 0 CA--C 1.491 -1.327 0 N-CA-C 109.609 -0.515 . . . . 0.0 109.609 179.765 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 12' ' ' PHE . . . . . 0.451 ' HB2' ' HB2' ' A' ' 2' ' ' ARG . 99.9 m-85 -90.47 128.25 49.65 Favored Pre-proline 0 C--N 1.288 -2.07 0 N-CA-C 107.411 -1.329 . . . . 0.0 107.411 175.082 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 12.5 Cg_endo -53.8 -20.43 17.37 Favored 'Trans proline' 0 N--CA 1.484 0.927 0 C-N-CA 124.307 3.338 . . . . 0.0 114.593 -172.627 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 17.5 m-20 . . . . . 0 C--N 1.316 -0.866 0 C-N-CA 123.303 0.641 . . . . 0.0 111.73 -179.091 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.436 -1.36 0 N-CA-C 110.682 -0.967 . . . . 0.0 110.682 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 2' ' ' ARG . . . . . 0.458 ' O ' ' HA ' ' A' ' 11' ' ' ALA . 26.7 mtt180 -124.26 93.65 3.98 Favored 'General case' 0 C--N 1.315 -0.917 0 N-CA-C 108.268 -1.012 . . . . 0.0 108.268 -178.958 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -108.1 134.76 50.52 Favored 'General case' 0 C--N 1.293 -1.872 0 CA-C-O 120.999 0.428 . . . . 0.0 110.959 178.091 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 4' ' ' TYR . . . . . 0.455 ' HD1' ' O ' ' A' ' 10' ' ' ILE . 96.3 m-85 -104.05 142.42 34.48 Favored 'General case' 0 C--N 1.302 -1.463 0 CA-C-N 115.536 -0.757 . . . . 0.0 110.218 -179.698 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 12.8 mptt -82.63 -30.08 29.67 Favored 'General case' 0 C--O 1.246 0.891 0 CA-C-N 115.852 -0.613 . . . . 0.0 111.549 -177.23 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 10.6 m -66.24 155.28 37.56 Favored 'General case' 0 N--CA 1.442 -0.862 0 CA-C-N 115.587 -0.733 . . . . 0.0 110.237 -178.589 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 7' ' ' LYS . . . . . 0.45 ' HD2' ' N ' ' A' ' 7' ' ' LYS . 3.5 mptp? -104.56 135.39 19.32 Favored Pre-proline 0 N--CA 1.437 -1.121 0 N-CA-C 109.183 -0.673 . . . . 0.0 109.183 179.294 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 67.2 Cg_endo -70.54 136.15 38.99 Favored 'Cis proline' 0 N--CA 1.484 0.912 0 C-N-CA 124.373 -1.094 . . . . 0.0 112.374 1.384 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 42.9 Cg_endo -71.68 107.32 2.16 Favored 'Trans proline' 0 N--CA 1.447 -1.207 0 C-N-CA 122.049 1.833 . . . . 0.0 111.52 179.63 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 10' ' ' ILE . . . . . 0.455 ' O ' ' HD1' ' A' ' 4' ' ' TYR . 50.6 mm -93.7 129.69 43.73 Favored 'Isoleucine or valine' 0 C--N 1.291 -1.952 0 N-CA-C 108.35 -0.981 . . . . 0.0 108.35 179.616 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 11' ' ' ALA . . . . . 0.458 ' HA ' ' O ' ' A' ' 2' ' ' ARG . . . -126.8 126.52 43.53 Favored 'General case' 0 N--CA 1.434 -1.249 0 N-CA-C 109.582 -0.525 . . . . 0.0 109.582 177.702 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 74.6 m-85 -98.66 132.19 24.42 Favored Pre-proline 0 C--N 1.291 -1.956 0 N-CA-C 107.181 -1.414 . . . . 0.0 107.181 175.809 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 26.5 Cg_endo -57.67 -8.98 4.77 Favored 'Trans proline' 0 N--CA 1.485 1.002 0 C-N-CA 124.169 3.246 . . . . 0.0 115.064 -173.035 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 14' ' ' ASP . . . . . 0.402 ' HB2' ' HE ' ' A' ' 2' ' ' ARG . 45.3 m-20 . . . . . 0 C--N 1.319 -0.742 0 CA-C-O 120.729 0.3 . . . . 0.0 110.308 178.131 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 101' ' ' WMH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.434 -1.483 0 N-CA-C 112.664 -0.175 . . . . 0.0 112.664 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 73.8 mtm180 -134.97 102.78 5.34 Favored 'General case' 0 C--N 1.305 -1.363 0 N-CA-C 109.968 -0.382 . . . . 0.0 109.968 177.634 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -118.49 134.41 55.1 Favored 'General case' 0 C--N 1.287 -2.151 0 CA-C-N 115.802 -0.635 . . . . 0.0 111.44 178.764 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 92.2 m-85 -88.25 122.18 31.49 Favored 'General case' 0 N--CA 1.421 -1.881 0 N-CA-C 106.263 -1.755 . . . . 0.0 106.263 171.92 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 10.5 mtmp? -80.94 -5.63 57.71 Favored 'General case' 0 C--N 1.311 -1.098 0 CA-C-O 121.237 0.541 . . . . 0.0 111.106 -176.314 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 11.5 p -83.95 148.33 26.97 Favored 'General case' 0 N--CA 1.425 -1.717 0 CA-C-N 115.423 -0.808 . . . . 0.0 109.361 175.977 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 55.3 mtpt -97.7 141.34 22.84 Favored Pre-proline 0 C--N 1.304 -1.385 0 N-CA-C 108.071 -1.085 . . . . 0.0 108.071 177.248 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 24.7 Cg_exo -66.74 140.54 50.5 Favored 'Cis proline' 0 N--CA 1.486 1.039 0 CA-C-N 119.813 0.969 . . . . 0.0 113.435 2.11 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 57.6 Cg_endo -70.73 109.25 2.45 Favored 'Trans proline' 0 C--O 1.244 0.78 0 C-N-CA 123.251 2.634 . . . . 0.0 113.542 -177.837 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 64.1 mt -109.09 122.29 63.52 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.346 0 N-CA-C 107.659 -1.238 . . . . 0.0 107.659 175.87 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -133.52 154.04 51.15 Favored 'General case' 0 C--N 1.317 -0.819 0 CA-C-O 121.175 0.512 . . . . 0.0 110.926 -177.307 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 99.8 m-85 -121.63 131.36 24.46 Favored Pre-proline 0 C--N 1.297 -1.698 0 N-CA-C 107.052 -1.462 . . . . 0.0 107.052 173.916 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 37.5 Cg_exo -58.83 -12.66 15.53 Favored 'Trans proline' 0 N--CA 1.489 1.215 0 C-N-CA 123.965 3.11 . . . . 0.0 115.188 -174.514 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 5.8 p-10 . . . . . 0 C--N 1.318 -0.77 0 CA-C-O 120.93 0.395 . . . . 0.0 110.832 178.203 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 101' ' ' WMH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.492 -1.403 0 N-CA-C 110.424 -1.071 . . . . 0.0 110.424 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 82.0 mtt180 -128.61 100.62 5.82 Favored 'General case' 0 C--N 1.315 -0.913 0 N-CA-C 108.379 -0.971 . . . . 0.0 108.379 -178.8 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -110.71 135.5 51.22 Favored 'General case' 0 C--N 1.29 -1.985 0 CA-C-N 116.351 -0.386 . . . . 0.0 111.12 -179.428 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 4' ' ' TYR . . . . . 0.469 ' HD1' ' O ' ' A' ' 10' ' ' ILE . 94.8 m-85 -88.91 141.16 28.73 Favored 'General case' 0 C--N 1.301 -1.533 0 CA-C-N 115.92 -0.582 . . . . 0.0 109.568 176.325 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 66.2 mttm -92.54 -42.1 9.88 Favored 'General case' 0 C--N 1.3 -1.564 0 N-CA-C 108.895 -0.78 . . . . 0.0 108.895 -179.106 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 24.9 m -65.42 127.13 30.54 Favored 'General case' 0 N--CA 1.424 -1.725 0 N-CA-C 108.668 -0.864 . . . . 0.0 108.668 176.867 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 42.7 mmtm -75.12 146.07 81.52 Favored Pre-proline 0 C--N 1.306 -1.302 0 CA-C-N 115.741 -0.663 . . . . 0.0 110.643 -173.773 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 56.7 Cg_endo -71.29 144.33 79.21 Favored 'Cis proline' 0 C--N 1.352 0.711 0 C-N-CA 123.979 -1.259 . . . . 0.0 112.729 1.63 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 55.4 Cg_endo -73.16 96.03 0.86 Allowed 'Trans proline' 0 N--CA 1.446 -1.3 0 C-N-CA 122.22 1.947 . . . . 0.0 111.574 -179.178 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 10' ' ' ILE . . . . . 0.469 ' O ' ' HD1' ' A' ' 4' ' ' TYR . 50.4 mm -92.32 134.4 30.58 Favored 'Isoleucine or valine' 0 C--N 1.294 -1.814 0 N-CA-C 106.642 -1.614 . . . . 0.0 106.642 177.64 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -130.98 144.32 51.39 Favored 'General case' 0 C--N 1.303 -1.434 0 C-N-CA 119.925 -0.71 . . . . 0.0 109.323 179.081 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 80.1 m-85 -109.46 129.54 23.79 Favored Pre-proline 0 C--N 1.288 -2.093 0 N-CA-C 107.311 -1.366 . . . . 0.0 107.311 173.264 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 3.4 Cg_exo -49.18 -17.06 1.22 Allowed 'Trans proline' 0 C--N 1.361 1.226 0 C-N-CA 124.522 3.481 . . . . 0.0 114.689 179.599 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 25.5 t70 . . . . . 0 C--N 1.318 -0.763 0 CA-C-O 121.672 0.749 . . . . 0.0 110.569 175.703 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 101' ' ' WMH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.431 -1.658 0 N-CA-C 109.804 -1.319 . . . . 0.0 109.804 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 2' ' ' ARG . . . . . 0.462 ' HB3' ' HB2' ' A' ' 12' ' ' PHE . 9.6 ttm180 -135.76 98.28 3.87 Favored 'General case' 0 N--CA 1.431 -1.378 0 N-CA-C 109.57 -0.53 . . . . 0.0 109.57 -177.67 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -107.56 134.99 49.77 Favored 'General case' 0 C--N 1.289 -2.058 0 CA-C-O 121.639 0.733 . . . . 0.0 112.001 179.839 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 66.9 m-85 -101.18 105.49 16.63 Favored 'General case' 0 C--N 1.287 -2.121 0 N-CA-C 107.182 -1.414 . . . . 0.0 107.182 172.137 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 56.5 mtmt -86.1 -7.29 58.7 Favored 'General case' 0 C--N 1.31 -1.109 0 CA-C-N 115.36 -0.836 . . . . 0.0 109.945 -178.652 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 14.9 m -85.88 168.15 14.48 Favored 'General case' 0 N--CA 1.432 -1.364 0 N-CA-C 106.052 -1.833 . . . . 0.0 106.052 171.931 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 18.2 ptpt -95.44 146.34 31.14 Favored Pre-proline 0 C--N 1.301 -1.534 0 C-N-CA 118.998 -1.081 . . . . 0.0 111.262 -179.601 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 6.0 Cg_exo -76.58 138.88 56.87 Favored 'Cis proline' 0 C--N 1.349 0.596 0 C-N-CA 124.045 -1.231 . . . . 0.0 112.235 0.531 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 32.4 Cg_endo -65.74 114.96 3.15 Favored 'Trans proline' 0 C--O 1.239 0.546 0 C-N-CA 122.489 2.126 . . . . 0.0 111.441 -179.896 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 7.3 tp -142.29 132.58 24.08 Favored 'Isoleucine or valine' 0 C--N 1.293 -1.871 0 N-CA-C 108.529 -0.915 . . . . 0.0 108.529 179.219 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -124.23 123.2 39.73 Favored 'General case' 0 N--CA 1.434 -1.267 0 CA-C-O 121.333 0.587 . . . . 0.0 110.006 -178.858 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 12' ' ' PHE . . . . . 0.465 ' HA ' ' HD3' ' A' ' 13' ' ' PRO . 82.6 m-85 -95.69 132.3 27.65 Favored Pre-proline 0 C--N 1.282 -2.349 0 N-CA-C 108.282 -1.007 . . . . 0.0 108.282 -179.877 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 13' ' ' PRO . . . . . 0.465 ' HD3' ' HA ' ' A' ' 12' ' ' PHE . 25.6 Cg_exo -60.91 9.33 0.08 OUTLIER 'Trans proline' 0 N--CA 1.491 1.335 0 C-N-CA 124.497 3.464 . . . . 0.0 116.112 -174.047 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 6.7 p-10 . . . . . 0 C--N 1.3 -1.573 0 N-CA-C 108.82 -0.807 . . . . 0.0 108.82 176.48 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 101' ' ' WMH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.44 -1.082 0 N-CA-C 110.856 -0.898 . . . . 0.0 110.856 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 90.7 mtt180 -110.19 97.54 7.0 Favored 'General case' 0 C--N 1.315 -0.912 0 N-CA-C 109.329 -0.619 . . . . 0.0 109.329 -177.744 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -108.59 135.28 50.11 Favored 'General case' 0 C--N 1.303 -1.437 0 CA-C-N 115.356 -0.838 . . . . 0.0 112.862 -179.437 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 55.8 m-85 -92.22 151.93 20.1 Favored 'General case' 0 C--N 1.3 -1.548 0 CA-C-N 114.684 -1.144 . . . . 0.0 109.109 173.718 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -101.95 -1.48 31.85 Favored 'General case' 0 C--N 1.308 -1.219 0 CA-C-O 121.797 0.808 . . . . 0.0 110.59 175.04 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 25.5 m -89.13 130.94 35.49 Favored 'General case' 0 N--CA 1.425 -1.712 0 CA-C-N 115.057 -0.974 . . . . 0.0 108.716 177.29 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 7' ' ' LYS . . . . . 0.494 ' HA ' ' C ' ' A' ' 8' ' ' PRO . 2.9 mppt? -92.63 141.16 24.22 Favored Pre-proline 0 C--N 1.315 -0.905 0 N-CA-C 109.495 -0.557 . . . . 0.0 109.495 179.486 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 8' ' ' PRO . . . . . 0.494 ' C ' ' HA ' ' A' ' 7' ' ' LYS . 38.4 Cg_exo -63.1 132.98 12.86 Favored 'Cis proline' 0 C--N 1.353 0.797 0 C-N-CA 124.312 -1.12 . . . . 0.0 111.066 -1.261 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 9' ' ' PRO . . . . . 0.491 ' HB2' ' N1 ' ' A' ' 101' ' ' WMH . 70.6 Cg_endo -76.86 119.14 5.01 Favored 'Trans proline' 0 N--CA 1.445 -1.33 0 C-N-CA 122.377 2.051 . . . . 0.0 112.718 -173.878 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 73.7 mt -98.29 121.97 49.44 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.708 0 CA-C-N 115.242 -0.89 . . . . 0.0 108.859 178.435 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -127.63 119.18 25.35 Favored 'General case' 0 N--CA 1.439 -0.986 0 CA-C-O 121.095 0.474 . . . . 0.0 109.964 178.182 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 97.3 m-85 -89.6 131.38 40.14 Favored Pre-proline 0 C--N 1.288 -2.092 0 N-CA-C 107.917 -1.142 . . . . 0.0 107.917 175.989 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 81.4 Cg_exo -52.54 -7.73 0.34 Allowed 'Trans proline' 0 N--CA 1.505 2.205 0 C-N-CA 124.932 3.754 . . . . 0.0 115.067 -178.763 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 25.8 t70 . . . . . 0 C--N 1.314 -0.955 0 CA-C-O 121.579 0.704 . . . . 0.0 109.583 174.306 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 101' ' ' WMH . . . . . 0.491 ' N1 ' ' HB2' ' A' ' 9' ' ' PRO . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.423 -2.214 0 N-CA-C 110.677 -0.969 . . . . 0.0 110.677 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 54.5 mtt180 -134.01 105.53 6.76 Favored 'General case' 0 C--N 1.312 -1.026 0 N-CA-C 108.539 -0.911 . . . . 0.0 108.539 -178.048 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -118.98 134.59 55.1 Favored 'General case' 0 C--N 1.298 -1.667 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.631 177.635 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 80.2 m-85 -96.66 129.09 44.13 Favored 'General case' 0 C--N 1.298 -1.647 0 CA-C-N 115.305 -0.861 . . . . 0.0 110.352 177.425 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 34.5 mtmm -90.05 -16.1 30.42 Favored 'General case' 0 C--N 1.306 -1.312 0 CA-C-O 121.71 0.767 . . . . 0.0 109.643 177.674 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 23.0 m -81.12 135.65 35.82 Favored 'General case' 0 N--CA 1.419 -2.014 0 N-CA-C 108.032 -1.099 . . . . 0.0 108.032 175.534 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 2.0 mppt? -80.49 135.84 52.96 Favored Pre-proline 0 C--N 1.305 -1.335 0 N-CA-C 109.681 -0.488 . . . . 0.0 109.681 -176.72 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 8' ' ' PRO . . . . . 0.46 ' HA ' ' HD3' ' A' ' 9' ' ' PRO . 61.1 Cg_endo -73.43 132.19 25.83 Favored 'Cis proline' 0 CA--C 1.542 0.922 0 C-N-CA 124.131 -1.195 . . . . 0.0 112.848 1.694 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 9' ' ' PRO . . . . . 0.46 ' HD3' ' HA ' ' A' ' 8' ' ' PRO . 8.9 Cg_exo -72.08 97.11 0.81 Allowed 'Trans proline' 0 N--CA 1.455 -0.766 0 C-N-CA 122.432 2.088 . . . . 0.0 111.272 -179.351 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 61.4 mt -94.69 136.01 27.18 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.798 0 CA-C-N 115.895 -0.593 . . . . 0.0 109.678 179.336 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -124.2 151.81 43.63 Favored 'General case' 0 N--CA 1.437 -1.11 0 CA-C-O 121.407 0.623 . . . . 0.0 110.947 179.22 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 96.4 m-85 -130.09 132.92 24.4 Favored Pre-proline 0 C--N 1.297 -1.683 0 C-N-CA 124.935 1.294 . . . . 0.0 108.301 179.205 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 33.6 Cg_exo -58.84 -12.2 14.24 Favored 'Trans proline' 0 N--CA 1.497 1.733 0 C-N-CA 123.715 2.943 . . . . 0.0 113.135 -178.899 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 11.1 t70 . . . . . 0 C--O 1.241 0.61 0 C-N-CA 124.227 1.011 . . . . 0.0 109.305 175.419 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 101' ' ' WMH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.437 -1.274 0 N-CA-C 110.811 -0.915 . . . . 0.0 110.811 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 2' ' ' ARG . . . . . 0.475 ' HE ' ' HB2' ' A' ' 14' ' ' ASP . 73.2 mtm180 -103.63 107.27 18.05 Favored 'General case' 0 C--N 1.313 -0.986 0 N-CA-C 109.899 -0.408 . . . . 0.0 109.899 -176.51 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -122.11 146.31 47.34 Favored 'General case' 0 C--N 1.3 -1.566 0 C-N-CA 123.325 0.65 . . . . 0.0 111.573 -179.538 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 97.5 m-85 -115.11 130.56 56.96 Favored 'General case' 0 C--N 1.301 -1.533 0 N-CA-C 108.674 -0.861 . . . . 0.0 108.674 174.758 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 2.6 mppt? -92.88 85.99 5.34 Favored 'General case' 0 N--CA 1.431 -1.384 0 N-CA-C 106.923 -1.51 . . . . 0.0 106.923 176.511 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 13.5 p -139.54 171.28 14.48 Favored 'General case' 0 C--N 1.285 -2.227 0 CA-C-N 114.139 -1.391 . . . . 0.0 108.572 -176.572 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 7' ' ' LYS . . . . . 0.408 ' HA ' ' HA ' ' A' ' 8' ' ' PRO . 4.8 mptp? -113.5 108.7 51.75 Favored Pre-proline 0 C--N 1.309 -1.167 0 N-CA-C 109.211 -0.663 . . . . 0.0 109.211 174.207 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 8' ' ' PRO . . . . . 0.429 ' HA ' ' HD3' ' A' ' 9' ' ' PRO . 1.3 Cg_endo -85.21 154.36 59.56 Favored 'Cis proline' 0 C--O 1.245 0.829 0 CA-C-N 119.643 0.908 . . . . 0.0 111.362 0.245 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 9' ' ' PRO . . . . . 0.429 ' HD3' ' HA ' ' A' ' 8' ' ' PRO . 3.4 Cg_exo -72.63 124.5 9.83 Favored 'Trans proline' 0 N--CA 1.457 -0.623 0 C-N-CA 122.42 2.08 . . . . 0.0 111.87 -178.11 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 48.7 mm -106.75 130.35 58.8 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.212 0 N-CA-C 108.377 -0.971 . . . . 0.0 108.377 179.64 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -134.33 153.99 51.58 Favored 'General case' 0 CA--C 1.508 -0.667 0 CA-C-O 121.251 0.548 . . . . 0.0 110.667 -178.263 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 97.6 m-85 -125.11 131.77 24.16 Favored Pre-proline 0 C--N 1.291 -1.973 0 N-CA-C 106.918 -1.512 . . . . 0.0 106.918 175.098 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 31.3 Cg_exo -59.57 4.13 0.17 Allowed 'Trans proline' 0 N--CA 1.497 1.734 0 C-N-CA 124.444 3.43 . . . . 0.0 115.262 -174.944 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 14' ' ' ASP . . . . . 0.475 ' HB2' ' HE ' ' A' ' 2' ' ' ARG . 8.5 m-20 . . . . . 0 C--N 1.307 -1.281 0 N-CA-C 108.854 -0.795 . . . . 0.0 108.854 174.338 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 101' ' ' WMH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.485 -1.784 0 N-CA-C 108.767 -1.733 . . . . 0.0 108.767 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 6.9 tpp180 -130.1 103.1 6.55 Favored 'General case' 0 N--CA 1.431 -1.389 0 N-CA-C 108.535 -0.913 . . . . 0.0 108.535 -174.93 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -108.99 133.83 52.45 Favored 'General case' 0 C--N 1.296 -1.732 0 CA-C-O 120.89 0.376 . . . . 0.0 111.816 -179.561 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 96.6 m-85 -119.15 103.76 9.82 Favored 'General case' 0 C--N 1.303 -1.418 0 N-CA-C 108.475 -0.935 . . . . 0.0 108.475 176.399 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 55.7 mtpt -87.05 76.15 9.38 Favored 'General case' 0 N--CA 1.426 -1.658 0 CA-C-O 122.503 1.144 . . . . 0.0 110.827 -178.71 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 56.8 m -150.09 170.77 18.12 Favored 'General case' 0 C--N 1.279 -2.491 0 N-CA-C 104.578 -2.378 . . . . 0.0 104.578 178.25 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 12.0 mptt -91.91 130.19 39.39 Favored Pre-proline 0 C--N 1.299 -1.63 0 CA-C-N 118.789 0.722 . . . . 0.0 110.837 -177.776 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 96.7 Cg_endo -82.66 150.6 71.12 Favored 'Cis proline' 0 C--O 1.245 0.873 0 C-N-CA 123.993 -1.253 . . . . 0.0 111.083 -4.954 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 28.2 Cg_exo -62.2 109.59 0.86 Allowed 'Trans proline' 0 C--N 1.354 0.83 0 C-N-CA 122.355 2.037 . . . . 0.0 111.207 -179.069 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 8.1 tp -118.36 122.53 69.78 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.755 0 CA-C-O 121.341 0.591 . . . . 0.0 110.262 -179.384 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -126.22 126.84 44.71 Favored 'General case' 0 N--CA 1.433 -1.316 0 CA-C-N 115.601 -0.727 . . . . 0.0 109.177 178.728 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 90.7 m-85 -97.69 132.69 24.57 Favored Pre-proline 0 C--N 1.282 -2.352 0 CA-C-N 114.956 -1.02 . . . . 0.0 109.494 -178.676 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 78.4 Cg_exo -49.68 -16.28 1.37 Allowed 'Trans proline' 0 N--CA 1.502 1.982 0 C-N-CA 124.743 3.629 . . . . 0.0 115.036 179.547 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 28.2 t70 . . . . . 0 N--CA 1.479 0.98 0 CA-C-O 121.818 0.818 . . . . 0.0 109.897 175.259 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 101' ' ' WMH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.496 -1.137 0 N-CA-C 110.161 -1.176 . . . . 0.0 110.161 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 2' ' ' ARG . . . . . 0.549 ' HB3' ' HB2' ' A' ' 12' ' ' PHE . 24.4 ttm180 -132.72 135.07 45.54 Favored 'General case' 0 C--N 1.31 -1.128 0 N-CA-C 107.532 -1.284 . . . . 0.0 107.532 -175.125 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -148.81 134.66 18.95 Favored 'General case' 0 C--N 1.304 -1.406 0 CA-C-O 121.112 0.482 . . . . 0.0 112.005 -175.898 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 80.9 m-85 -90.24 154.59 19.62 Favored 'General case' 0 C--N 1.302 -1.462 0 CA-C-N 115.569 -0.741 . . . . 0.0 109.648 175.964 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 75.2 mmtt -102.87 -0.36 31.34 Favored 'General case' 0 C--N 1.316 -0.869 0 CA-C-O 121.522 0.677 . . . . 0.0 109.739 178.743 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 34.9 m -95.86 170.1 9.54 Favored 'General case' 0 C--N 1.308 -1.212 0 CA-C-N 115.527 -0.76 . . . . 0.0 110.19 179.208 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 35.4 mmtp -98.02 137.15 20.85 Favored Pre-proline 0 C--N 1.308 -1.23 0 N-CA-C 108.538 -0.912 . . . . 0.0 108.538 177.307 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 3.0 Cg_exo -77.83 156.26 95.08 Favored 'Cis proline' 0 C--O 1.251 1.148 0 C-N-CA 124.032 -1.236 . . . . 0.0 111.58 0.164 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 15.0 Cg_exo -66.67 92.11 0.3 Allowed 'Trans proline' 0 N--CA 1.452 -0.929 0 C-N-CA 122.411 2.074 . . . . 0.0 110.596 177.267 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 71.3 mt -98.37 118.22 44.56 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.665 0 CA-C-N 115.472 -0.786 . . . . 0.0 108.96 179.902 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -127.36 150.95 49.37 Favored 'General case' 0 N--CA 1.432 -1.355 0 N-CA-C 109.735 -0.468 . . . . 0.0 109.735 -179.25 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 12' ' ' PHE . . . . . 0.549 ' HB2' ' HB3' ' A' ' 2' ' ' ARG . 43.2 m-85 -117.82 132.86 23.45 Favored Pre-proline 0 C--N 1.296 -1.754 0 C-N-CA 124.413 1.085 . . . . 0.0 108.406 -179.242 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 13' ' ' PRO . . . . . 0.402 ' HD3' ' HA ' ' A' ' 12' ' ' PHE . 37.1 Cg_exo -61.53 -2.74 2.8 Favored 'Trans proline' 0 N--CA 1.494 1.523 0 C-N-CA 123.871 3.047 . . . . 0.0 113.44 -178.527 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 33.6 t70 . . . . . 0 C--N 1.32 -0.697 0 C-N-CA 123.802 0.841 . . . . 0.0 109.035 174.0 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 101' ' ' WMH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.432 -1.618 0 CA-C-O 119.771 -0.461 . . . . 0.0 113.43 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 2' ' ' ARG . . . . . 0.482 ' HB2' ' HB2' ' A' ' 12' ' ' PHE . 65.4 mtp180 -72.39 95.03 1.69 Allowed 'General case' 0 N--CA 1.464 0.256 0 N-CA-C 108.885 -0.783 . . . . 0.0 108.885 176.93 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -107.21 135.1 49.31 Favored 'General case' 0 C--N 1.299 -1.589 0 CA-C-O 121.132 0.492 . . . . 0.0 110.678 -178.927 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 97.2 m-85 -120.86 115.85 24.03 Favored 'General case' 0 C--N 1.293 -1.856 0 CA-C-N 115.168 -0.924 . . . . 0.0 109.552 179.023 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 98.0 mttt -83.06 83.74 7.73 Favored 'General case' 0 N--CA 1.43 -1.454 0 CA-C-O 122.325 1.06 . . . . 0.0 109.051 177.645 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 27.7 m -146.94 171.5 15.14 Favored 'General case' 0 C--N 1.282 -2.349 0 N-CA-C 105.573 -2.01 . . . . 0.0 105.573 -178.914 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 7' ' ' LYS . . . . . 0.414 ' HA ' ' HA ' ' A' ' 8' ' ' PRO . 63.7 mttp -108.9 119.79 47.91 Favored Pre-proline 0 C--N 1.297 -1.68 0 CA-C-N 118.413 0.551 . . . . 0.0 110.642 177.434 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 8' ' ' PRO . . . . . 0.414 ' HA ' ' HA ' ' A' ' 7' ' ' LYS . 88.0 Cg_endo -78.53 152.85 90.79 Favored 'Cis proline' 0 CA--C 1.545 1.069 0 C-N-CA 124.662 -0.974 . . . . 0.0 112.712 -2.084 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 37.5 Cg_endo -71.23 107.14 2.06 Favored 'Trans proline' 0 C--O 1.252 1.211 0 C-N-CA 122.504 2.136 . . . . 0.0 112.088 179.107 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 5.7 tp -100.89 128.89 52.6 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.317 0 CA-C-N 115.356 -0.838 . . . . 0.0 110.116 179.766 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 11' ' ' ALA . . . . . 0.424 ' HA ' ' O ' ' A' ' 2' ' ' ARG . . . -129.62 118.18 21.56 Favored 'General case' 0 N--CA 1.428 -1.565 0 N-CA-C 108.638 -0.875 . . . . 0.0 108.638 177.496 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 12' ' ' PHE . . . . . 0.482 ' HB2' ' HB2' ' A' ' 2' ' ' ARG . 91.0 m-85 -84.56 132.26 47.37 Favored Pre-proline 0 C--N 1.294 -1.835 0 N-CA-C 108.22 -1.03 . . . . 0.0 108.22 178.168 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 0.4 OUTLIER -25.24 -46.22 0.05 OUTLIER 'Trans proline' 0 C--N 1.356 0.971 1 C-N-CA 126.795 4.996 . . . . 0.0 118.343 -174.275 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 14' ' ' ASP . . . . . 0.47 ' OD1' ' HG3' ' A' ' 2' ' ' ARG . 5.7 p-10 . . . . . 0 N--CA 1.474 0.771 0 N-CA-C 111.693 0.257 . . . . 0.0 111.693 -176.344 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 101' ' ' WMH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.486 -1.773 0 N-CA-C 108.995 -1.642 . . . . 0.0 108.995 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 2' ' ' ARG . . . . . 0.502 ' HB3' ' HB2' ' A' ' 12' ' ' PHE . 27.4 ttm180 -137.68 92.41 2.68 Favored 'General case' 0 N--CA 1.431 -1.399 0 N-CA-C 109.289 -0.634 . . . . 0.0 109.289 -175.168 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -109.3 134.46 51.76 Favored 'General case' 0 C--N 1.29 -2.009 0 CA-C-N 115.894 -0.594 . . . . 0.0 111.411 176.817 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 94.4 m-85 -106.61 151.29 25.24 Favored 'General case' 0 C--N 1.298 -1.637 0 CA-C-N 114.994 -1.003 . . . . 0.0 108.415 177.36 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 18.6 ptpt -93.01 -1.73 56.37 Favored 'General case' 0 C--N 1.312 -1.059 0 CA-C-O 121.696 0.76 . . . . 0.0 110.209 -179.223 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 23.5 m -81.66 167.18 19.46 Favored 'General case' 0 N--CA 1.429 -1.496 0 CA-C-N 115.051 -0.977 . . . . 0.0 110.283 179.672 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 7' ' ' LYS . . . . . 0.458 ' HA ' ' C ' ' A' ' 8' ' ' PRO . 20.0 ptmt -113.56 141.66 26.32 Favored Pre-proline 0 C--N 1.308 -1.222 0 CA-C-N 115.953 -0.567 . . . . 0.0 109.915 179.827 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 8' ' ' PRO . . . . . 0.458 ' C ' ' HA ' ' A' ' 7' ' ' LYS . 59.3 Cg_endo -68.56 165.45 72.83 Favored 'Cis proline' 0 N--CA 1.483 0.903 0 C-N-CA 124.17 -1.179 . . . . 0.0 112.007 1.394 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 16.1 Cg_exo -63.35 96.88 0.19 Allowed 'Trans proline' 0 C--N 1.354 0.823 0 C-N-CA 122.198 1.932 . . . . 0.0 112.04 179.873 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 10' ' ' ILE . . . . . 0.434 HG13 ' O ' ' A' ' 8' ' ' PRO . 72.8 mt -93.97 107.2 18.98 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.326 0 CA-C-N 115.33 -0.85 . . . . 0.0 109.093 179.281 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -132.41 132.44 42.8 Favored 'General case' 0 N--CA 1.441 -0.884 0 CA-C-O 121.343 0.592 . . . . 0.0 110.355 178.327 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 12' ' ' PHE . . . . . 0.502 ' HB2' ' HB3' ' A' ' 2' ' ' ARG . 87.8 m-85 -108.96 131.9 21.51 Favored Pre-proline 0 C--N 1.277 -2.556 0 N-CA-C 108.312 -0.995 . . . . 0.0 108.312 176.403 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 11.8 Cg_endo -58.36 -7.99 4.65 Favored 'Trans proline' 0 C--N 1.359 1.124 0 C-N-CA 123.529 2.819 . . . . 0.0 112.956 177.543 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 10.2 t70 . . . . . 0 C--N 1.322 -0.593 0 C-N-CA 123.589 0.756 . . . . 0.0 109.315 171.904 . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 101' ' ' WMH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.445 -0.701 0 N-CA-C 114.489 0.555 . . . . 0.0 114.489 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 2' ' ' ARG . . . . . 0.482 ' O ' ' HA ' ' A' ' 11' ' ' ALA . 26.9 mmm180 -125.09 98.81 5.83 Favored 'General case' 0 C--N 1.31 -1.115 0 CA-C-N 117.51 0.655 . . . . 0.0 110.667 178.592 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -108.08 134.73 50.54 Favored 'General case' 0 C--N 1.306 -1.314 0 N-CA-C 109.719 -0.474 . . . . 0.0 109.719 174.775 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 95.7 m-85 -114.08 125.78 54.35 Favored 'General case' 0 C--N 1.288 -2.098 0 N-CA-C 109.467 -0.568 . . . . 0.0 109.467 178.46 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 5' ' ' LYS . . . . . 0.493 ' H ' ' HD3' ' A' ' 5' ' ' LYS . 0.0 OUTLIER -72.44 -20.72 61.36 Favored 'General case' 0 C--N 1.316 -0.87 0 O-C-N 123.878 0.736 . . . . 0.0 111.276 -179.694 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 60.6 m -73.86 135.59 43.4 Favored 'General case' 0 N--CA 1.433 -1.292 0 CA-C-O 120.757 0.313 . . . . 0.0 110.24 178.854 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 8.4 mtmp? -82.32 141.3 45.84 Favored Pre-proline 0 C--N 1.313 -1.021 0 CA-C-N 115.756 -0.656 . . . . 0.0 110.926 -175.686 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 8' ' ' PRO . . . . . 0.465 ' HA ' ' HD3' ' A' ' 9' ' ' PRO . 14.2 Cg_exo -72.46 132.09 24.61 Favored 'Cis proline' 0 C--O 1.242 0.688 0 C-N-CA 123.776 -1.343 . . . . 0.0 110.902 -1.692 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 9' ' ' PRO . . . . . 0.465 ' HD3' ' HA ' ' A' ' 8' ' ' PRO . 22.5 Cg_exo -65.68 110.45 1.66 Allowed 'Trans proline' 0 N--CA 1.456 -0.694 0 C-N-CA 122.239 1.959 . . . . 0.0 111.296 -178.761 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 6.6 tp -104.68 127.34 59.19 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.736 0 N-CA-C 108.788 -0.819 . . . . 0.0 108.788 178.856 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 11' ' ' ALA . . . . . 0.482 ' HA ' ' O ' ' A' ' 2' ' ' ARG . . . -122.58 121.41 36.41 Favored 'General case' 0 N--CA 1.429 -1.489 0 CA-C-N 115.981 -0.554 . . . . 0.0 109.854 -179.731 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 12' ' ' PHE . . . . . 0.42 ' HA ' ' HD3' ' A' ' 13' ' ' PRO . 86.6 m-85 -94.19 131.65 31.0 Favored Pre-proline 0 C--N 1.282 -2.339 0 CA-C-N 114.996 -1.002 . . . . 0.0 108.451 178.605 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 13' ' ' PRO . . . . . 0.42 ' HD3' ' HA ' ' A' ' 12' ' ' PHE . 63.5 Cg_exo -54.97 -13.3 6.15 Favored 'Trans proline' 0 N--CA 1.494 1.522 0 C-N-CA 124.344 3.362 . . . . 0.0 114.673 -177.852 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 5.2 p-10 . . . . . 0 C--N 1.315 -0.899 0 O-C-N 122.098 -0.376 . . . . 0.0 111.779 178.05 . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 101' ' ' WMH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.433 -1.557 0 N-CA-C 110.776 -0.93 . . . . 0.0 110.776 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 2' ' ' ARG . . . . . 0.495 ' O ' ' HA ' ' A' ' 11' ' ' ALA . 20.3 mmm180 -123.64 97.19 5.27 Favored 'General case' 0 C--N 1.311 -1.081 0 N-CA-C 110.171 -0.307 . . . . 0.0 110.171 -177.646 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -107.2 134.64 49.99 Favored 'General case' 0 C--N 1.293 -1.857 0 CA-C-O 121.116 0.484 . . . . 0.0 110.048 177.507 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 88.9 m-85 -118.93 126.75 52.49 Favored 'General case' 0 C--N 1.302 -1.459 0 CA-C-N 115.444 -0.798 . . . . 0.0 109.303 -179.492 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 54.1 mtmt -88.91 82.91 6.64 Favored 'General case' 0 C--N 1.3 -1.555 0 CA-C-O 121.966 0.889 . . . . 0.0 112.157 -175.163 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 49.8 m -150.49 170.32 19.38 Favored 'General case' 0 C--N 1.292 -1.923 0 N-CA-C 105.938 -1.875 . . . . 0.0 105.938 175.93 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 28.7 mtpp -113.27 125.48 29.62 Favored Pre-proline 0 C--N 1.303 -1.42 0 N-CA-C 108.891 -0.781 . . . . 0.0 108.891 176.951 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 5.6 Cg_exo -75.11 147.08 88.24 Favored 'Cis proline' 0 C--O 1.246 0.922 0 C-N-CA 124.304 -1.123 . . . . 0.0 111.898 0.406 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 9' ' ' PRO . . . . . 0.45 ' HB2' ' N1 ' ' A' ' 101' ' ' WMH . 36.1 Cg_endo -67.41 114.45 3.27 Favored 'Trans proline' 0 N--CA 1.455 -0.773 0 C-N-CA 122.556 2.17 . . . . 0.0 111.702 179.095 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 51.0 mm -99.5 117.61 44.9 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.512 0 N-CA-C 108.683 -0.858 . . . . 0.0 108.683 -179.956 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 11' ' ' ALA . . . . . 0.495 ' HA ' ' O ' ' A' ' 2' ' ' ARG . . . -128.2 128.42 44.72 Favored 'General case' 0 N--CA 1.441 -0.888 0 N-CA-C 109.496 -0.557 . . . . 0.0 109.496 178.787 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 12' ' ' PHE . . . . . 0.433 ' HB2' ' HB2' ' A' ' 2' ' ' ARG . 98.1 m-85 -99.35 131.67 24.66 Favored Pre-proline 0 C--N 1.289 -2.058 0 N-CA-C 108.75 -0.833 . . . . 0.0 108.75 177.072 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 82.5 Cg_exo -50.31 -15.91 1.69 Allowed 'Trans proline' 0 N--CA 1.497 1.716 0 C-N-CA 124.949 3.766 . . . . 0.0 116.113 -176.68 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 24.5 t70 . . . . . 0 N--CA 1.474 0.749 0 CA-C-O 121.351 0.595 . . . . 0.0 110.212 175.483 . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 101' ' ' WMH . . . . . 0.45 ' N1 ' ' HB2' ' A' ' 9' ' ' PRO . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.435 -1.389 0 N-CA-C 109.575 -1.41 . . . . 0.0 109.575 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 38.7 ttm180 -150.98 120.08 6.73 Favored 'General case' 0 C--N 1.303 -1.439 0 N-CA-C 108.744 -0.836 . . . . 0.0 108.744 -175.969 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -129.76 135.49 48.51 Favored 'General case' 0 C--N 1.305 -1.365 0 CA-C-O 121.066 0.46 . . . . 0.0 110.885 -178.734 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 56.7 m-85 -89.18 115.97 27.09 Favored 'General case' 0 C--N 1.297 -1.715 0 CA-C-N 115.321 -0.854 . . . . 0.0 108.793 176.243 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 95.2 mttt -82.04 72.06 9.09 Favored 'General case' 0 C--N 1.317 -0.806 0 CA-C-O 121.76 0.79 . . . . 0.0 110.034 -179.171 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 26.9 m -146.56 166.66 25.82 Favored 'General case' 0 C--N 1.29 -2.011 0 N-CA-C 106.627 -1.62 . . . . 0.0 106.627 179.858 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 28.1 mtpp -114.11 116.36 44.72 Favored Pre-proline 0 C--N 1.291 -1.944 0 N-CA-C 108.949 -0.76 . . . . 0.0 108.949 175.849 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 3.2 Cg_exo -81.87 147.48 68.31 Favored 'Cis proline' 0 CA--C 1.541 0.861 0 C-N-CA 124.813 -0.911 . . . . 0.0 112.987 2.755 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 9' ' ' PRO . . . . . 0.439 ' HB2' ' N1 ' ' A' ' 101' ' ' WMH . 74.1 Cg_endo -82.47 126.94 4.91 Favored 'Trans proline' 0 N--CA 1.447 -1.211 0 C-N-CA 122.467 2.111 . . . . 0.0 112.887 -179.214 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 68.4 mt -102.92 130.46 52.98 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.796 0 N-CA-C 107.289 -1.375 . . . . 0.0 107.289 175.898 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -127.22 153.94 45.47 Favored 'General case' 0 C--N 1.311 -1.087 0 N-CA-C 109.555 -0.535 . . . . 0.0 109.555 179.46 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 89.9 m-85 -124.47 131.73 24.21 Favored Pre-proline 0 C--N 1.295 -1.762 0 CA-C-N 115.627 -0.715 . . . . 0.0 109.324 178.496 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 77.9 Cg_exo -46.5 -19.49 0.7 Allowed 'Trans proline' 0 N--CA 1.501 1.915 1 C-N-CA 125.372 4.048 . . . . 0.0 115.858 -177.565 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 32.1 t70 . . . . . 0 C--N 1.319 -0.753 0 CA-C-O 121.162 0.506 . . . . 0.0 110.765 177.335 . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 101' ' ' WMH . . . . . 0.439 ' N1 ' ' HB2' ' A' ' 9' ' ' PRO . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.435 -1.379 0 N-CA-C 112.094 -0.402 . . . . 0.0 112.094 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 33.4 ttm180 -143.9 128.09 17.68 Favored 'General case' 0 C--N 1.312 -1.051 0 N-CA-C 109.101 -0.703 . . . . 0.0 109.101 179.146 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -120.91 135.52 55.17 Favored 'General case' 0 C--N 1.293 -1.857 0 CA-C-O 120.487 0.184 . . . . 0.0 111.297 178.78 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 96.8 m-85 -101.52 118.78 37.65 Favored 'General case' 0 C--N 1.306 -1.303 0 N-CA-C 108.838 -0.801 . . . . 0.0 108.838 175.716 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 30.2 mmmt -88.18 72.1 9.14 Favored 'General case' 0 N--CA 1.427 -1.595 0 CA-C-O 122.589 1.185 . . . . 0.0 110.913 179.188 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 35.0 m -151.07 170.87 18.34 Favored 'General case' 0 C--N 1.293 -1.852 0 CA-C-N 113.308 -1.769 . . . . 0.0 106.324 178.795 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 19.7 ptpt -98.51 135.65 21.07 Favored Pre-proline 0 C--N 1.295 -1.798 0 N-CA-C 107.406 -1.331 . . . . 0.0 107.406 170.949 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 74.3 Cg_endo -81.25 160.56 82.0 Favored 'Cis proline' 0 CA--C 1.54 0.8 0 C-N-CA 123.533 -1.444 . . . . 0.0 111.277 0.473 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 33.6 Cg_endo -66.41 95.43 0.32 Allowed 'Trans proline' 0 N--CA 1.452 -0.917 0 C-N-CA 121.909 1.739 . . . . 0.0 111.202 177.927 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 49.7 mm -106.72 115.21 47.76 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.46 0 N-CA-C 108.487 -0.931 . . . . 0.0 108.487 179.633 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -125.89 138.97 53.83 Favored 'General case' 0 C--N 1.295 -1.792 0 N-CA-C 107.447 -1.316 . . . . 0.0 107.447 178.196 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 22.2 m-30 -96.11 131.97 27.78 Favored Pre-proline 0 C--N 1.288 -2.077 0 N-CA-C 108.758 -0.83 . . . . 0.0 108.758 179.841 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 13.7 Cg_endo -57.92 -10.77 8.29 Favored 'Trans proline' 0 C--N 1.356 0.925 0 C-N-CA 123.84 3.026 . . . . 0.0 113.704 -179.032 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 24.4 t70 . . . . . 0 C--N 1.317 -0.812 0 CA-C-O 121.446 0.641 . . . . 0.0 110.123 174.754 . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 101' ' ' WMH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.44 -1.074 0 N-CA-C 111.986 -0.446 . . . . 0.0 111.986 . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 21.4 ttm180 -115.94 114.03 24.1 Favored 'General case' 0 C--N 1.316 -0.862 0 C-N-CA 120.713 -0.395 . . . . 0.0 110.053 -178.869 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -108.25 135.51 49.45 Favored 'General case' 0 C--N 1.304 -1.379 0 C-N-CA 123.169 0.587 . . . . 0.0 111.694 -178.542 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 4' ' ' TYR . . . . . 0.45 ' HB2' ' H ' ' A' ' 10' ' ' ILE . 12.1 m-85 -89.81 122.14 32.61 Favored 'General case' 0 C--N 1.301 -1.523 0 N-CA-C 108.641 -0.874 . . . . 0.0 108.641 173.43 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 5' ' ' LYS . . . . . 0.489 ' HD2' ' N ' ' A' ' 5' ' ' LYS . 0.1 OUTLIER -84.0 -22.61 31.31 Favored 'General case' 0 C--N 1.303 -1.425 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.058 -177.218 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 41.4 m -84.5 141.73 30.54 Favored 'General case' 0 N--CA 1.43 -1.464 0 N-CA-C 109.081 -0.711 . . . . 0.0 109.081 176.245 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 38.1 ttpt -67.82 138.98 93.21 Favored Pre-proline 0 C--N 1.308 -1.214 0 C-N-CA 123.504 0.722 . . . . 0.0 109.407 178.581 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 8' ' ' PRO . . . . . 0.445 ' HA ' ' HD3' ' A' ' 9' ' ' PRO . 74.3 Cg_endo -77.15 134.22 34.36 Favored 'Cis proline' 0 C--N 1.351 0.671 0 C-N-CA 123.882 -1.299 . . . . 0.0 111.566 -0.965 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 9' ' ' PRO . . . . . 0.445 ' HD3' ' HA ' ' A' ' 8' ' ' PRO . 21.9 Cg_exo -65.58 105.1 0.72 Allowed 'Trans proline' 0 N--CA 1.457 -0.655 0 C-N-CA 122.017 1.811 . . . . 0.0 111.081 179.916 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 10' ' ' ILE . . . . . 0.45 ' H ' ' HB2' ' A' ' 4' ' ' TYR . 67.8 mt -108.58 128.26 64.38 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.554 0 N-CA-C 107.725 -1.213 . . . . 0.0 107.725 178.207 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -123.09 112.51 17.83 Favored 'General case' 0 N--CA 1.433 -1.278 0 CA-C-O 121.249 0.547 . . . . 0.0 109.764 -179.808 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 92.6 m-85 -79.5 132.1 63.03 Favored Pre-proline 0 C--N 1.289 -2.025 0 CA-C-N 115.039 -0.982 . . . . 0.0 109.487 -179.962 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 84.5 Cg_exo -48.8 -21.32 3.54 Favored 'Trans proline' 0 N--CA 1.495 1.575 0 C-N-CA 124.696 3.597 . . . . 0.0 114.65 -177.2 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 19.2 t70 . . . . . 0 N--CA 1.469 0.486 0 C-N-CA 123.14 0.576 . . . . 0.0 110.376 177.345 . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 101' ' ' WMH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.436 -1.366 0 N-CA-C 111.542 -0.623 . . . . 0.0 111.542 . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 2' ' ' ARG . . . . . 0.47 ' O ' ' HA ' ' A' ' 11' ' ' ALA . 78.5 mtp180 -117.83 102.35 9.03 Favored 'General case' 0 C--N 1.313 -0.995 0 O-C-N 122.568 -0.372 . . . . 0.0 110.521 -179.019 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -107.9 134.56 50.65 Favored 'General case' 0 C--N 1.3 -1.55 0 CA-C-N 115.634 -0.712 . . . . 0.0 109.195 179.002 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 62.9 m-85 -103.75 154.55 19.44 Favored 'General case' 0 C--N 1.295 -1.79 0 CA-C-N 115.726 -0.67 . . . . 0.0 110.936 179.749 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -88.19 -27.66 21.68 Favored 'General case' 0 C--N 1.313 -0.991 0 N-CA-C 108.615 -0.883 . . . . 0.0 108.615 -178.467 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 11.8 p -62.79 135.53 57.39 Favored 'General case' 0 N--CA 1.433 -1.283 0 CA-C-N 115.093 -0.958 . . . . 0.0 111.021 -179.572 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 96.6 mttt -90.97 139.67 25.94 Favored Pre-proline 0 C--N 1.309 -1.164 0 N-CA-C 110.164 -0.31 . . . . 0.0 110.164 -178.66 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 8' ' ' PRO . . . . . 0.492 ' HA ' ' HD3' ' A' ' 9' ' ' PRO . 57.1 Cg_endo -73.16 133.11 29.04 Favored 'Cis proline' 0 C--O 1.245 0.855 0 C-N-CA 123.73 -1.363 . . . . 0.0 110.948 -3.005 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 9' ' ' PRO . . . . . 0.492 ' HD3' ' HA ' ' A' ' 8' ' ' PRO . 22.1 Cg_exo -65.65 115.21 3.26 Favored 'Trans proline' 0 N--CA 1.453 -0.861 0 C-N-CA 122.053 1.835 . . . . 0.0 111.636 -178.231 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 7.9 tp -97.9 136.3 29.27 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.741 0 N-CA-C 107.815 -1.18 . . . . 0.0 107.815 177.212 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 11' ' ' ALA . . . . . 0.47 ' HA ' ' O ' ' A' ' 2' ' ' ARG . . . -123.74 112.37 17.26 Favored 'General case' 0 N--CA 1.436 -1.163 0 N-CA-C 109.333 -0.617 . . . . 0.0 109.333 177.527 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 93.9 m-85 -79.48 132.57 61.7 Favored Pre-proline 0 C--N 1.294 -1.816 0 N-CA-C 108.341 -0.985 . . . . 0.0 108.341 178.55 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 8.5 Cg_endo -48.3 -21.17 2.85 Favored 'Trans proline' 0 N--CA 1.496 1.649 0 C-N-CA 124.975 3.784 . . . . 0.0 115.561 -175.558 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 34.0 t70 . . . . . 0 N--CA 1.473 0.715 0 CA-C-O 121.668 0.747 . . . . 0.0 110.375 177.908 . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 101' ' ' WMH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.436 -1.305 0 CA-C-O 120.242 -0.199 . . . . 0.0 112.695 . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 71.6 ttt180 -152.64 129.88 11.24 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 116.79 0.295 . . . . 0.0 110.252 177.843 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -130.56 134.71 47.24 Favored 'General case' 0 C--N 1.305 -1.345 0 C-N-CA 123.078 0.551 . . . . 0.0 111.298 178.711 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 58.7 m-85 -92.77 137.85 32.0 Favored 'General case' 0 C--N 1.31 -1.144 0 CA-C-N 115.908 -0.587 . . . . 0.0 110.151 177.047 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 75.7 mmtt -88.53 -43.94 11.04 Favored 'General case' 0 C--N 1.303 -1.445 0 N-CA-C 109.094 -0.706 . . . . 0.0 109.094 179.322 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 37.5 m -79.9 155.78 27.6 Favored 'General case' 0 N--CA 1.437 -1.084 0 CA-C-N 115.42 -0.809 . . . . 0.0 110.502 179.74 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 53.0 mtmt -79.74 136.88 54.74 Favored Pre-proline 0 C--N 1.313 -1.019 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.144 -178.238 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 8' ' ' PRO . . . . . 0.449 ' HA ' ' HD3' ' A' ' 9' ' ' PRO . 78.1 Cg_endo -75.28 127.81 15.24 Favored 'Cis proline' 0 CA--C 1.54 0.822 0 C-N-CA 123.988 -1.255 . . . . 0.0 112.84 2.774 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 9' ' ' PRO . . . . . 0.449 ' HD3' ' HA ' ' A' ' 8' ' ' PRO . 3.4 Cg_exo -79.44 87.69 1.52 Allowed 'Trans proline' 0 N--CA 1.436 -1.896 0 C-N-CA 121.748 1.632 . . . . 0.0 109.79 178.574 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 13.3 tt -105.61 140.15 24.57 Favored 'Isoleucine or valine' 0 C--N 1.291 -1.964 0 N-CA-C 108.57 -0.9 . . . . 0.0 108.57 179.029 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -118.15 145.49 44.88 Favored 'General case' 0 N--CA 1.422 -1.861 0 N-CA-C 108.41 -0.959 . . . . 0.0 108.41 178.955 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 48.0 m-85 -110.12 131.7 21.85 Favored Pre-proline 0 C--N 1.276 -2.588 0 N-CA-C 108.038 -1.097 . . . . 0.0 108.038 178.487 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 37.2 Cg_endo -65.87 3.17 1.31 Allowed 'Trans proline' 0 N--CA 1.486 1.033 0 C-N-CA 123.592 2.861 . . . . 0.0 112.716 -179.969 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 51.3 m-20 . . . . . 0 C--N 1.321 -0.667 0 N-CA-C 108.993 -0.743 . . . . 0.0 108.993 176.827 . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 101' ' ' WMH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.433 -1.524 0 N-CA-C 111.212 -0.755 . . . . 0.0 111.212 . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 4.4 tpp180 -143.34 105.24 4.36 Favored 'General case' 0 C--N 1.31 -1.119 0 N-CA-C 109.781 -0.451 . . . . 0.0 109.781 179.236 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -108.14 135.26 49.78 Favored 'General case' 0 C--N 1.294 -1.823 0 CA-C-N 115.868 -0.606 . . . . 0.0 110.286 179.003 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 47.0 m-85 -98.16 139.68 33.6 Favored 'General case' 0 C--N 1.298 -1.654 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.66 178.561 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 18.8 ptmt -94.44 12.4 27.32 Favored 'General case' 0 C--N 1.309 -1.188 0 CA-C-O 122.006 0.908 . . . . 0.0 109.702 -179.955 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 41.5 m -75.75 171.02 15.08 Favored 'General case' 0 C--N 1.308 -1.219 0 CA-C-N 114.185 -1.371 . . . . 0.0 109.734 176.097 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 7' ' ' LYS . . . . . 0.428 ' HA ' ' HA ' ' A' ' 8' ' ' PRO . 24.1 ttmm -108.15 118.24 53.0 Favored Pre-proline 0 C--N 1.304 -1.373 0 N-CA-C 109.673 -0.492 . . . . 0.0 109.673 177.581 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 8' ' ' PRO . . . . . 0.428 ' HA ' ' HA ' ' A' ' 7' ' ' LYS . 93.7 Cg_endo -83.49 159.54 73.03 Favored 'Cis proline' 0 C--O 1.243 0.771 0 C-N-CA 124.327 -1.114 . . . . 0.0 111.218 -2.469 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 28.8 Cg_endo -67.41 104.43 0.91 Allowed 'Trans proline' 0 N--CA 1.451 -1.012 0 C-N-CA 121.818 1.679 . . . . 0.0 111.56 178.905 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 7.6 tp -100.72 138.61 24.41 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.284 0 N-CA-C 108.185 -1.042 . . . . 0.0 108.185 176.891 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -128.65 150.39 50.25 Favored 'General case' 0 N--CA 1.43 -1.433 0 N-CA-C 109.311 -0.626 . . . . 0.0 109.311 -177.797 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 90.3 m-85 -107.94 132.05 21.31 Favored Pre-proline 0 C--N 1.288 -2.075 0 N-CA-C 107.414 -1.328 . . . . 0.0 107.414 174.548 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 21.1 Cg_endo -61.34 -5.68 5.66 Favored 'Trans proline' 0 N--CA 1.485 0.988 0 C-N-CA 123.73 2.953 . . . . 0.0 114.501 -175.758 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 8.7 m-20 . . . . . 0 C--N 1.309 -1.169 0 CA-C-N 116.109 -0.496 . . . . 0.0 109.749 175.087 . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 101' ' ' WMH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.438 -1.199 0 N-CA-C 111.698 -0.561 . . . . 0.0 111.698 . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 2' ' ' ARG . . . . . 0.451 ' HB2' ' HB2' ' A' ' 12' ' ' PHE . 95.7 mtt180 -132.53 93.58 3.26 Favored 'General case' 0 C--N 1.317 -0.837 0 CA-C-O 120.92 0.39 . . . . 0.0 110.828 -179.109 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -107.89 137.2 46.3 Favored 'General case' 0 C--N 1.294 -1.834 0 CA-C-N 115.417 -0.811 . . . . 0.0 110.412 177.056 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 53.6 m-85 -115.47 126.2 54.02 Favored 'General case' 0 C--N 1.295 -1.778 0 N-CA-C 107.65 -1.241 . . . . 0.0 107.65 178.944 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -83.66 70.4 10.31 Favored 'General case' 0 C--N 1.309 -1.191 0 CA-C-O 122.751 1.263 . . . . 0.0 111.221 -177.362 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 53.7 m -148.33 158.08 43.88 Favored 'General case' 0 C--N 1.301 -1.505 0 CA-C-N 114.634 -1.166 . . . . 0.0 108.295 179.422 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 7' ' ' LYS . . . . . 0.425 ' HA ' ' C ' ' A' ' 8' ' ' PRO . 7.8 ptpp? -112.95 133.62 21.95 Favored Pre-proline 0 C--N 1.31 -1.123 0 N-CA-C 110.05 -0.352 . . . . 0.0 110.05 179.474 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 8' ' ' PRO . . . . . 0.425 ' C ' ' HA ' ' A' ' 7' ' ' LYS . 12.8 Cg_exo -69.05 138.11 45.56 Favored 'Cis proline' 0 C--N 1.356 0.969 0 C-N-CA 124.334 -1.111 . . . . 0.0 111.814 1.42 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 35.3 Cg_endo -66.01 121.47 8.8 Favored 'Trans proline' 0 C--O 1.24 0.613 0 C-N-CA 122.655 2.236 . . . . 0.0 112.537 -177.163 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 48.6 mm -110.24 121.74 63.59 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.618 0 N-CA-C 107.808 -1.182 . . . . 0.0 107.808 178.564 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -134.29 120.54 20.07 Favored 'General case' 0 CA--C 1.491 -1.327 0 N-CA-C 109.609 -0.515 . . . . 0.0 109.609 179.765 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 12' ' ' PHE . . . . . 0.451 ' HB2' ' HB2' ' A' ' 2' ' ' ARG . 99.9 m-85 -90.47 128.25 49.65 Favored Pre-proline 0 C--N 1.288 -2.07 0 N-CA-C 107.411 -1.329 . . . . 0.0 107.411 175.082 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 12.5 Cg_endo -53.8 -20.43 17.37 Favored 'Trans proline' 0 N--CA 1.484 0.927 0 C-N-CA 124.307 3.338 . . . . 0.0 114.593 -172.627 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 17.5 m-20 . . . . . 0 C--N 1.316 -0.866 0 C-N-CA 123.303 0.641 . . . . 0.0 111.73 -179.091 . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 101' ' ' WMH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.436 -1.36 0 N-CA-C 110.682 -0.967 . . . . 0.0 110.682 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 2' ' ' ARG . . . . . 0.458 ' O ' ' HA ' ' A' ' 11' ' ' ALA . 26.7 mtt180 -124.26 93.65 3.98 Favored 'General case' 0 C--N 1.315 -0.917 0 N-CA-C 108.268 -1.012 . . . . 0.0 108.268 -178.958 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -108.1 134.76 50.52 Favored 'General case' 0 C--N 1.293 -1.872 0 CA-C-O 120.999 0.428 . . . . 0.0 110.959 178.091 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 4' ' ' TYR . . . . . 0.455 ' HD1' ' O ' ' A' ' 10' ' ' ILE . 96.3 m-85 -104.05 142.42 34.48 Favored 'General case' 0 C--N 1.302 -1.463 0 CA-C-N 115.536 -0.757 . . . . 0.0 110.218 -179.698 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 12.8 mptt -82.63 -30.08 29.67 Favored 'General case' 0 C--O 1.246 0.891 0 CA-C-N 115.852 -0.613 . . . . 0.0 111.549 -177.23 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 10.6 m -66.24 155.28 37.56 Favored 'General case' 0 N--CA 1.442 -0.862 0 CA-C-N 115.587 -0.733 . . . . 0.0 110.237 -178.589 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . 0.45 ' HD2' ' N ' ' A' ' 7' ' ' LYS . 3.5 mptp? -104.56 135.39 19.32 Favored Pre-proline 0 N--CA 1.437 -1.121 0 N-CA-C 109.183 -0.673 . . . . 0.0 109.183 179.294 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 67.2 Cg_endo -70.54 136.15 38.99 Favored 'Cis proline' 0 N--CA 1.484 0.912 0 C-N-CA 124.373 -1.094 . . . . 0.0 112.374 1.384 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 42.9 Cg_endo -71.68 107.32 2.16 Favored 'Trans proline' 0 N--CA 1.447 -1.207 0 C-N-CA 122.049 1.833 . . . . 0.0 111.52 179.63 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 10' ' ' ILE . . . . . 0.455 ' O ' ' HD1' ' A' ' 4' ' ' TYR . 50.6 mm -93.7 129.69 43.73 Favored 'Isoleucine or valine' 0 C--N 1.291 -1.952 0 N-CA-C 108.35 -0.981 . . . . 0.0 108.35 179.616 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . 0.458 ' HA ' ' O ' ' A' ' 2' ' ' ARG . . . -126.8 126.52 43.53 Favored 'General case' 0 N--CA 1.434 -1.249 0 N-CA-C 109.582 -0.525 . . . . 0.0 109.582 177.702 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 74.6 m-85 -98.66 132.19 24.42 Favored Pre-proline 0 C--N 1.291 -1.956 0 N-CA-C 107.181 -1.414 . . . . 0.0 107.181 175.809 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 26.5 Cg_endo -57.67 -8.98 4.77 Favored 'Trans proline' 0 N--CA 1.485 1.002 0 C-N-CA 124.169 3.246 . . . . 0.0 115.064 -173.035 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . 0.402 ' HB2' ' HE ' ' A' ' 2' ' ' ARG . 45.3 m-20 . . . . . 0 C--N 1.319 -0.742 0 CA-C-O 120.729 0.3 . . . . 0.0 110.308 178.131 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.434 -1.483 0 N-CA-C 112.664 -0.175 . . . . 0.0 112.664 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 73.8 mtm180 -134.97 102.78 5.34 Favored 'General case' 0 C--N 1.305 -1.363 0 N-CA-C 109.968 -0.382 . . . . 0.0 109.968 177.634 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -118.49 134.41 55.1 Favored 'General case' 0 C--N 1.287 -2.151 0 CA-C-N 115.802 -0.635 . . . . 0.0 111.44 178.764 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 92.2 m-85 -88.25 122.18 31.49 Favored 'General case' 0 N--CA 1.421 -1.881 0 N-CA-C 106.263 -1.755 . . . . 0.0 106.263 171.92 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 10.5 mtmp? -80.94 -5.63 57.71 Favored 'General case' 0 C--N 1.311 -1.098 0 CA-C-O 121.237 0.541 . . . . 0.0 111.106 -176.314 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 11.5 p -83.95 148.33 26.97 Favored 'General case' 0 N--CA 1.425 -1.717 0 CA-C-N 115.423 -0.808 . . . . 0.0 109.361 175.977 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 55.3 mtpt -97.7 141.34 22.84 Favored Pre-proline 0 C--N 1.304 -1.385 0 N-CA-C 108.071 -1.085 . . . . 0.0 108.071 177.248 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 24.7 Cg_exo -66.74 140.54 50.5 Favored 'Cis proline' 0 N--CA 1.486 1.039 0 CA-C-N 119.813 0.969 . . . . 0.0 113.435 2.11 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 57.6 Cg_endo -70.73 109.25 2.45 Favored 'Trans proline' 0 C--O 1.244 0.78 0 C-N-CA 123.251 2.634 . . . . 0.0 113.542 -177.837 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 64.1 mt -109.09 122.29 63.52 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.346 0 N-CA-C 107.659 -1.238 . . . . 0.0 107.659 175.87 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -133.52 154.04 51.15 Favored 'General case' 0 C--N 1.317 -0.819 0 CA-C-O 121.175 0.512 . . . . 0.0 110.926 -177.307 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 99.8 m-85 -121.63 131.36 24.46 Favored Pre-proline 0 C--N 1.297 -1.698 0 N-CA-C 107.052 -1.462 . . . . 0.0 107.052 173.916 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 37.5 Cg_exo -58.83 -12.66 15.53 Favored 'Trans proline' 0 N--CA 1.489 1.215 0 C-N-CA 123.965 3.11 . . . . 0.0 115.188 -174.514 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 5.8 p-10 . . . . . 0 C--N 1.318 -0.77 0 CA-C-O 120.93 0.395 . . . . 0.0 110.832 178.203 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.492 -1.403 0 N-CA-C 110.424 -1.071 . . . . 0.0 110.424 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 82.0 mtt180 -128.61 100.62 5.82 Favored 'General case' 0 C--N 1.315 -0.913 0 N-CA-C 108.379 -0.971 . . . . 0.0 108.379 -178.8 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -110.71 135.5 51.22 Favored 'General case' 0 C--N 1.29 -1.985 0 CA-C-N 116.351 -0.386 . . . . 0.0 111.12 -179.428 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 4' ' ' TYR . . . . . 0.469 ' HD1' ' O ' ' A' ' 10' ' ' ILE . 94.8 m-85 -88.91 141.16 28.73 Favored 'General case' 0 C--N 1.301 -1.533 0 CA-C-N 115.92 -0.582 . . . . 0.0 109.568 176.325 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 66.2 mttm -92.54 -42.1 9.88 Favored 'General case' 0 C--N 1.3 -1.564 0 N-CA-C 108.895 -0.78 . . . . 0.0 108.895 -179.106 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 24.9 m -65.42 127.13 30.54 Favored 'General case' 0 N--CA 1.424 -1.725 0 N-CA-C 108.668 -0.864 . . . . 0.0 108.668 176.867 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 42.7 mmtm -75.12 146.07 81.52 Favored Pre-proline 0 C--N 1.306 -1.302 0 CA-C-N 115.741 -0.663 . . . . 0.0 110.643 -173.773 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 56.7 Cg_endo -71.29 144.33 79.21 Favored 'Cis proline' 0 C--N 1.352 0.711 0 C-N-CA 123.979 -1.259 . . . . 0.0 112.729 1.63 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 55.4 Cg_endo -73.16 96.03 0.86 Allowed 'Trans proline' 0 N--CA 1.446 -1.3 0 C-N-CA 122.22 1.947 . . . . 0.0 111.574 -179.178 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 10' ' ' ILE . . . . . 0.469 ' O ' ' HD1' ' A' ' 4' ' ' TYR . 50.4 mm -92.32 134.4 30.58 Favored 'Isoleucine or valine' 0 C--N 1.294 -1.814 0 N-CA-C 106.642 -1.614 . . . . 0.0 106.642 177.64 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -130.98 144.32 51.39 Favored 'General case' 0 C--N 1.303 -1.434 0 C-N-CA 119.925 -0.71 . . . . 0.0 109.323 179.081 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 80.1 m-85 -109.46 129.54 23.79 Favored Pre-proline 0 C--N 1.288 -2.093 0 N-CA-C 107.311 -1.366 . . . . 0.0 107.311 173.264 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 3.4 Cg_exo -49.18 -17.06 1.22 Allowed 'Trans proline' 0 C--N 1.361 1.226 0 C-N-CA 124.522 3.481 . . . . 0.0 114.689 179.599 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 25.5 t70 . . . . . 0 C--N 1.318 -0.763 0 CA-C-O 121.672 0.749 . . . . 0.0 110.569 175.703 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.431 -1.658 0 N-CA-C 109.804 -1.319 . . . . 0.0 109.804 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 2' ' ' ARG . . . . . 0.462 ' HB3' ' HB2' ' A' ' 12' ' ' PHE . 9.6 ttm180 -135.76 98.28 3.87 Favored 'General case' 0 N--CA 1.431 -1.378 0 N-CA-C 109.57 -0.53 . . . . 0.0 109.57 -177.67 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -107.56 134.99 49.77 Favored 'General case' 0 C--N 1.289 -2.058 0 CA-C-O 121.639 0.733 . . . . 0.0 112.001 179.839 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 66.9 m-85 -101.18 105.49 16.63 Favored 'General case' 0 C--N 1.287 -2.121 0 N-CA-C 107.182 -1.414 . . . . 0.0 107.182 172.137 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 56.5 mtmt -86.1 -7.29 58.7 Favored 'General case' 0 C--N 1.31 -1.109 0 CA-C-N 115.36 -0.836 . . . . 0.0 109.945 -178.652 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 14.9 m -85.88 168.15 14.48 Favored 'General case' 0 N--CA 1.432 -1.364 0 N-CA-C 106.052 -1.833 . . . . 0.0 106.052 171.931 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 18.2 ptpt -95.44 146.34 31.14 Favored Pre-proline 0 C--N 1.301 -1.534 0 C-N-CA 118.998 -1.081 . . . . 0.0 111.262 -179.601 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 6.0 Cg_exo -76.58 138.88 56.87 Favored 'Cis proline' 0 C--N 1.349 0.596 0 C-N-CA 124.045 -1.231 . . . . 0.0 112.235 0.531 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 32.4 Cg_endo -65.74 114.96 3.15 Favored 'Trans proline' 0 C--O 1.239 0.546 0 C-N-CA 122.489 2.126 . . . . 0.0 111.441 -179.896 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 7.3 tp -142.29 132.58 24.08 Favored 'Isoleucine or valine' 0 C--N 1.293 -1.871 0 N-CA-C 108.529 -0.915 . . . . 0.0 108.529 179.219 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -124.23 123.2 39.73 Favored 'General case' 0 N--CA 1.434 -1.267 0 CA-C-O 121.333 0.587 . . . . 0.0 110.006 -178.858 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 12' ' ' PHE . . . . . 0.465 ' HA ' ' HD3' ' A' ' 13' ' ' PRO . 82.6 m-85 -95.69 132.3 27.65 Favored Pre-proline 0 C--N 1.282 -2.349 0 N-CA-C 108.282 -1.007 . . . . 0.0 108.282 -179.877 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 13' ' ' PRO . . . . . 0.465 ' HD3' ' HA ' ' A' ' 12' ' ' PHE . 25.6 Cg_exo -60.91 9.33 0.08 OUTLIER 'Trans proline' 0 N--CA 1.491 1.335 0 C-N-CA 124.497 3.464 . . . . 0.0 116.112 -174.047 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 6.7 p-10 . . . . . 0 C--N 1.3 -1.573 0 N-CA-C 108.82 -0.807 . . . . 0.0 108.82 176.48 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.44 -1.082 0 N-CA-C 110.856 -0.898 . . . . 0.0 110.856 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 90.7 mtt180 -110.19 97.54 7.0 Favored 'General case' 0 C--N 1.315 -0.912 0 N-CA-C 109.329 -0.619 . . . . 0.0 109.329 -177.744 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -108.59 135.28 50.11 Favored 'General case' 0 C--N 1.303 -1.437 0 CA-C-N 115.356 -0.838 . . . . 0.0 112.862 -179.437 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 55.8 m-85 -92.22 151.93 20.1 Favored 'General case' 0 C--N 1.3 -1.548 0 CA-C-N 114.684 -1.144 . . . . 0.0 109.109 173.718 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -101.95 -1.48 31.85 Favored 'General case' 0 C--N 1.308 -1.219 0 CA-C-O 121.797 0.808 . . . . 0.0 110.59 175.04 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 25.5 m -89.13 130.94 35.49 Favored 'General case' 0 N--CA 1.425 -1.712 0 CA-C-N 115.057 -0.974 . . . . 0.0 108.716 177.29 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . 0.494 ' HA ' ' C ' ' A' ' 8' ' ' PRO . 2.9 mppt? -92.63 141.16 24.22 Favored Pre-proline 0 C--N 1.315 -0.905 0 N-CA-C 109.495 -0.557 . . . . 0.0 109.495 179.486 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . 0.494 ' C ' ' HA ' ' A' ' 7' ' ' LYS . 38.4 Cg_exo -63.1 132.98 12.86 Favored 'Cis proline' 0 C--N 1.353 0.797 0 C-N-CA 124.312 -1.12 . . . . 0.0 111.066 -1.261 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 70.6 Cg_endo -76.86 119.14 5.01 Favored 'Trans proline' 0 N--CA 1.445 -1.33 0 C-N-CA 122.377 2.051 . . . . 0.0 112.718 -173.878 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 73.7 mt -98.29 121.97 49.44 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.708 0 CA-C-N 115.242 -0.89 . . . . 0.0 108.859 178.435 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -127.63 119.18 25.35 Favored 'General case' 0 N--CA 1.439 -0.986 0 CA-C-O 121.095 0.474 . . . . 0.0 109.964 178.182 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 97.3 m-85 -89.6 131.38 40.14 Favored Pre-proline 0 C--N 1.288 -2.092 0 N-CA-C 107.917 -1.142 . . . . 0.0 107.917 175.989 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 81.4 Cg_exo -52.54 -7.73 0.34 Allowed 'Trans proline' 0 N--CA 1.505 2.205 0 C-N-CA 124.932 3.754 . . . . 0.0 115.067 -178.763 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 25.8 t70 . . . . . 0 C--N 1.314 -0.955 0 CA-C-O 121.579 0.704 . . . . 0.0 109.583 174.306 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.423 -2.214 0 N-CA-C 110.677 -0.969 . . . . 0.0 110.677 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 54.5 mtt180 -134.01 105.53 6.76 Favored 'General case' 0 C--N 1.312 -1.026 0 N-CA-C 108.539 -0.911 . . . . 0.0 108.539 -178.048 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -118.98 134.59 55.1 Favored 'General case' 0 C--N 1.298 -1.667 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.631 177.635 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 80.2 m-85 -96.66 129.09 44.13 Favored 'General case' 0 C--N 1.298 -1.647 0 CA-C-N 115.305 -0.861 . . . . 0.0 110.352 177.425 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 34.5 mtmm -90.05 -16.1 30.42 Favored 'General case' 0 C--N 1.306 -1.312 0 CA-C-O 121.71 0.767 . . . . 0.0 109.643 177.674 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 23.0 m -81.12 135.65 35.82 Favored 'General case' 0 N--CA 1.419 -2.014 0 N-CA-C 108.032 -1.099 . . . . 0.0 108.032 175.534 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 2.0 mppt? -80.49 135.84 52.96 Favored Pre-proline 0 C--N 1.305 -1.335 0 N-CA-C 109.681 -0.488 . . . . 0.0 109.681 -176.72 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . 0.46 ' HA ' ' HD3' ' A' ' 9' ' ' PRO . 61.1 Cg_endo -73.43 132.19 25.83 Favored 'Cis proline' 0 CA--C 1.542 0.922 0 C-N-CA 124.131 -1.195 . . . . 0.0 112.848 1.694 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 9' ' ' PRO . . . . . 0.46 ' HD3' ' HA ' ' A' ' 8' ' ' PRO . 8.9 Cg_exo -72.08 97.11 0.81 Allowed 'Trans proline' 0 N--CA 1.455 -0.766 0 C-N-CA 122.432 2.088 . . . . 0.0 111.272 -179.351 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 61.4 mt -94.69 136.01 27.18 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.798 0 CA-C-N 115.895 -0.593 . . . . 0.0 109.678 179.336 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -124.2 151.81 43.63 Favored 'General case' 0 N--CA 1.437 -1.11 0 CA-C-O 121.407 0.623 . . . . 0.0 110.947 179.22 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 96.4 m-85 -130.09 132.92 24.4 Favored Pre-proline 0 C--N 1.297 -1.683 0 C-N-CA 124.935 1.294 . . . . 0.0 108.301 179.205 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 33.6 Cg_exo -58.84 -12.2 14.24 Favored 'Trans proline' 0 N--CA 1.497 1.733 0 C-N-CA 123.715 2.943 . . . . 0.0 113.135 -178.899 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 11.1 t70 . . . . . 0 C--O 1.241 0.61 0 C-N-CA 124.227 1.011 . . . . 0.0 109.305 175.419 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.437 -1.274 0 N-CA-C 110.811 -0.915 . . . . 0.0 110.811 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 2' ' ' ARG . . . . . 0.475 ' HE ' ' HB2' ' A' ' 14' ' ' ASP . 73.2 mtm180 -103.63 107.27 18.05 Favored 'General case' 0 C--N 1.313 -0.986 0 N-CA-C 109.899 -0.408 . . . . 0.0 109.899 -176.51 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -122.11 146.31 47.34 Favored 'General case' 0 C--N 1.3 -1.566 0 C-N-CA 123.325 0.65 . . . . 0.0 111.573 -179.538 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 97.5 m-85 -115.11 130.56 56.96 Favored 'General case' 0 C--N 1.301 -1.533 0 N-CA-C 108.674 -0.861 . . . . 0.0 108.674 174.758 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 2.6 mppt? -92.88 85.99 5.34 Favored 'General case' 0 N--CA 1.431 -1.384 0 N-CA-C 106.923 -1.51 . . . . 0.0 106.923 176.511 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 13.5 p -139.54 171.28 14.48 Favored 'General case' 0 C--N 1.285 -2.227 0 CA-C-N 114.139 -1.391 . . . . 0.0 108.572 -176.572 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . 0.408 ' HA ' ' HA ' ' A' ' 8' ' ' PRO . 4.8 mptp? -113.5 108.7 51.75 Favored Pre-proline 0 C--N 1.309 -1.167 0 N-CA-C 109.211 -0.663 . . . . 0.0 109.211 174.207 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . 0.429 ' HA ' ' HD3' ' A' ' 9' ' ' PRO . 1.3 Cg_endo -85.21 154.36 59.56 Favored 'Cis proline' 0 C--O 1.245 0.829 0 CA-C-N 119.643 0.908 . . . . 0.0 111.362 0.245 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 9' ' ' PRO . . . . . 0.429 ' HD3' ' HA ' ' A' ' 8' ' ' PRO . 3.4 Cg_exo -72.63 124.5 9.83 Favored 'Trans proline' 0 N--CA 1.457 -0.623 0 C-N-CA 122.42 2.08 . . . . 0.0 111.87 -178.11 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 48.7 mm -106.75 130.35 58.8 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.212 0 N-CA-C 108.377 -0.971 . . . . 0.0 108.377 179.64 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -134.33 153.99 51.58 Favored 'General case' 0 CA--C 1.508 -0.667 0 CA-C-O 121.251 0.548 . . . . 0.0 110.667 -178.263 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 97.6 m-85 -125.11 131.77 24.16 Favored Pre-proline 0 C--N 1.291 -1.973 0 N-CA-C 106.918 -1.512 . . . . 0.0 106.918 175.098 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 31.3 Cg_exo -59.57 4.13 0.17 Allowed 'Trans proline' 0 N--CA 1.497 1.734 0 C-N-CA 124.444 3.43 . . . . 0.0 115.262 -174.944 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . 0.475 ' HB2' ' HE ' ' A' ' 2' ' ' ARG . 8.5 m-20 . . . . . 0 C--N 1.307 -1.281 0 N-CA-C 108.854 -0.795 . . . . 0.0 108.854 174.338 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.485 -1.784 0 N-CA-C 108.767 -1.733 . . . . 0.0 108.767 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 6.9 tpp180 -130.1 103.1 6.55 Favored 'General case' 0 N--CA 1.431 -1.389 0 N-CA-C 108.535 -0.913 . . . . 0.0 108.535 -174.93 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -108.99 133.83 52.45 Favored 'General case' 0 C--N 1.296 -1.732 0 CA-C-O 120.89 0.376 . . . . 0.0 111.816 -179.561 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 96.6 m-85 -119.15 103.76 9.82 Favored 'General case' 0 C--N 1.303 -1.418 0 N-CA-C 108.475 -0.935 . . . . 0.0 108.475 176.399 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 55.7 mtpt -87.05 76.15 9.38 Favored 'General case' 0 N--CA 1.426 -1.658 0 CA-C-O 122.503 1.144 . . . . 0.0 110.827 -178.71 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 56.8 m -150.09 170.77 18.12 Favored 'General case' 0 C--N 1.279 -2.491 0 N-CA-C 104.578 -2.378 . . . . 0.0 104.578 178.25 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 12.0 mptt -91.91 130.19 39.39 Favored Pre-proline 0 C--N 1.299 -1.63 0 CA-C-N 118.789 0.722 . . . . 0.0 110.837 -177.776 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 96.7 Cg_endo -82.66 150.6 71.12 Favored 'Cis proline' 0 C--O 1.245 0.873 0 C-N-CA 123.993 -1.253 . . . . 0.0 111.083 -4.954 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 28.2 Cg_exo -62.2 109.59 0.86 Allowed 'Trans proline' 0 C--N 1.354 0.83 0 C-N-CA 122.355 2.037 . . . . 0.0 111.207 -179.069 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 8.1 tp -118.36 122.53 69.78 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.755 0 CA-C-O 121.341 0.591 . . . . 0.0 110.262 -179.384 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -126.22 126.84 44.71 Favored 'General case' 0 N--CA 1.433 -1.316 0 CA-C-N 115.601 -0.727 . . . . 0.0 109.177 178.728 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 90.7 m-85 -97.69 132.69 24.57 Favored Pre-proline 0 C--N 1.282 -2.352 0 CA-C-N 114.956 -1.02 . . . . 0.0 109.494 -178.676 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 78.4 Cg_exo -49.68 -16.28 1.37 Allowed 'Trans proline' 0 N--CA 1.502 1.982 0 C-N-CA 124.743 3.629 . . . . 0.0 115.036 179.547 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 28.2 t70 . . . . . 0 N--CA 1.479 0.98 0 CA-C-O 121.818 0.818 . . . . 0.0 109.897 175.259 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.496 -1.137 0 N-CA-C 110.161 -1.176 . . . . 0.0 110.161 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 2' ' ' ARG . . . . . 0.549 ' HB3' ' HB2' ' A' ' 12' ' ' PHE . 24.4 ttm180 -132.72 135.07 45.54 Favored 'General case' 0 C--N 1.31 -1.128 0 N-CA-C 107.532 -1.284 . . . . 0.0 107.532 -175.125 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -148.81 134.66 18.95 Favored 'General case' 0 C--N 1.304 -1.406 0 CA-C-O 121.112 0.482 . . . . 0.0 112.005 -175.898 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 80.9 m-85 -90.24 154.59 19.62 Favored 'General case' 0 C--N 1.302 -1.462 0 CA-C-N 115.569 -0.741 . . . . 0.0 109.648 175.964 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 75.2 mmtt -102.87 -0.36 31.34 Favored 'General case' 0 C--N 1.316 -0.869 0 CA-C-O 121.522 0.677 . . . . 0.0 109.739 178.743 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 34.9 m -95.86 170.1 9.54 Favored 'General case' 0 C--N 1.308 -1.212 0 CA-C-N 115.527 -0.76 . . . . 0.0 110.19 179.208 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 35.4 mmtp -98.02 137.15 20.85 Favored Pre-proline 0 C--N 1.308 -1.23 0 N-CA-C 108.538 -0.912 . . . . 0.0 108.538 177.307 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 3.0 Cg_exo -77.83 156.26 95.08 Favored 'Cis proline' 0 C--O 1.251 1.148 0 C-N-CA 124.032 -1.236 . . . . 0.0 111.58 0.164 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 15.0 Cg_exo -66.67 92.11 0.3 Allowed 'Trans proline' 0 N--CA 1.452 -0.929 0 C-N-CA 122.411 2.074 . . . . 0.0 110.596 177.267 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 71.3 mt -98.37 118.22 44.56 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.665 0 CA-C-N 115.472 -0.786 . . . . 0.0 108.96 179.902 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -127.36 150.95 49.37 Favored 'General case' 0 N--CA 1.432 -1.355 0 N-CA-C 109.735 -0.468 . . . . 0.0 109.735 -179.25 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 12' ' ' PHE . . . . . 0.549 ' HB2' ' HB3' ' A' ' 2' ' ' ARG . 43.2 m-85 -117.82 132.86 23.45 Favored Pre-proline 0 C--N 1.296 -1.754 0 C-N-CA 124.413 1.085 . . . . 0.0 108.406 -179.242 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 13' ' ' PRO . . . . . 0.402 ' HD3' ' HA ' ' A' ' 12' ' ' PHE . 37.1 Cg_exo -61.53 -2.74 2.8 Favored 'Trans proline' 0 N--CA 1.494 1.523 0 C-N-CA 123.871 3.047 . . . . 0.0 113.44 -178.527 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 33.6 t70 . . . . . 0 C--N 1.32 -0.697 0 C-N-CA 123.802 0.841 . . . . 0.0 109.035 174.0 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.432 -1.618 0 CA-C-O 119.771 -0.461 . . . . 0.0 113.43 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 2' ' ' ARG . . . . . 0.482 ' HB2' ' HB2' ' A' ' 12' ' ' PHE . 65.4 mtp180 -72.39 95.03 1.69 Allowed 'General case' 0 N--CA 1.464 0.256 0 N-CA-C 108.885 -0.783 . . . . 0.0 108.885 176.93 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -107.21 135.1 49.31 Favored 'General case' 0 C--N 1.299 -1.589 0 CA-C-O 121.132 0.492 . . . . 0.0 110.678 -178.927 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 97.2 m-85 -120.86 115.85 24.03 Favored 'General case' 0 C--N 1.293 -1.856 0 CA-C-N 115.168 -0.924 . . . . 0.0 109.552 179.023 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 98.0 mttt -83.06 83.74 7.73 Favored 'General case' 0 N--CA 1.43 -1.454 0 CA-C-O 122.325 1.06 . . . . 0.0 109.051 177.645 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 27.7 m -146.94 171.5 15.14 Favored 'General case' 0 C--N 1.282 -2.349 0 N-CA-C 105.573 -2.01 . . . . 0.0 105.573 -178.914 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . 0.414 ' HA ' ' HA ' ' A' ' 8' ' ' PRO . 63.7 mttp -108.9 119.79 47.91 Favored Pre-proline 0 C--N 1.297 -1.68 0 CA-C-N 118.413 0.551 . . . . 0.0 110.642 177.434 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . 0.414 ' HA ' ' HA ' ' A' ' 7' ' ' LYS . 88.0 Cg_endo -78.53 152.85 90.79 Favored 'Cis proline' 0 CA--C 1.545 1.069 0 C-N-CA 124.662 -0.974 . . . . 0.0 112.712 -2.084 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 37.5 Cg_endo -71.23 107.14 2.06 Favored 'Trans proline' 0 C--O 1.252 1.211 0 C-N-CA 122.504 2.136 . . . . 0.0 112.088 179.107 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 5.7 tp -100.89 128.89 52.6 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.317 0 CA-C-N 115.356 -0.838 . . . . 0.0 110.116 179.766 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . 0.424 ' HA ' ' O ' ' A' ' 2' ' ' ARG . . . -129.62 118.18 21.56 Favored 'General case' 0 N--CA 1.428 -1.565 0 N-CA-C 108.638 -0.875 . . . . 0.0 108.638 177.496 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 12' ' ' PHE . . . . . 0.482 ' HB2' ' HB2' ' A' ' 2' ' ' ARG . 91.0 m-85 -84.56 132.26 47.37 Favored Pre-proline 0 C--N 1.294 -1.835 0 N-CA-C 108.22 -1.03 . . . . 0.0 108.22 178.168 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 0.4 OUTLIER -25.24 -46.22 0.05 OUTLIER 'Trans proline' 0 C--N 1.356 0.971 1 C-N-CA 126.795 4.996 . . . . 0.0 118.343 -174.275 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . 0.47 ' OD1' ' HG3' ' A' ' 2' ' ' ARG . 5.7 p-10 . . . . . 0 N--CA 1.474 0.771 0 N-CA-C 111.693 0.257 . . . . 0.0 111.693 -176.344 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.486 -1.773 0 N-CA-C 108.995 -1.642 . . . . 0.0 108.995 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 2' ' ' ARG . . . . . 0.502 ' HB3' ' HB2' ' A' ' 12' ' ' PHE . 27.4 ttm180 -137.68 92.41 2.68 Favored 'General case' 0 N--CA 1.431 -1.399 0 N-CA-C 109.289 -0.634 . . . . 0.0 109.289 -175.168 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -109.3 134.46 51.76 Favored 'General case' 0 C--N 1.29 -2.009 0 CA-C-N 115.894 -0.594 . . . . 0.0 111.411 176.817 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 94.4 m-85 -106.61 151.29 25.24 Favored 'General case' 0 C--N 1.298 -1.637 0 CA-C-N 114.994 -1.003 . . . . 0.0 108.415 177.36 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 18.6 ptpt -93.01 -1.73 56.37 Favored 'General case' 0 C--N 1.312 -1.059 0 CA-C-O 121.696 0.76 . . . . 0.0 110.209 -179.223 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 23.5 m -81.66 167.18 19.46 Favored 'General case' 0 N--CA 1.429 -1.496 0 CA-C-N 115.051 -0.977 . . . . 0.0 110.283 179.672 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . 0.458 ' HA ' ' C ' ' A' ' 8' ' ' PRO . 20.0 ptmt -113.56 141.66 26.32 Favored Pre-proline 0 C--N 1.308 -1.222 0 CA-C-N 115.953 -0.567 . . . . 0.0 109.915 179.827 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . 0.458 ' C ' ' HA ' ' A' ' 7' ' ' LYS . 59.3 Cg_endo -68.56 165.45 72.83 Favored 'Cis proline' 0 N--CA 1.483 0.903 0 C-N-CA 124.17 -1.179 . . . . 0.0 112.007 1.394 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 16.1 Cg_exo -63.35 96.88 0.19 Allowed 'Trans proline' 0 C--N 1.354 0.823 0 C-N-CA 122.198 1.932 . . . . 0.0 112.04 179.873 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 10' ' ' ILE . . . . . 0.434 HG13 ' O ' ' A' ' 8' ' ' PRO . 72.8 mt -93.97 107.2 18.98 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.326 0 CA-C-N 115.33 -0.85 . . . . 0.0 109.093 179.281 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -132.41 132.44 42.8 Favored 'General case' 0 N--CA 1.441 -0.884 0 CA-C-O 121.343 0.592 . . . . 0.0 110.355 178.327 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 12' ' ' PHE . . . . . 0.502 ' HB2' ' HB3' ' A' ' 2' ' ' ARG . 87.8 m-85 -108.96 131.9 21.51 Favored Pre-proline 0 C--N 1.277 -2.556 0 N-CA-C 108.312 -0.995 . . . . 0.0 108.312 176.403 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 11.8 Cg_endo -58.36 -7.99 4.65 Favored 'Trans proline' 0 C--N 1.359 1.124 0 C-N-CA 123.529 2.819 . . . . 0.0 112.956 177.543 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 10.2 t70 . . . . . 0 C--N 1.322 -0.593 0 C-N-CA 123.589 0.756 . . . . 0.0 109.315 171.904 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.445 -0.701 0 N-CA-C 114.489 0.555 . . . . 0.0 114.489 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 2' ' ' ARG . . . . . 0.482 ' O ' ' HA ' ' A' ' 11' ' ' ALA . 26.9 mmm180 -125.09 98.81 5.83 Favored 'General case' 0 C--N 1.31 -1.115 0 CA-C-N 117.51 0.655 . . . . 0.0 110.667 178.592 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -108.08 134.73 50.54 Favored 'General case' 0 C--N 1.306 -1.314 0 N-CA-C 109.719 -0.474 . . . . 0.0 109.719 174.775 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 95.7 m-85 -114.08 125.78 54.35 Favored 'General case' 0 C--N 1.288 -2.098 0 N-CA-C 109.467 -0.568 . . . . 0.0 109.467 178.46 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . 0.493 ' H ' ' HD3' ' A' ' 5' ' ' LYS . 0.0 OUTLIER -72.44 -20.72 61.36 Favored 'General case' 0 C--N 1.316 -0.87 0 O-C-N 123.878 0.736 . . . . 0.0 111.276 -179.694 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 60.6 m -73.86 135.59 43.4 Favored 'General case' 0 N--CA 1.433 -1.292 0 CA-C-O 120.757 0.313 . . . . 0.0 110.24 178.854 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 8.4 mtmp? -82.32 141.3 45.84 Favored Pre-proline 0 C--N 1.313 -1.021 0 CA-C-N 115.756 -0.656 . . . . 0.0 110.926 -175.686 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . 0.465 ' HA ' ' HD3' ' A' ' 9' ' ' PRO . 14.2 Cg_exo -72.46 132.09 24.61 Favored 'Cis proline' 0 C--O 1.242 0.688 0 C-N-CA 123.776 -1.343 . . . . 0.0 110.902 -1.692 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 9' ' ' PRO . . . . . 0.465 ' HD3' ' HA ' ' A' ' 8' ' ' PRO . 22.5 Cg_exo -65.68 110.45 1.66 Allowed 'Trans proline' 0 N--CA 1.456 -0.694 0 C-N-CA 122.239 1.959 . . . . 0.0 111.296 -178.761 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 6.6 tp -104.68 127.34 59.19 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.736 0 N-CA-C 108.788 -0.819 . . . . 0.0 108.788 178.856 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . 0.482 ' HA ' ' O ' ' A' ' 2' ' ' ARG . . . -122.58 121.41 36.41 Favored 'General case' 0 N--CA 1.429 -1.489 0 CA-C-N 115.981 -0.554 . . . . 0.0 109.854 -179.731 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 12' ' ' PHE . . . . . 0.42 ' HA ' ' HD3' ' A' ' 13' ' ' PRO . 86.6 m-85 -94.19 131.65 31.0 Favored Pre-proline 0 C--N 1.282 -2.339 0 CA-C-N 114.996 -1.002 . . . . 0.0 108.451 178.605 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 13' ' ' PRO . . . . . 0.42 ' HD3' ' HA ' ' A' ' 12' ' ' PHE . 63.5 Cg_exo -54.97 -13.3 6.15 Favored 'Trans proline' 0 N--CA 1.494 1.522 0 C-N-CA 124.344 3.362 . . . . 0.0 114.673 -177.852 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 5.2 p-10 . . . . . 0 C--N 1.315 -0.899 0 O-C-N 122.098 -0.376 . . . . 0.0 111.779 178.05 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.433 -1.557 0 N-CA-C 110.776 -0.93 . . . . 0.0 110.776 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 2' ' ' ARG . . . . . 0.495 ' O ' ' HA ' ' A' ' 11' ' ' ALA . 20.3 mmm180 -123.64 97.19 5.27 Favored 'General case' 0 C--N 1.311 -1.081 0 N-CA-C 110.171 -0.307 . . . . 0.0 110.171 -177.646 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -107.2 134.64 49.99 Favored 'General case' 0 C--N 1.293 -1.857 0 CA-C-O 121.116 0.484 . . . . 0.0 110.048 177.507 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 88.9 m-85 -118.93 126.75 52.49 Favored 'General case' 0 C--N 1.302 -1.459 0 CA-C-N 115.444 -0.798 . . . . 0.0 109.303 -179.492 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 54.1 mtmt -88.91 82.91 6.64 Favored 'General case' 0 C--N 1.3 -1.555 0 CA-C-O 121.966 0.889 . . . . 0.0 112.157 -175.163 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 49.8 m -150.49 170.32 19.38 Favored 'General case' 0 C--N 1.292 -1.923 0 N-CA-C 105.938 -1.875 . . . . 0.0 105.938 175.93 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 28.7 mtpp -113.27 125.48 29.62 Favored Pre-proline 0 C--N 1.303 -1.42 0 N-CA-C 108.891 -0.781 . . . . 0.0 108.891 176.951 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 5.6 Cg_exo -75.11 147.08 88.24 Favored 'Cis proline' 0 C--O 1.246 0.922 0 C-N-CA 124.304 -1.123 . . . . 0.0 111.898 0.406 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 36.1 Cg_endo -67.41 114.45 3.27 Favored 'Trans proline' 0 N--CA 1.455 -0.773 0 C-N-CA 122.556 2.17 . . . . 0.0 111.702 179.095 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 51.0 mm -99.5 117.61 44.9 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.512 0 N-CA-C 108.683 -0.858 . . . . 0.0 108.683 -179.956 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . 0.495 ' HA ' ' O ' ' A' ' 2' ' ' ARG . . . -128.2 128.42 44.72 Favored 'General case' 0 N--CA 1.441 -0.888 0 N-CA-C 109.496 -0.557 . . . . 0.0 109.496 178.787 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 12' ' ' PHE . . . . . 0.433 ' HB2' ' HB2' ' A' ' 2' ' ' ARG . 98.1 m-85 -99.35 131.67 24.66 Favored Pre-proline 0 C--N 1.289 -2.058 0 N-CA-C 108.75 -0.833 . . . . 0.0 108.75 177.072 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 82.5 Cg_exo -50.31 -15.91 1.69 Allowed 'Trans proline' 0 N--CA 1.497 1.716 0 C-N-CA 124.949 3.766 . . . . 0.0 116.113 -176.68 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 24.5 t70 . . . . . 0 N--CA 1.474 0.749 0 CA-C-O 121.351 0.595 . . . . 0.0 110.212 175.483 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.435 -1.389 0 N-CA-C 109.575 -1.41 . . . . 0.0 109.575 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 38.7 ttm180 -150.98 120.08 6.73 Favored 'General case' 0 C--N 1.303 -1.439 0 N-CA-C 108.744 -0.836 . . . . 0.0 108.744 -175.969 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -129.76 135.49 48.51 Favored 'General case' 0 C--N 1.305 -1.365 0 CA-C-O 121.066 0.46 . . . . 0.0 110.885 -178.734 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 56.7 m-85 -89.18 115.97 27.09 Favored 'General case' 0 C--N 1.297 -1.715 0 CA-C-N 115.321 -0.854 . . . . 0.0 108.793 176.243 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 95.2 mttt -82.04 72.06 9.09 Favored 'General case' 0 C--N 1.317 -0.806 0 CA-C-O 121.76 0.79 . . . . 0.0 110.034 -179.171 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 26.9 m -146.56 166.66 25.82 Favored 'General case' 0 C--N 1.29 -2.011 0 N-CA-C 106.627 -1.62 . . . . 0.0 106.627 179.858 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 28.1 mtpp -114.11 116.36 44.72 Favored Pre-proline 0 C--N 1.291 -1.944 0 N-CA-C 108.949 -0.76 . . . . 0.0 108.949 175.849 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 3.2 Cg_exo -81.87 147.48 68.31 Favored 'Cis proline' 0 CA--C 1.541 0.861 0 C-N-CA 124.813 -0.911 . . . . 0.0 112.987 2.755 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 74.1 Cg_endo -82.47 126.94 4.91 Favored 'Trans proline' 0 N--CA 1.447 -1.211 0 C-N-CA 122.467 2.111 . . . . 0.0 112.887 -179.214 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 68.4 mt -102.92 130.46 52.98 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.796 0 N-CA-C 107.289 -1.375 . . . . 0.0 107.289 175.898 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -127.22 153.94 45.47 Favored 'General case' 0 C--N 1.311 -1.087 0 N-CA-C 109.555 -0.535 . . . . 0.0 109.555 179.46 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 89.9 m-85 -124.47 131.73 24.21 Favored Pre-proline 0 C--N 1.295 -1.762 0 CA-C-N 115.627 -0.715 . . . . 0.0 109.324 178.496 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 77.9 Cg_exo -46.5 -19.49 0.7 Allowed 'Trans proline' 0 N--CA 1.501 1.915 1 C-N-CA 125.372 4.048 . . . . 0.0 115.858 -177.565 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 32.1 t70 . . . . . 0 C--N 1.319 -0.753 0 CA-C-O 121.162 0.506 . . . . 0.0 110.765 177.335 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.435 -1.379 0 N-CA-C 112.094 -0.402 . . . . 0.0 112.094 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 33.4 ttm180 -143.9 128.09 17.68 Favored 'General case' 0 C--N 1.312 -1.051 0 N-CA-C 109.101 -0.703 . . . . 0.0 109.101 179.146 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -120.91 135.52 55.17 Favored 'General case' 0 C--N 1.293 -1.857 0 CA-C-O 120.487 0.184 . . . . 0.0 111.297 178.78 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 96.8 m-85 -101.52 118.78 37.65 Favored 'General case' 0 C--N 1.306 -1.303 0 N-CA-C 108.838 -0.801 . . . . 0.0 108.838 175.716 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 30.2 mmmt -88.18 72.1 9.14 Favored 'General case' 0 N--CA 1.427 -1.595 0 CA-C-O 122.589 1.185 . . . . 0.0 110.913 179.188 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 35.0 m -151.07 170.87 18.34 Favored 'General case' 0 C--N 1.293 -1.852 0 CA-C-N 113.308 -1.769 . . . . 0.0 106.324 178.795 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 19.7 ptpt -98.51 135.65 21.07 Favored Pre-proline 0 C--N 1.295 -1.798 0 N-CA-C 107.406 -1.331 . . . . 0.0 107.406 170.949 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 74.3 Cg_endo -81.25 160.56 82.0 Favored 'Cis proline' 0 CA--C 1.54 0.8 0 C-N-CA 123.533 -1.444 . . . . 0.0 111.277 0.473 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 33.6 Cg_endo -66.41 95.43 0.32 Allowed 'Trans proline' 0 N--CA 1.452 -0.917 0 C-N-CA 121.909 1.739 . . . . 0.0 111.202 177.927 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 49.7 mm -106.72 115.21 47.76 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.46 0 N-CA-C 108.487 -0.931 . . . . 0.0 108.487 179.633 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -125.89 138.97 53.83 Favored 'General case' 0 C--N 1.295 -1.792 0 N-CA-C 107.447 -1.316 . . . . 0.0 107.447 178.196 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 22.2 m-30 -96.11 131.97 27.78 Favored Pre-proline 0 C--N 1.288 -2.077 0 N-CA-C 108.758 -0.83 . . . . 0.0 108.758 179.841 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 13.7 Cg_endo -57.92 -10.77 8.29 Favored 'Trans proline' 0 C--N 1.356 0.925 0 C-N-CA 123.84 3.026 . . . . 0.0 113.704 -179.032 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 24.4 t70 . . . . . 0 C--N 1.317 -0.812 0 CA-C-O 121.446 0.641 . . . . 0.0 110.123 174.754 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.44 -1.074 0 N-CA-C 111.986 -0.446 . . . . 0.0 111.986 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 21.4 ttm180 -115.94 114.03 24.1 Favored 'General case' 0 C--N 1.316 -0.862 0 C-N-CA 120.713 -0.395 . . . . 0.0 110.053 -178.869 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -108.25 135.51 49.45 Favored 'General case' 0 C--N 1.304 -1.379 0 C-N-CA 123.169 0.587 . . . . 0.0 111.694 -178.542 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 4' ' ' TYR . . . . . 0.45 ' HB2' ' H ' ' A' ' 10' ' ' ILE . 12.1 m-85 -89.81 122.14 32.61 Favored 'General case' 0 C--N 1.301 -1.523 0 N-CA-C 108.641 -0.874 . . . . 0.0 108.641 173.43 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . 0.489 ' HD2' ' N ' ' A' ' 5' ' ' LYS . 0.1 OUTLIER -84.0 -22.61 31.31 Favored 'General case' 0 C--N 1.303 -1.425 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.058 -177.218 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 41.4 m -84.5 141.73 30.54 Favored 'General case' 0 N--CA 1.43 -1.464 0 N-CA-C 109.081 -0.711 . . . . 0.0 109.081 176.245 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 38.1 ttpt -67.82 138.98 93.21 Favored Pre-proline 0 C--N 1.308 -1.214 0 C-N-CA 123.504 0.722 . . . . 0.0 109.407 178.581 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . 0.445 ' HA ' ' HD3' ' A' ' 9' ' ' PRO . 74.3 Cg_endo -77.15 134.22 34.36 Favored 'Cis proline' 0 C--N 1.351 0.671 0 C-N-CA 123.882 -1.299 . . . . 0.0 111.566 -0.965 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 9' ' ' PRO . . . . . 0.445 ' HD3' ' HA ' ' A' ' 8' ' ' PRO . 21.9 Cg_exo -65.58 105.1 0.72 Allowed 'Trans proline' 0 N--CA 1.457 -0.655 0 C-N-CA 122.017 1.811 . . . . 0.0 111.081 179.916 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 10' ' ' ILE . . . . . 0.45 ' H ' ' HB2' ' A' ' 4' ' ' TYR . 67.8 mt -108.58 128.26 64.38 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.554 0 N-CA-C 107.725 -1.213 . . . . 0.0 107.725 178.207 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -123.09 112.51 17.83 Favored 'General case' 0 N--CA 1.433 -1.278 0 CA-C-O 121.249 0.547 . . . . 0.0 109.764 -179.808 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 92.6 m-85 -79.5 132.1 63.03 Favored Pre-proline 0 C--N 1.289 -2.025 0 CA-C-N 115.039 -0.982 . . . . 0.0 109.487 -179.962 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 84.5 Cg_exo -48.8 -21.32 3.54 Favored 'Trans proline' 0 N--CA 1.495 1.575 0 C-N-CA 124.696 3.597 . . . . 0.0 114.65 -177.2 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 19.2 t70 . . . . . 0 N--CA 1.469 0.486 0 C-N-CA 123.14 0.576 . . . . 0.0 110.376 177.345 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.436 -1.366 0 N-CA-C 111.542 -0.623 . . . . 0.0 111.542 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 2' ' ' ARG . . . . . 0.47 ' O ' ' HA ' ' A' ' 11' ' ' ALA . 78.5 mtp180 -117.83 102.35 9.03 Favored 'General case' 0 C--N 1.313 -0.995 0 O-C-N 122.568 -0.372 . . . . 0.0 110.521 -179.019 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -107.9 134.56 50.65 Favored 'General case' 0 C--N 1.3 -1.55 0 CA-C-N 115.634 -0.712 . . . . 0.0 109.195 179.002 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 62.9 m-85 -103.75 154.55 19.44 Favored 'General case' 0 C--N 1.295 -1.79 0 CA-C-N 115.726 -0.67 . . . . 0.0 110.936 179.749 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -88.19 -27.66 21.68 Favored 'General case' 0 C--N 1.313 -0.991 0 N-CA-C 108.615 -0.883 . . . . 0.0 108.615 -178.467 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 11.8 p -62.79 135.53 57.39 Favored 'General case' 0 N--CA 1.433 -1.283 0 CA-C-N 115.093 -0.958 . . . . 0.0 111.021 -179.572 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 96.6 mttt -90.97 139.67 25.94 Favored Pre-proline 0 C--N 1.309 -1.164 0 N-CA-C 110.164 -0.31 . . . . 0.0 110.164 -178.66 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . 0.492 ' HA ' ' HD3' ' A' ' 9' ' ' PRO . 57.1 Cg_endo -73.16 133.11 29.04 Favored 'Cis proline' 0 C--O 1.245 0.855 0 C-N-CA 123.73 -1.363 . . . . 0.0 110.948 -3.005 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 9' ' ' PRO . . . . . 0.492 ' HD3' ' HA ' ' A' ' 8' ' ' PRO . 22.1 Cg_exo -65.65 115.21 3.26 Favored 'Trans proline' 0 N--CA 1.453 -0.861 0 C-N-CA 122.053 1.835 . . . . 0.0 111.636 -178.231 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 7.9 tp -97.9 136.3 29.27 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.741 0 N-CA-C 107.815 -1.18 . . . . 0.0 107.815 177.212 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . 0.47 ' HA ' ' O ' ' A' ' 2' ' ' ARG . . . -123.74 112.37 17.26 Favored 'General case' 0 N--CA 1.436 -1.163 0 N-CA-C 109.333 -0.617 . . . . 0.0 109.333 177.527 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 93.9 m-85 -79.48 132.57 61.7 Favored Pre-proline 0 C--N 1.294 -1.816 0 N-CA-C 108.341 -0.985 . . . . 0.0 108.341 178.55 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 8.5 Cg_endo -48.3 -21.17 2.85 Favored 'Trans proline' 0 N--CA 1.496 1.649 0 C-N-CA 124.975 3.784 . . . . 0.0 115.561 -175.558 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 34.0 t70 . . . . . 0 N--CA 1.473 0.715 0 CA-C-O 121.668 0.747 . . . . 0.0 110.375 177.908 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.436 -1.305 0 CA-C-O 120.242 -0.199 . . . . 0.0 112.695 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 71.6 ttt180 -152.64 129.88 11.24 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 116.79 0.295 . . . . 0.0 110.252 177.843 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -130.56 134.71 47.24 Favored 'General case' 0 C--N 1.305 -1.345 0 C-N-CA 123.078 0.551 . . . . 0.0 111.298 178.711 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 58.7 m-85 -92.77 137.85 32.0 Favored 'General case' 0 C--N 1.31 -1.144 0 CA-C-N 115.908 -0.587 . . . . 0.0 110.151 177.047 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 75.7 mmtt -88.53 -43.94 11.04 Favored 'General case' 0 C--N 1.303 -1.445 0 N-CA-C 109.094 -0.706 . . . . 0.0 109.094 179.322 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 37.5 m -79.9 155.78 27.6 Favored 'General case' 0 N--CA 1.437 -1.084 0 CA-C-N 115.42 -0.809 . . . . 0.0 110.502 179.74 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 53.0 mtmt -79.74 136.88 54.74 Favored Pre-proline 0 C--N 1.313 -1.019 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.144 -178.238 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . 0.449 ' HA ' ' HD3' ' A' ' 9' ' ' PRO . 78.1 Cg_endo -75.28 127.81 15.24 Favored 'Cis proline' 0 CA--C 1.54 0.822 0 C-N-CA 123.988 -1.255 . . . . 0.0 112.84 2.774 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 9' ' ' PRO . . . . . 0.449 ' HD3' ' HA ' ' A' ' 8' ' ' PRO . 3.4 Cg_exo -79.44 87.69 1.52 Allowed 'Trans proline' 0 N--CA 1.436 -1.896 0 C-N-CA 121.748 1.632 . . . . 0.0 109.79 178.574 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 13.3 tt -105.61 140.15 24.57 Favored 'Isoleucine or valine' 0 C--N 1.291 -1.964 0 N-CA-C 108.57 -0.9 . . . . 0.0 108.57 179.029 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -118.15 145.49 44.88 Favored 'General case' 0 N--CA 1.422 -1.861 0 N-CA-C 108.41 -0.959 . . . . 0.0 108.41 178.955 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 48.0 m-85 -110.12 131.7 21.85 Favored Pre-proline 0 C--N 1.276 -2.588 0 N-CA-C 108.038 -1.097 . . . . 0.0 108.038 178.487 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 37.2 Cg_endo -65.87 3.17 1.31 Allowed 'Trans proline' 0 N--CA 1.486 1.033 0 C-N-CA 123.592 2.861 . . . . 0.0 112.716 -179.969 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 51.3 m-20 . . . . . 0 C--N 1.321 -0.667 0 N-CA-C 108.993 -0.743 . . . . 0.0 108.993 176.827 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.433 -1.524 0 N-CA-C 111.212 -0.755 . . . . 0.0 111.212 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 4.4 tpp180 -143.34 105.24 4.36 Favored 'General case' 0 C--N 1.31 -1.119 0 N-CA-C 109.781 -0.451 . . . . 0.0 109.781 179.236 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -108.14 135.26 49.78 Favored 'General case' 0 C--N 1.294 -1.823 0 CA-C-N 115.868 -0.606 . . . . 0.0 110.286 179.003 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 47.0 m-85 -98.16 139.68 33.6 Favored 'General case' 0 C--N 1.298 -1.654 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.66 178.561 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 18.8 ptmt -94.44 12.4 27.32 Favored 'General case' 0 C--N 1.309 -1.188 0 CA-C-O 122.006 0.908 . . . . 0.0 109.702 -179.955 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 41.5 m -75.75 171.02 15.08 Favored 'General case' 0 C--N 1.308 -1.219 0 CA-C-N 114.185 -1.371 . . . . 0.0 109.734 176.097 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . 0.428 ' HA ' ' HA ' ' A' ' 8' ' ' PRO . 24.1 ttmm -108.15 118.24 53.0 Favored Pre-proline 0 C--N 1.304 -1.373 0 N-CA-C 109.673 -0.492 . . . . 0.0 109.673 177.581 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . 0.428 ' HA ' ' HA ' ' A' ' 7' ' ' LYS . 93.7 Cg_endo -83.49 159.54 73.03 Favored 'Cis proline' 0 C--O 1.243 0.771 0 C-N-CA 124.327 -1.114 . . . . 0.0 111.218 -2.469 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 28.8 Cg_endo -67.41 104.43 0.91 Allowed 'Trans proline' 0 N--CA 1.451 -1.012 0 C-N-CA 121.818 1.679 . . . . 0.0 111.56 178.905 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 7.6 tp -100.72 138.61 24.41 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.284 0 N-CA-C 108.185 -1.042 . . . . 0.0 108.185 176.891 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -128.65 150.39 50.25 Favored 'General case' 0 N--CA 1.43 -1.433 0 N-CA-C 109.311 -0.626 . . . . 0.0 109.311 -177.797 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 90.3 m-85 -107.94 132.05 21.31 Favored Pre-proline 0 C--N 1.288 -2.075 0 N-CA-C 107.414 -1.328 . . . . 0.0 107.414 174.548 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 21.1 Cg_endo -61.34 -5.68 5.66 Favored 'Trans proline' 0 N--CA 1.485 0.988 0 C-N-CA 123.73 2.953 . . . . 0.0 114.501 -175.758 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 8.7 m-20 . . . . . 0 C--N 1.309 -1.169 0 CA-C-N 116.109 -0.496 . . . . 0.0 109.749 175.087 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.438 -1.199 0 N-CA-C 111.698 -0.561 . . . . 0.0 111.698 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 2' ' ' ARG . . . . . 0.451 ' HB2' ' HB2' ' A' ' 12' ' ' PHE . 95.7 mtt180 -132.53 93.58 3.26 Favored 'General case' 0 C--N 1.317 -0.837 0 CA-C-O 120.92 0.39 . . . . 0.0 110.828 -179.109 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -107.89 137.2 46.3 Favored 'General case' 0 C--N 1.294 -1.834 0 CA-C-N 115.417 -0.811 . . . . 0.0 110.412 177.056 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 53.6 m-85 -115.47 126.2 54.02 Favored 'General case' 0 C--N 1.295 -1.778 0 N-CA-C 107.65 -1.241 . . . . 0.0 107.65 178.944 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -83.66 70.4 10.31 Favored 'General case' 0 C--N 1.309 -1.191 0 CA-C-O 122.751 1.263 . . . . 0.0 111.221 -177.362 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 53.7 m -148.33 158.08 43.88 Favored 'General case' 0 C--N 1.301 -1.505 0 CA-C-N 114.634 -1.166 . . . . 0.0 108.295 179.422 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . 0.425 ' HA ' ' C ' ' A' ' 8' ' ' PRO . 7.8 ptpp? -112.95 133.62 21.95 Favored Pre-proline 0 C--N 1.31 -1.123 0 N-CA-C 110.05 -0.352 . . . . 0.0 110.05 179.474 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . 0.425 ' C ' ' HA ' ' A' ' 7' ' ' LYS . 12.8 Cg_exo -69.05 138.11 45.56 Favored 'Cis proline' 0 C--N 1.356 0.969 0 C-N-CA 124.334 -1.111 . . . . 0.0 111.814 1.42 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 35.3 Cg_endo -66.01 121.47 8.8 Favored 'Trans proline' 0 C--O 1.24 0.613 0 C-N-CA 122.655 2.236 . . . . 0.0 112.537 -177.163 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 48.6 mm -110.24 121.74 63.59 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.618 0 N-CA-C 107.808 -1.182 . . . . 0.0 107.808 178.564 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -134.29 120.54 20.07 Favored 'General case' 0 CA--C 1.491 -1.327 0 N-CA-C 109.609 -0.515 . . . . 0.0 109.609 179.765 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 12' ' ' PHE . . . . . 0.451 ' HB2' ' HB2' ' A' ' 2' ' ' ARG . 99.9 m-85 -90.47 128.25 49.65 Favored Pre-proline 0 C--N 1.288 -2.07 0 N-CA-C 107.411 -1.329 . . . . 0.0 107.411 175.082 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 12.5 Cg_endo -53.8 -20.43 17.37 Favored 'Trans proline' 0 N--CA 1.484 0.927 0 C-N-CA 124.307 3.338 . . . . 0.0 114.593 -172.627 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 17.5 m-20 . . . . . 0 C--N 1.316 -0.866 0 C-N-CA 123.303 0.641 . . . . 0.0 111.73 -179.091 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.436 -1.36 0 N-CA-C 110.682 -0.967 . . . . 0.0 110.682 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . 0.458 ' O ' ' HA ' ' A' ' 11' ' ' ALA . 26.7 mtt180 -124.26 93.65 3.98 Favored 'General case' 0 C--N 1.315 -0.917 0 N-CA-C 108.268 -1.012 . . . . 0.0 108.268 -178.958 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -108.1 134.76 50.52 Favored 'General case' 0 C--N 1.293 -1.872 0 CA-C-O 120.999 0.428 . . . . 0.0 110.959 178.091 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' TYR . . . . . 0.455 ' HD1' ' O ' ' A' ' 10' ' ' ILE . 96.3 m-85 -104.05 142.42 34.48 Favored 'General case' 0 C--N 1.302 -1.463 0 CA-C-N 115.536 -0.757 . . . . 0.0 110.218 -179.698 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 12.8 mptt -82.63 -30.08 29.67 Favored 'General case' 0 C--O 1.246 0.891 0 CA-C-N 115.852 -0.613 . . . . 0.0 111.549 -177.23 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 10.6 m -66.24 155.28 37.56 Favored 'General case' 0 N--CA 1.442 -0.862 0 CA-C-N 115.587 -0.733 . . . . 0.0 110.237 -178.589 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . 0.45 ' HD2' ' N ' ' A' ' 7' ' ' LYS . 3.5 mptp? -104.56 135.39 19.32 Favored Pre-proline 0 N--CA 1.437 -1.121 0 N-CA-C 109.183 -0.673 . . . . 0.0 109.183 179.294 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 67.2 Cg_endo -70.54 136.15 38.99 Favored 'Cis proline' 0 N--CA 1.484 0.912 0 C-N-CA 124.373 -1.094 . . . . 0.0 112.374 1.384 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 42.9 Cg_endo -71.68 107.32 2.16 Favored 'Trans proline' 0 N--CA 1.447 -1.207 0 C-N-CA 122.049 1.833 . . . . 0.0 111.52 179.63 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' ILE . . . . . 0.455 ' O ' ' HD1' ' A' ' 4' ' ' TYR . 50.6 mm -93.7 129.69 43.73 Favored 'Isoleucine or valine' 0 C--N 1.291 -1.952 0 N-CA-C 108.35 -0.981 . . . . 0.0 108.35 179.616 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . 0.458 ' HA ' ' O ' ' A' ' 2' ' ' ARG . . . -126.8 126.52 43.53 Favored 'General case' 0 N--CA 1.434 -1.249 0 N-CA-C 109.582 -0.525 . . . . 0.0 109.582 177.702 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 74.6 m-85 -98.66 132.19 24.42 Favored Pre-proline 0 C--N 1.291 -1.956 0 N-CA-C 107.181 -1.414 . . . . 0.0 107.181 175.809 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 26.5 Cg_endo -57.67 -8.98 4.77 Favored 'Trans proline' 0 N--CA 1.485 1.002 0 C-N-CA 124.169 3.246 . . . . 0.0 115.064 -173.035 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . 0.402 ' HB2' ' HE ' ' A' ' 2' ' ' ARG . 45.3 m-20 . . . . . 0 C--N 1.319 -0.742 0 CA-C-O 120.729 0.3 . . . . 0.0 110.308 178.131 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 101' ' ' WMH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.434 -1.483 0 N-CA-C 112.664 -0.175 . . . . 0.0 112.664 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 73.8 mtm180 -134.97 102.78 5.34 Favored 'General case' 0 C--N 1.305 -1.363 0 N-CA-C 109.968 -0.382 . . . . 0.0 109.968 177.634 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -118.49 134.41 55.1 Favored 'General case' 0 C--N 1.287 -2.151 0 CA-C-N 115.802 -0.635 . . . . 0.0 111.44 178.764 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 92.2 m-85 -88.25 122.18 31.49 Favored 'General case' 0 N--CA 1.421 -1.881 0 N-CA-C 106.263 -1.755 . . . . 0.0 106.263 171.92 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 10.5 mtmp? -80.94 -5.63 57.71 Favored 'General case' 0 C--N 1.311 -1.098 0 CA-C-O 121.237 0.541 . . . . 0.0 111.106 -176.314 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 11.5 p -83.95 148.33 26.97 Favored 'General case' 0 N--CA 1.425 -1.717 0 CA-C-N 115.423 -0.808 . . . . 0.0 109.361 175.977 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 55.3 mtpt -97.7 141.34 22.84 Favored Pre-proline 0 C--N 1.304 -1.385 0 N-CA-C 108.071 -1.085 . . . . 0.0 108.071 177.248 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 24.7 Cg_exo -66.74 140.54 50.5 Favored 'Cis proline' 0 N--CA 1.486 1.039 0 CA-C-N 119.813 0.969 . . . . 0.0 113.435 2.11 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 57.6 Cg_endo -70.73 109.25 2.45 Favored 'Trans proline' 0 C--O 1.244 0.78 0 C-N-CA 123.251 2.634 . . . . 0.0 113.542 -177.837 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 64.1 mt -109.09 122.29 63.52 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.346 0 N-CA-C 107.659 -1.238 . . . . 0.0 107.659 175.87 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -133.52 154.04 51.15 Favored 'General case' 0 C--N 1.317 -0.819 0 CA-C-O 121.175 0.512 . . . . 0.0 110.926 -177.307 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 99.8 m-85 -121.63 131.36 24.46 Favored Pre-proline 0 C--N 1.297 -1.698 0 N-CA-C 107.052 -1.462 . . . . 0.0 107.052 173.916 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 37.5 Cg_exo -58.83 -12.66 15.53 Favored 'Trans proline' 0 N--CA 1.489 1.215 0 C-N-CA 123.965 3.11 . . . . 0.0 115.188 -174.514 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 5.8 p-10 . . . . . 0 C--N 1.318 -0.77 0 CA-C-O 120.93 0.395 . . . . 0.0 110.832 178.203 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 101' ' ' WMH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.492 -1.403 0 N-CA-C 110.424 -1.071 . . . . 0.0 110.424 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 82.0 mtt180 -128.61 100.62 5.82 Favored 'General case' 0 C--N 1.315 -0.913 0 N-CA-C 108.379 -0.971 . . . . 0.0 108.379 -178.8 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -110.71 135.5 51.22 Favored 'General case' 0 C--N 1.29 -1.985 0 CA-C-N 116.351 -0.386 . . . . 0.0 111.12 -179.428 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' TYR . . . . . 0.469 ' HD1' ' O ' ' A' ' 10' ' ' ILE . 94.8 m-85 -88.91 141.16 28.73 Favored 'General case' 0 C--N 1.301 -1.533 0 CA-C-N 115.92 -0.582 . . . . 0.0 109.568 176.325 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 66.2 mttm -92.54 -42.1 9.88 Favored 'General case' 0 C--N 1.3 -1.564 0 N-CA-C 108.895 -0.78 . . . . 0.0 108.895 -179.106 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 24.9 m -65.42 127.13 30.54 Favored 'General case' 0 N--CA 1.424 -1.725 0 N-CA-C 108.668 -0.864 . . . . 0.0 108.668 176.867 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 42.7 mmtm -75.12 146.07 81.52 Favored Pre-proline 0 C--N 1.306 -1.302 0 CA-C-N 115.741 -0.663 . . . . 0.0 110.643 -173.773 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 56.7 Cg_endo -71.29 144.33 79.21 Favored 'Cis proline' 0 C--N 1.352 0.711 0 C-N-CA 123.979 -1.259 . . . . 0.0 112.729 1.63 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 55.4 Cg_endo -73.16 96.03 0.86 Allowed 'Trans proline' 0 N--CA 1.446 -1.3 0 C-N-CA 122.22 1.947 . . . . 0.0 111.574 -179.178 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' ILE . . . . . 0.469 ' O ' ' HD1' ' A' ' 4' ' ' TYR . 50.4 mm -92.32 134.4 30.58 Favored 'Isoleucine or valine' 0 C--N 1.294 -1.814 0 N-CA-C 106.642 -1.614 . . . . 0.0 106.642 177.64 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -130.98 144.32 51.39 Favored 'General case' 0 C--N 1.303 -1.434 0 C-N-CA 119.925 -0.71 . . . . 0.0 109.323 179.081 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 80.1 m-85 -109.46 129.54 23.79 Favored Pre-proline 0 C--N 1.288 -2.093 0 N-CA-C 107.311 -1.366 . . . . 0.0 107.311 173.264 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 3.4 Cg_exo -49.18 -17.06 1.22 Allowed 'Trans proline' 0 C--N 1.361 1.226 0 C-N-CA 124.522 3.481 . . . . 0.0 114.689 179.599 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 25.5 t70 . . . . . 0 C--N 1.318 -0.763 0 CA-C-O 121.672 0.749 . . . . 0.0 110.569 175.703 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 101' ' ' WMH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.431 -1.658 0 N-CA-C 109.804 -1.319 . . . . 0.0 109.804 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . 0.462 ' HB3' ' HB2' ' A' ' 12' ' ' PHE . 9.6 ttm180 -135.76 98.28 3.87 Favored 'General case' 0 N--CA 1.431 -1.378 0 N-CA-C 109.57 -0.53 . . . . 0.0 109.57 -177.67 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -107.56 134.99 49.77 Favored 'General case' 0 C--N 1.289 -2.058 0 CA-C-O 121.639 0.733 . . . . 0.0 112.001 179.839 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 66.9 m-85 -101.18 105.49 16.63 Favored 'General case' 0 C--N 1.287 -2.121 0 N-CA-C 107.182 -1.414 . . . . 0.0 107.182 172.137 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 56.5 mtmt -86.1 -7.29 58.7 Favored 'General case' 0 C--N 1.31 -1.109 0 CA-C-N 115.36 -0.836 . . . . 0.0 109.945 -178.652 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 14.9 m -85.88 168.15 14.48 Favored 'General case' 0 N--CA 1.432 -1.364 0 N-CA-C 106.052 -1.833 . . . . 0.0 106.052 171.931 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 18.2 ptpt -95.44 146.34 31.14 Favored Pre-proline 0 C--N 1.301 -1.534 0 C-N-CA 118.998 -1.081 . . . . 0.0 111.262 -179.601 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 6.0 Cg_exo -76.58 138.88 56.87 Favored 'Cis proline' 0 C--N 1.349 0.596 0 C-N-CA 124.045 -1.231 . . . . 0.0 112.235 0.531 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 32.4 Cg_endo -65.74 114.96 3.15 Favored 'Trans proline' 0 C--O 1.239 0.546 0 C-N-CA 122.489 2.126 . . . . 0.0 111.441 -179.896 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 7.3 tp -142.29 132.58 24.08 Favored 'Isoleucine or valine' 0 C--N 1.293 -1.871 0 N-CA-C 108.529 -0.915 . . . . 0.0 108.529 179.219 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -124.23 123.2 39.73 Favored 'General case' 0 N--CA 1.434 -1.267 0 CA-C-O 121.333 0.587 . . . . 0.0 110.006 -178.858 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . 0.465 ' HA ' ' HD3' ' A' ' 13' ' ' PRO . 82.6 m-85 -95.69 132.3 27.65 Favored Pre-proline 0 C--N 1.282 -2.349 0 N-CA-C 108.282 -1.007 . . . . 0.0 108.282 -179.877 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . 0.465 ' HD3' ' HA ' ' A' ' 12' ' ' PHE . 25.6 Cg_exo -60.91 9.33 0.08 OUTLIER 'Trans proline' 0 N--CA 1.491 1.335 0 C-N-CA 124.497 3.464 . . . . 0.0 116.112 -174.047 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 6.7 p-10 . . . . . 0 C--N 1.3 -1.573 0 N-CA-C 108.82 -0.807 . . . . 0.0 108.82 176.48 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 101' ' ' WMH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.44 -1.082 0 N-CA-C 110.856 -0.898 . . . . 0.0 110.856 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 90.7 mtt180 -110.19 97.54 7.0 Favored 'General case' 0 C--N 1.315 -0.912 0 N-CA-C 109.329 -0.619 . . . . 0.0 109.329 -177.744 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -108.59 135.28 50.11 Favored 'General case' 0 C--N 1.303 -1.437 0 CA-C-N 115.356 -0.838 . . . . 0.0 112.862 -179.437 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 55.8 m-85 -92.22 151.93 20.1 Favored 'General case' 0 C--N 1.3 -1.548 0 CA-C-N 114.684 -1.144 . . . . 0.0 109.109 173.718 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -101.95 -1.48 31.85 Favored 'General case' 0 C--N 1.308 -1.219 0 CA-C-O 121.797 0.808 . . . . 0.0 110.59 175.04 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 25.5 m -89.13 130.94 35.49 Favored 'General case' 0 N--CA 1.425 -1.712 0 CA-C-N 115.057 -0.974 . . . . 0.0 108.716 177.29 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . 0.494 ' HA ' ' C ' ' A' ' 8' ' ' PRO . 2.9 mppt? -92.63 141.16 24.22 Favored Pre-proline 0 C--N 1.315 -0.905 0 N-CA-C 109.495 -0.557 . . . . 0.0 109.495 179.486 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . 0.494 ' C ' ' HA ' ' A' ' 7' ' ' LYS . 38.4 Cg_exo -63.1 132.98 12.86 Favored 'Cis proline' 0 C--N 1.353 0.797 0 C-N-CA 124.312 -1.12 . . . . 0.0 111.066 -1.261 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . 0.491 ' HB2' ' N1 ' ' A' ' 101' ' ' WMH . 70.6 Cg_endo -76.86 119.14 5.01 Favored 'Trans proline' 0 N--CA 1.445 -1.33 0 C-N-CA 122.377 2.051 . . . . 0.0 112.718 -173.878 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 73.7 mt -98.29 121.97 49.44 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.708 0 CA-C-N 115.242 -0.89 . . . . 0.0 108.859 178.435 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -127.63 119.18 25.35 Favored 'General case' 0 N--CA 1.439 -0.986 0 CA-C-O 121.095 0.474 . . . . 0.0 109.964 178.182 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 97.3 m-85 -89.6 131.38 40.14 Favored Pre-proline 0 C--N 1.288 -2.092 0 N-CA-C 107.917 -1.142 . . . . 0.0 107.917 175.989 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 81.4 Cg_exo -52.54 -7.73 0.34 Allowed 'Trans proline' 0 N--CA 1.505 2.205 0 C-N-CA 124.932 3.754 . . . . 0.0 115.067 -178.763 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 25.8 t70 . . . . . 0 C--N 1.314 -0.955 0 CA-C-O 121.579 0.704 . . . . 0.0 109.583 174.306 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 101' ' ' WMH . . . . . 0.491 ' N1 ' ' HB2' ' A' ' 9' ' ' PRO . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.423 -2.214 0 N-CA-C 110.677 -0.969 . . . . 0.0 110.677 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 54.5 mtt180 -134.01 105.53 6.76 Favored 'General case' 0 C--N 1.312 -1.026 0 N-CA-C 108.539 -0.911 . . . . 0.0 108.539 -178.048 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -118.98 134.59 55.1 Favored 'General case' 0 C--N 1.298 -1.667 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.631 177.635 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 80.2 m-85 -96.66 129.09 44.13 Favored 'General case' 0 C--N 1.298 -1.647 0 CA-C-N 115.305 -0.861 . . . . 0.0 110.352 177.425 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 34.5 mtmm -90.05 -16.1 30.42 Favored 'General case' 0 C--N 1.306 -1.312 0 CA-C-O 121.71 0.767 . . . . 0.0 109.643 177.674 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 23.0 m -81.12 135.65 35.82 Favored 'General case' 0 N--CA 1.419 -2.014 0 N-CA-C 108.032 -1.099 . . . . 0.0 108.032 175.534 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 2.0 mppt? -80.49 135.84 52.96 Favored Pre-proline 0 C--N 1.305 -1.335 0 N-CA-C 109.681 -0.488 . . . . 0.0 109.681 -176.72 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . 0.46 ' HA ' ' HD3' ' A' ' 9' ' ' PRO . 61.1 Cg_endo -73.43 132.19 25.83 Favored 'Cis proline' 0 CA--C 1.542 0.922 0 C-N-CA 124.131 -1.195 . . . . 0.0 112.848 1.694 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . 0.46 ' HD3' ' HA ' ' A' ' 8' ' ' PRO . 8.9 Cg_exo -72.08 97.11 0.81 Allowed 'Trans proline' 0 N--CA 1.455 -0.766 0 C-N-CA 122.432 2.088 . . . . 0.0 111.272 -179.351 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 61.4 mt -94.69 136.01 27.18 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.798 0 CA-C-N 115.895 -0.593 . . . . 0.0 109.678 179.336 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -124.2 151.81 43.63 Favored 'General case' 0 N--CA 1.437 -1.11 0 CA-C-O 121.407 0.623 . . . . 0.0 110.947 179.22 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 96.4 m-85 -130.09 132.92 24.4 Favored Pre-proline 0 C--N 1.297 -1.683 0 C-N-CA 124.935 1.294 . . . . 0.0 108.301 179.205 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 33.6 Cg_exo -58.84 -12.2 14.24 Favored 'Trans proline' 0 N--CA 1.497 1.733 0 C-N-CA 123.715 2.943 . . . . 0.0 113.135 -178.899 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 11.1 t70 . . . . . 0 C--O 1.241 0.61 0 C-N-CA 124.227 1.011 . . . . 0.0 109.305 175.419 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 101' ' ' WMH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.437 -1.274 0 N-CA-C 110.811 -0.915 . . . . 0.0 110.811 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . 0.475 ' HE ' ' HB2' ' A' ' 14' ' ' ASP . 73.2 mtm180 -103.63 107.27 18.05 Favored 'General case' 0 C--N 1.313 -0.986 0 N-CA-C 109.899 -0.408 . . . . 0.0 109.899 -176.51 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -122.11 146.31 47.34 Favored 'General case' 0 C--N 1.3 -1.566 0 C-N-CA 123.325 0.65 . . . . 0.0 111.573 -179.538 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 97.5 m-85 -115.11 130.56 56.96 Favored 'General case' 0 C--N 1.301 -1.533 0 N-CA-C 108.674 -0.861 . . . . 0.0 108.674 174.758 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 2.6 mppt? -92.88 85.99 5.34 Favored 'General case' 0 N--CA 1.431 -1.384 0 N-CA-C 106.923 -1.51 . . . . 0.0 106.923 176.511 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 13.5 p -139.54 171.28 14.48 Favored 'General case' 0 C--N 1.285 -2.227 0 CA-C-N 114.139 -1.391 . . . . 0.0 108.572 -176.572 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . 0.408 ' HA ' ' HA ' ' A' ' 8' ' ' PRO . 4.8 mptp? -113.5 108.7 51.75 Favored Pre-proline 0 C--N 1.309 -1.167 0 N-CA-C 109.211 -0.663 . . . . 0.0 109.211 174.207 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . 0.429 ' HA ' ' HD3' ' A' ' 9' ' ' PRO . 1.3 Cg_endo -85.21 154.36 59.56 Favored 'Cis proline' 0 C--O 1.245 0.829 0 CA-C-N 119.643 0.908 . . . . 0.0 111.362 0.245 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . 0.429 ' HD3' ' HA ' ' A' ' 8' ' ' PRO . 3.4 Cg_exo -72.63 124.5 9.83 Favored 'Trans proline' 0 N--CA 1.457 -0.623 0 C-N-CA 122.42 2.08 . . . . 0.0 111.87 -178.11 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 48.7 mm -106.75 130.35 58.8 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.212 0 N-CA-C 108.377 -0.971 . . . . 0.0 108.377 179.64 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -134.33 153.99 51.58 Favored 'General case' 0 CA--C 1.508 -0.667 0 CA-C-O 121.251 0.548 . . . . 0.0 110.667 -178.263 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 97.6 m-85 -125.11 131.77 24.16 Favored Pre-proline 0 C--N 1.291 -1.973 0 N-CA-C 106.918 -1.512 . . . . 0.0 106.918 175.098 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 31.3 Cg_exo -59.57 4.13 0.17 Allowed 'Trans proline' 0 N--CA 1.497 1.734 0 C-N-CA 124.444 3.43 . . . . 0.0 115.262 -174.944 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . 0.475 ' HB2' ' HE ' ' A' ' 2' ' ' ARG . 8.5 m-20 . . . . . 0 C--N 1.307 -1.281 0 N-CA-C 108.854 -0.795 . . . . 0.0 108.854 174.338 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 101' ' ' WMH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.485 -1.784 0 N-CA-C 108.767 -1.733 . . . . 0.0 108.767 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 6.9 tpp180 -130.1 103.1 6.55 Favored 'General case' 0 N--CA 1.431 -1.389 0 N-CA-C 108.535 -0.913 . . . . 0.0 108.535 -174.93 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -108.99 133.83 52.45 Favored 'General case' 0 C--N 1.296 -1.732 0 CA-C-O 120.89 0.376 . . . . 0.0 111.816 -179.561 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 96.6 m-85 -119.15 103.76 9.82 Favored 'General case' 0 C--N 1.303 -1.418 0 N-CA-C 108.475 -0.935 . . . . 0.0 108.475 176.399 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 55.7 mtpt -87.05 76.15 9.38 Favored 'General case' 0 N--CA 1.426 -1.658 0 CA-C-O 122.503 1.144 . . . . 0.0 110.827 -178.71 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 56.8 m -150.09 170.77 18.12 Favored 'General case' 0 C--N 1.279 -2.491 0 N-CA-C 104.578 -2.378 . . . . 0.0 104.578 178.25 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 12.0 mptt -91.91 130.19 39.39 Favored Pre-proline 0 C--N 1.299 -1.63 0 CA-C-N 118.789 0.722 . . . . 0.0 110.837 -177.776 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 96.7 Cg_endo -82.66 150.6 71.12 Favored 'Cis proline' 0 C--O 1.245 0.873 0 C-N-CA 123.993 -1.253 . . . . 0.0 111.083 -4.954 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 28.2 Cg_exo -62.2 109.59 0.86 Allowed 'Trans proline' 0 C--N 1.354 0.83 0 C-N-CA 122.355 2.037 . . . . 0.0 111.207 -179.069 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 8.1 tp -118.36 122.53 69.78 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.755 0 CA-C-O 121.341 0.591 . . . . 0.0 110.262 -179.384 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -126.22 126.84 44.71 Favored 'General case' 0 N--CA 1.433 -1.316 0 CA-C-N 115.601 -0.727 . . . . 0.0 109.177 178.728 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 90.7 m-85 -97.69 132.69 24.57 Favored Pre-proline 0 C--N 1.282 -2.352 0 CA-C-N 114.956 -1.02 . . . . 0.0 109.494 -178.676 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 78.4 Cg_exo -49.68 -16.28 1.37 Allowed 'Trans proline' 0 N--CA 1.502 1.982 0 C-N-CA 124.743 3.629 . . . . 0.0 115.036 179.547 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 28.2 t70 . . . . . 0 N--CA 1.479 0.98 0 CA-C-O 121.818 0.818 . . . . 0.0 109.897 175.259 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 101' ' ' WMH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.496 -1.137 0 N-CA-C 110.161 -1.176 . . . . 0.0 110.161 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . 0.549 ' HB3' ' HB2' ' A' ' 12' ' ' PHE . 24.4 ttm180 -132.72 135.07 45.54 Favored 'General case' 0 C--N 1.31 -1.128 0 N-CA-C 107.532 -1.284 . . . . 0.0 107.532 -175.125 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -148.81 134.66 18.95 Favored 'General case' 0 C--N 1.304 -1.406 0 CA-C-O 121.112 0.482 . . . . 0.0 112.005 -175.898 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 80.9 m-85 -90.24 154.59 19.62 Favored 'General case' 0 C--N 1.302 -1.462 0 CA-C-N 115.569 -0.741 . . . . 0.0 109.648 175.964 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 75.2 mmtt -102.87 -0.36 31.34 Favored 'General case' 0 C--N 1.316 -0.869 0 CA-C-O 121.522 0.677 . . . . 0.0 109.739 178.743 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 34.9 m -95.86 170.1 9.54 Favored 'General case' 0 C--N 1.308 -1.212 0 CA-C-N 115.527 -0.76 . . . . 0.0 110.19 179.208 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 35.4 mmtp -98.02 137.15 20.85 Favored Pre-proline 0 C--N 1.308 -1.23 0 N-CA-C 108.538 -0.912 . . . . 0.0 108.538 177.307 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 3.0 Cg_exo -77.83 156.26 95.08 Favored 'Cis proline' 0 C--O 1.251 1.148 0 C-N-CA 124.032 -1.236 . . . . 0.0 111.58 0.164 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 15.0 Cg_exo -66.67 92.11 0.3 Allowed 'Trans proline' 0 N--CA 1.452 -0.929 0 C-N-CA 122.411 2.074 . . . . 0.0 110.596 177.267 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 71.3 mt -98.37 118.22 44.56 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.665 0 CA-C-N 115.472 -0.786 . . . . 0.0 108.96 179.902 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -127.36 150.95 49.37 Favored 'General case' 0 N--CA 1.432 -1.355 0 N-CA-C 109.735 -0.468 . . . . 0.0 109.735 -179.25 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . 0.549 ' HB2' ' HB3' ' A' ' 2' ' ' ARG . 43.2 m-85 -117.82 132.86 23.45 Favored Pre-proline 0 C--N 1.296 -1.754 0 C-N-CA 124.413 1.085 . . . . 0.0 108.406 -179.242 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . 0.402 ' HD3' ' HA ' ' A' ' 12' ' ' PHE . 37.1 Cg_exo -61.53 -2.74 2.8 Favored 'Trans proline' 0 N--CA 1.494 1.523 0 C-N-CA 123.871 3.047 . . . . 0.0 113.44 -178.527 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 33.6 t70 . . . . . 0 C--N 1.32 -0.697 0 C-N-CA 123.802 0.841 . . . . 0.0 109.035 174.0 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 101' ' ' WMH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.432 -1.618 0 CA-C-O 119.771 -0.461 . . . . 0.0 113.43 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . 0.482 ' HB2' ' HB2' ' A' ' 12' ' ' PHE . 65.4 mtp180 -72.39 95.03 1.69 Allowed 'General case' 0 N--CA 1.464 0.256 0 N-CA-C 108.885 -0.783 . . . . 0.0 108.885 176.93 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -107.21 135.1 49.31 Favored 'General case' 0 C--N 1.299 -1.589 0 CA-C-O 121.132 0.492 . . . . 0.0 110.678 -178.927 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 97.2 m-85 -120.86 115.85 24.03 Favored 'General case' 0 C--N 1.293 -1.856 0 CA-C-N 115.168 -0.924 . . . . 0.0 109.552 179.023 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 98.0 mttt -83.06 83.74 7.73 Favored 'General case' 0 N--CA 1.43 -1.454 0 CA-C-O 122.325 1.06 . . . . 0.0 109.051 177.645 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 27.7 m -146.94 171.5 15.14 Favored 'General case' 0 C--N 1.282 -2.349 0 N-CA-C 105.573 -2.01 . . . . 0.0 105.573 -178.914 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . 0.414 ' HA ' ' HA ' ' A' ' 8' ' ' PRO . 63.7 mttp -108.9 119.79 47.91 Favored Pre-proline 0 C--N 1.297 -1.68 0 CA-C-N 118.413 0.551 . . . . 0.0 110.642 177.434 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . 0.414 ' HA ' ' HA ' ' A' ' 7' ' ' LYS . 88.0 Cg_endo -78.53 152.85 90.79 Favored 'Cis proline' 0 CA--C 1.545 1.069 0 C-N-CA 124.662 -0.974 . . . . 0.0 112.712 -2.084 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 37.5 Cg_endo -71.23 107.14 2.06 Favored 'Trans proline' 0 C--O 1.252 1.211 0 C-N-CA 122.504 2.136 . . . . 0.0 112.088 179.107 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 5.7 tp -100.89 128.89 52.6 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.317 0 CA-C-N 115.356 -0.838 . . . . 0.0 110.116 179.766 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . 0.424 ' HA ' ' O ' ' A' ' 2' ' ' ARG . . . -129.62 118.18 21.56 Favored 'General case' 0 N--CA 1.428 -1.565 0 N-CA-C 108.638 -0.875 . . . . 0.0 108.638 177.496 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . 0.482 ' HB2' ' HB2' ' A' ' 2' ' ' ARG . 91.0 m-85 -84.56 132.26 47.37 Favored Pre-proline 0 C--N 1.294 -1.835 0 N-CA-C 108.22 -1.03 . . . . 0.0 108.22 178.168 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 0.4 OUTLIER -25.24 -46.22 0.05 OUTLIER 'Trans proline' 0 C--N 1.356 0.971 1 C-N-CA 126.795 4.996 . . . . 0.0 118.343 -174.275 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . 0.47 ' OD1' ' HG3' ' A' ' 2' ' ' ARG . 5.7 p-10 . . . . . 0 N--CA 1.474 0.771 0 N-CA-C 111.693 0.257 . . . . 0.0 111.693 -176.344 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 101' ' ' WMH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.486 -1.773 0 N-CA-C 108.995 -1.642 . . . . 0.0 108.995 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . 0.502 ' HB3' ' HB2' ' A' ' 12' ' ' PHE . 27.4 ttm180 -137.68 92.41 2.68 Favored 'General case' 0 N--CA 1.431 -1.399 0 N-CA-C 109.289 -0.634 . . . . 0.0 109.289 -175.168 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -109.3 134.46 51.76 Favored 'General case' 0 C--N 1.29 -2.009 0 CA-C-N 115.894 -0.594 . . . . 0.0 111.411 176.817 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 94.4 m-85 -106.61 151.29 25.24 Favored 'General case' 0 C--N 1.298 -1.637 0 CA-C-N 114.994 -1.003 . . . . 0.0 108.415 177.36 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 18.6 ptpt -93.01 -1.73 56.37 Favored 'General case' 0 C--N 1.312 -1.059 0 CA-C-O 121.696 0.76 . . . . 0.0 110.209 -179.223 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 23.5 m -81.66 167.18 19.46 Favored 'General case' 0 N--CA 1.429 -1.496 0 CA-C-N 115.051 -0.977 . . . . 0.0 110.283 179.672 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . 0.458 ' HA ' ' C ' ' A' ' 8' ' ' PRO . 20.0 ptmt -113.56 141.66 26.32 Favored Pre-proline 0 C--N 1.308 -1.222 0 CA-C-N 115.953 -0.567 . . . . 0.0 109.915 179.827 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . 0.458 ' C ' ' HA ' ' A' ' 7' ' ' LYS . 59.3 Cg_endo -68.56 165.45 72.83 Favored 'Cis proline' 0 N--CA 1.483 0.903 0 C-N-CA 124.17 -1.179 . . . . 0.0 112.007 1.394 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 16.1 Cg_exo -63.35 96.88 0.19 Allowed 'Trans proline' 0 C--N 1.354 0.823 0 C-N-CA 122.198 1.932 . . . . 0.0 112.04 179.873 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 10' ' ' ILE . . . . . 0.434 HG13 ' O ' ' A' ' 8' ' ' PRO . 72.8 mt -93.97 107.2 18.98 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.326 0 CA-C-N 115.33 -0.85 . . . . 0.0 109.093 179.281 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -132.41 132.44 42.8 Favored 'General case' 0 N--CA 1.441 -0.884 0 CA-C-O 121.343 0.592 . . . . 0.0 110.355 178.327 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . 0.502 ' HB2' ' HB3' ' A' ' 2' ' ' ARG . 87.8 m-85 -108.96 131.9 21.51 Favored Pre-proline 0 C--N 1.277 -2.556 0 N-CA-C 108.312 -0.995 . . . . 0.0 108.312 176.403 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 11.8 Cg_endo -58.36 -7.99 4.65 Favored 'Trans proline' 0 C--N 1.359 1.124 0 C-N-CA 123.529 2.819 . . . . 0.0 112.956 177.543 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 10.2 t70 . . . . . 0 C--N 1.322 -0.593 0 C-N-CA 123.589 0.756 . . . . 0.0 109.315 171.904 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 101' ' ' WMH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.445 -0.701 0 N-CA-C 114.489 0.555 . . . . 0.0 114.489 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . 0.482 ' O ' ' HA ' ' A' ' 11' ' ' ALA . 26.9 mmm180 -125.09 98.81 5.83 Favored 'General case' 0 C--N 1.31 -1.115 0 CA-C-N 117.51 0.655 . . . . 0.0 110.667 178.592 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -108.08 134.73 50.54 Favored 'General case' 0 C--N 1.306 -1.314 0 N-CA-C 109.719 -0.474 . . . . 0.0 109.719 174.775 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 95.7 m-85 -114.08 125.78 54.35 Favored 'General case' 0 C--N 1.288 -2.098 0 N-CA-C 109.467 -0.568 . . . . 0.0 109.467 178.46 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . 0.493 ' H ' ' HD3' ' A' ' 5' ' ' LYS . 0.0 OUTLIER -72.44 -20.72 61.36 Favored 'General case' 0 C--N 1.316 -0.87 0 O-C-N 123.878 0.736 . . . . 0.0 111.276 -179.694 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 60.6 m -73.86 135.59 43.4 Favored 'General case' 0 N--CA 1.433 -1.292 0 CA-C-O 120.757 0.313 . . . . 0.0 110.24 178.854 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 8.4 mtmp? -82.32 141.3 45.84 Favored Pre-proline 0 C--N 1.313 -1.021 0 CA-C-N 115.756 -0.656 . . . . 0.0 110.926 -175.686 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . 0.465 ' HA ' ' HD3' ' A' ' 9' ' ' PRO . 14.2 Cg_exo -72.46 132.09 24.61 Favored 'Cis proline' 0 C--O 1.242 0.688 0 C-N-CA 123.776 -1.343 . . . . 0.0 110.902 -1.692 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . 0.465 ' HD3' ' HA ' ' A' ' 8' ' ' PRO . 22.5 Cg_exo -65.68 110.45 1.66 Allowed 'Trans proline' 0 N--CA 1.456 -0.694 0 C-N-CA 122.239 1.959 . . . . 0.0 111.296 -178.761 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 6.6 tp -104.68 127.34 59.19 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.736 0 N-CA-C 108.788 -0.819 . . . . 0.0 108.788 178.856 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . 0.482 ' HA ' ' O ' ' A' ' 2' ' ' ARG . . . -122.58 121.41 36.41 Favored 'General case' 0 N--CA 1.429 -1.489 0 CA-C-N 115.981 -0.554 . . . . 0.0 109.854 -179.731 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . 0.42 ' HA ' ' HD3' ' A' ' 13' ' ' PRO . 86.6 m-85 -94.19 131.65 31.0 Favored Pre-proline 0 C--N 1.282 -2.339 0 CA-C-N 114.996 -1.002 . . . . 0.0 108.451 178.605 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . 0.42 ' HD3' ' HA ' ' A' ' 12' ' ' PHE . 63.5 Cg_exo -54.97 -13.3 6.15 Favored 'Trans proline' 0 N--CA 1.494 1.522 0 C-N-CA 124.344 3.362 . . . . 0.0 114.673 -177.852 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 5.2 p-10 . . . . . 0 C--N 1.315 -0.899 0 O-C-N 122.098 -0.376 . . . . 0.0 111.779 178.05 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 101' ' ' WMH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.433 -1.557 0 N-CA-C 110.776 -0.93 . . . . 0.0 110.776 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . 0.495 ' O ' ' HA ' ' A' ' 11' ' ' ALA . 20.3 mmm180 -123.64 97.19 5.27 Favored 'General case' 0 C--N 1.311 -1.081 0 N-CA-C 110.171 -0.307 . . . . 0.0 110.171 -177.646 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -107.2 134.64 49.99 Favored 'General case' 0 C--N 1.293 -1.857 0 CA-C-O 121.116 0.484 . . . . 0.0 110.048 177.507 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 88.9 m-85 -118.93 126.75 52.49 Favored 'General case' 0 C--N 1.302 -1.459 0 CA-C-N 115.444 -0.798 . . . . 0.0 109.303 -179.492 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 54.1 mtmt -88.91 82.91 6.64 Favored 'General case' 0 C--N 1.3 -1.555 0 CA-C-O 121.966 0.889 . . . . 0.0 112.157 -175.163 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 49.8 m -150.49 170.32 19.38 Favored 'General case' 0 C--N 1.292 -1.923 0 N-CA-C 105.938 -1.875 . . . . 0.0 105.938 175.93 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 28.7 mtpp -113.27 125.48 29.62 Favored Pre-proline 0 C--N 1.303 -1.42 0 N-CA-C 108.891 -0.781 . . . . 0.0 108.891 176.951 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 5.6 Cg_exo -75.11 147.08 88.24 Favored 'Cis proline' 0 C--O 1.246 0.922 0 C-N-CA 124.304 -1.123 . . . . 0.0 111.898 0.406 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . 0.45 ' HB2' ' N1 ' ' A' ' 101' ' ' WMH . 36.1 Cg_endo -67.41 114.45 3.27 Favored 'Trans proline' 0 N--CA 1.455 -0.773 0 C-N-CA 122.556 2.17 . . . . 0.0 111.702 179.095 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 51.0 mm -99.5 117.61 44.9 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.512 0 N-CA-C 108.683 -0.858 . . . . 0.0 108.683 -179.956 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . 0.495 ' HA ' ' O ' ' A' ' 2' ' ' ARG . . . -128.2 128.42 44.72 Favored 'General case' 0 N--CA 1.441 -0.888 0 N-CA-C 109.496 -0.557 . . . . 0.0 109.496 178.787 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . 0.433 ' HB2' ' HB2' ' A' ' 2' ' ' ARG . 98.1 m-85 -99.35 131.67 24.66 Favored Pre-proline 0 C--N 1.289 -2.058 0 N-CA-C 108.75 -0.833 . . . . 0.0 108.75 177.072 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 82.5 Cg_exo -50.31 -15.91 1.69 Allowed 'Trans proline' 0 N--CA 1.497 1.716 0 C-N-CA 124.949 3.766 . . . . 0.0 116.113 -176.68 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 24.5 t70 . . . . . 0 N--CA 1.474 0.749 0 CA-C-O 121.351 0.595 . . . . 0.0 110.212 175.483 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 101' ' ' WMH . . . . . 0.45 ' N1 ' ' HB2' ' A' ' 9' ' ' PRO . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.435 -1.389 0 N-CA-C 109.575 -1.41 . . . . 0.0 109.575 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 38.7 ttm180 -150.98 120.08 6.73 Favored 'General case' 0 C--N 1.303 -1.439 0 N-CA-C 108.744 -0.836 . . . . 0.0 108.744 -175.969 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -129.76 135.49 48.51 Favored 'General case' 0 C--N 1.305 -1.365 0 CA-C-O 121.066 0.46 . . . . 0.0 110.885 -178.734 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 56.7 m-85 -89.18 115.97 27.09 Favored 'General case' 0 C--N 1.297 -1.715 0 CA-C-N 115.321 -0.854 . . . . 0.0 108.793 176.243 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 95.2 mttt -82.04 72.06 9.09 Favored 'General case' 0 C--N 1.317 -0.806 0 CA-C-O 121.76 0.79 . . . . 0.0 110.034 -179.171 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 26.9 m -146.56 166.66 25.82 Favored 'General case' 0 C--N 1.29 -2.011 0 N-CA-C 106.627 -1.62 . . . . 0.0 106.627 179.858 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 28.1 mtpp -114.11 116.36 44.72 Favored Pre-proline 0 C--N 1.291 -1.944 0 N-CA-C 108.949 -0.76 . . . . 0.0 108.949 175.849 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 3.2 Cg_exo -81.87 147.48 68.31 Favored 'Cis proline' 0 CA--C 1.541 0.861 0 C-N-CA 124.813 -0.911 . . . . 0.0 112.987 2.755 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . 0.439 ' HB2' ' N1 ' ' A' ' 101' ' ' WMH . 74.1 Cg_endo -82.47 126.94 4.91 Favored 'Trans proline' 0 N--CA 1.447 -1.211 0 C-N-CA 122.467 2.111 . . . . 0.0 112.887 -179.214 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 68.4 mt -102.92 130.46 52.98 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.796 0 N-CA-C 107.289 -1.375 . . . . 0.0 107.289 175.898 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -127.22 153.94 45.47 Favored 'General case' 0 C--N 1.311 -1.087 0 N-CA-C 109.555 -0.535 . . . . 0.0 109.555 179.46 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 89.9 m-85 -124.47 131.73 24.21 Favored Pre-proline 0 C--N 1.295 -1.762 0 CA-C-N 115.627 -0.715 . . . . 0.0 109.324 178.496 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 77.9 Cg_exo -46.5 -19.49 0.7 Allowed 'Trans proline' 0 N--CA 1.501 1.915 1 C-N-CA 125.372 4.048 . . . . 0.0 115.858 -177.565 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 32.1 t70 . . . . . 0 C--N 1.319 -0.753 0 CA-C-O 121.162 0.506 . . . . 0.0 110.765 177.335 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 101' ' ' WMH . . . . . 0.439 ' N1 ' ' HB2' ' A' ' 9' ' ' PRO . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.435 -1.379 0 N-CA-C 112.094 -0.402 . . . . 0.0 112.094 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 33.4 ttm180 -143.9 128.09 17.68 Favored 'General case' 0 C--N 1.312 -1.051 0 N-CA-C 109.101 -0.703 . . . . 0.0 109.101 179.146 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -120.91 135.52 55.17 Favored 'General case' 0 C--N 1.293 -1.857 0 CA-C-O 120.487 0.184 . . . . 0.0 111.297 178.78 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 96.8 m-85 -101.52 118.78 37.65 Favored 'General case' 0 C--N 1.306 -1.303 0 N-CA-C 108.838 -0.801 . . . . 0.0 108.838 175.716 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 30.2 mmmt -88.18 72.1 9.14 Favored 'General case' 0 N--CA 1.427 -1.595 0 CA-C-O 122.589 1.185 . . . . 0.0 110.913 179.188 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 35.0 m -151.07 170.87 18.34 Favored 'General case' 0 C--N 1.293 -1.852 0 CA-C-N 113.308 -1.769 . . . . 0.0 106.324 178.795 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 19.7 ptpt -98.51 135.65 21.07 Favored Pre-proline 0 C--N 1.295 -1.798 0 N-CA-C 107.406 -1.331 . . . . 0.0 107.406 170.949 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 74.3 Cg_endo -81.25 160.56 82.0 Favored 'Cis proline' 0 CA--C 1.54 0.8 0 C-N-CA 123.533 -1.444 . . . . 0.0 111.277 0.473 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 33.6 Cg_endo -66.41 95.43 0.32 Allowed 'Trans proline' 0 N--CA 1.452 -0.917 0 C-N-CA 121.909 1.739 . . . . 0.0 111.202 177.927 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 49.7 mm -106.72 115.21 47.76 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.46 0 N-CA-C 108.487 -0.931 . . . . 0.0 108.487 179.633 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -125.89 138.97 53.83 Favored 'General case' 0 C--N 1.295 -1.792 0 N-CA-C 107.447 -1.316 . . . . 0.0 107.447 178.196 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 22.2 m-30 -96.11 131.97 27.78 Favored Pre-proline 0 C--N 1.288 -2.077 0 N-CA-C 108.758 -0.83 . . . . 0.0 108.758 179.841 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 13.7 Cg_endo -57.92 -10.77 8.29 Favored 'Trans proline' 0 C--N 1.356 0.925 0 C-N-CA 123.84 3.026 . . . . 0.0 113.704 -179.032 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 24.4 t70 . . . . . 0 C--N 1.317 -0.812 0 CA-C-O 121.446 0.641 . . . . 0.0 110.123 174.754 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 101' ' ' WMH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.44 -1.074 0 N-CA-C 111.986 -0.446 . . . . 0.0 111.986 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 21.4 ttm180 -115.94 114.03 24.1 Favored 'General case' 0 C--N 1.316 -0.862 0 C-N-CA 120.713 -0.395 . . . . 0.0 110.053 -178.869 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -108.25 135.51 49.45 Favored 'General case' 0 C--N 1.304 -1.379 0 C-N-CA 123.169 0.587 . . . . 0.0 111.694 -178.542 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 4' ' ' TYR . . . . . 0.45 ' HB2' ' H ' ' A' ' 10' ' ' ILE . 12.1 m-85 -89.81 122.14 32.61 Favored 'General case' 0 C--N 1.301 -1.523 0 N-CA-C 108.641 -0.874 . . . . 0.0 108.641 173.43 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . 0.489 ' HD2' ' N ' ' A' ' 5' ' ' LYS . 0.1 OUTLIER -84.0 -22.61 31.31 Favored 'General case' 0 C--N 1.303 -1.425 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.058 -177.218 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 41.4 m -84.5 141.73 30.54 Favored 'General case' 0 N--CA 1.43 -1.464 0 N-CA-C 109.081 -0.711 . . . . 0.0 109.081 176.245 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 38.1 ttpt -67.82 138.98 93.21 Favored Pre-proline 0 C--N 1.308 -1.214 0 C-N-CA 123.504 0.722 . . . . 0.0 109.407 178.581 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . 0.445 ' HA ' ' HD3' ' A' ' 9' ' ' PRO . 74.3 Cg_endo -77.15 134.22 34.36 Favored 'Cis proline' 0 C--N 1.351 0.671 0 C-N-CA 123.882 -1.299 . . . . 0.0 111.566 -0.965 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . 0.445 ' HD3' ' HA ' ' A' ' 8' ' ' PRO . 21.9 Cg_exo -65.58 105.1 0.72 Allowed 'Trans proline' 0 N--CA 1.457 -0.655 0 C-N-CA 122.017 1.811 . . . . 0.0 111.081 179.916 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 10' ' ' ILE . . . . . 0.45 ' H ' ' HB2' ' A' ' 4' ' ' TYR . 67.8 mt -108.58 128.26 64.38 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.554 0 N-CA-C 107.725 -1.213 . . . . 0.0 107.725 178.207 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -123.09 112.51 17.83 Favored 'General case' 0 N--CA 1.433 -1.278 0 CA-C-O 121.249 0.547 . . . . 0.0 109.764 -179.808 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 92.6 m-85 -79.5 132.1 63.03 Favored Pre-proline 0 C--N 1.289 -2.025 0 CA-C-N 115.039 -0.982 . . . . 0.0 109.487 -179.962 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 84.5 Cg_exo -48.8 -21.32 3.54 Favored 'Trans proline' 0 N--CA 1.495 1.575 0 C-N-CA 124.696 3.597 . . . . 0.0 114.65 -177.2 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 19.2 t70 . . . . . 0 N--CA 1.469 0.486 0 C-N-CA 123.14 0.576 . . . . 0.0 110.376 177.345 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 101' ' ' WMH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.436 -1.366 0 N-CA-C 111.542 -0.623 . . . . 0.0 111.542 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . 0.47 ' O ' ' HA ' ' A' ' 11' ' ' ALA . 78.5 mtp180 -117.83 102.35 9.03 Favored 'General case' 0 C--N 1.313 -0.995 0 O-C-N 122.568 -0.372 . . . . 0.0 110.521 -179.019 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -107.9 134.56 50.65 Favored 'General case' 0 C--N 1.3 -1.55 0 CA-C-N 115.634 -0.712 . . . . 0.0 109.195 179.002 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 62.9 m-85 -103.75 154.55 19.44 Favored 'General case' 0 C--N 1.295 -1.79 0 CA-C-N 115.726 -0.67 . . . . 0.0 110.936 179.749 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -88.19 -27.66 21.68 Favored 'General case' 0 C--N 1.313 -0.991 0 N-CA-C 108.615 -0.883 . . . . 0.0 108.615 -178.467 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 11.8 p -62.79 135.53 57.39 Favored 'General case' 0 N--CA 1.433 -1.283 0 CA-C-N 115.093 -0.958 . . . . 0.0 111.021 -179.572 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 96.6 mttt -90.97 139.67 25.94 Favored Pre-proline 0 C--N 1.309 -1.164 0 N-CA-C 110.164 -0.31 . . . . 0.0 110.164 -178.66 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . 0.492 ' HA ' ' HD3' ' A' ' 9' ' ' PRO . 57.1 Cg_endo -73.16 133.11 29.04 Favored 'Cis proline' 0 C--O 1.245 0.855 0 C-N-CA 123.73 -1.363 . . . . 0.0 110.948 -3.005 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . 0.492 ' HD3' ' HA ' ' A' ' 8' ' ' PRO . 22.1 Cg_exo -65.65 115.21 3.26 Favored 'Trans proline' 0 N--CA 1.453 -0.861 0 C-N-CA 122.053 1.835 . . . . 0.0 111.636 -178.231 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 7.9 tp -97.9 136.3 29.27 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.741 0 N-CA-C 107.815 -1.18 . . . . 0.0 107.815 177.212 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . 0.47 ' HA ' ' O ' ' A' ' 2' ' ' ARG . . . -123.74 112.37 17.26 Favored 'General case' 0 N--CA 1.436 -1.163 0 N-CA-C 109.333 -0.617 . . . . 0.0 109.333 177.527 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 93.9 m-85 -79.48 132.57 61.7 Favored Pre-proline 0 C--N 1.294 -1.816 0 N-CA-C 108.341 -0.985 . . . . 0.0 108.341 178.55 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 8.5 Cg_endo -48.3 -21.17 2.85 Favored 'Trans proline' 0 N--CA 1.496 1.649 0 C-N-CA 124.975 3.784 . . . . 0.0 115.561 -175.558 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 34.0 t70 . . . . . 0 N--CA 1.473 0.715 0 CA-C-O 121.668 0.747 . . . . 0.0 110.375 177.908 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 101' ' ' WMH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.436 -1.305 0 CA-C-O 120.242 -0.199 . . . . 0.0 112.695 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 71.6 ttt180 -152.64 129.88 11.24 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 116.79 0.295 . . . . 0.0 110.252 177.843 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -130.56 134.71 47.24 Favored 'General case' 0 C--N 1.305 -1.345 0 C-N-CA 123.078 0.551 . . . . 0.0 111.298 178.711 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 58.7 m-85 -92.77 137.85 32.0 Favored 'General case' 0 C--N 1.31 -1.144 0 CA-C-N 115.908 -0.587 . . . . 0.0 110.151 177.047 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 75.7 mmtt -88.53 -43.94 11.04 Favored 'General case' 0 C--N 1.303 -1.445 0 N-CA-C 109.094 -0.706 . . . . 0.0 109.094 179.322 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 37.5 m -79.9 155.78 27.6 Favored 'General case' 0 N--CA 1.437 -1.084 0 CA-C-N 115.42 -0.809 . . . . 0.0 110.502 179.74 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 53.0 mtmt -79.74 136.88 54.74 Favored Pre-proline 0 C--N 1.313 -1.019 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.144 -178.238 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . 0.449 ' HA ' ' HD3' ' A' ' 9' ' ' PRO . 78.1 Cg_endo -75.28 127.81 15.24 Favored 'Cis proline' 0 CA--C 1.54 0.822 0 C-N-CA 123.988 -1.255 . . . . 0.0 112.84 2.774 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . 0.449 ' HD3' ' HA ' ' A' ' 8' ' ' PRO . 3.4 Cg_exo -79.44 87.69 1.52 Allowed 'Trans proline' 0 N--CA 1.436 -1.896 0 C-N-CA 121.748 1.632 . . . . 0.0 109.79 178.574 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 13.3 tt -105.61 140.15 24.57 Favored 'Isoleucine or valine' 0 C--N 1.291 -1.964 0 N-CA-C 108.57 -0.9 . . . . 0.0 108.57 179.029 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -118.15 145.49 44.88 Favored 'General case' 0 N--CA 1.422 -1.861 0 N-CA-C 108.41 -0.959 . . . . 0.0 108.41 178.955 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 48.0 m-85 -110.12 131.7 21.85 Favored Pre-proline 0 C--N 1.276 -2.588 0 N-CA-C 108.038 -1.097 . . . . 0.0 108.038 178.487 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 37.2 Cg_endo -65.87 3.17 1.31 Allowed 'Trans proline' 0 N--CA 1.486 1.033 0 C-N-CA 123.592 2.861 . . . . 0.0 112.716 -179.969 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 51.3 m-20 . . . . . 0 C--N 1.321 -0.667 0 N-CA-C 108.993 -0.743 . . . . 0.0 108.993 176.827 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 101' ' ' WMH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.433 -1.524 0 N-CA-C 111.212 -0.755 . . . . 0.0 111.212 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 4.4 tpp180 -143.34 105.24 4.36 Favored 'General case' 0 C--N 1.31 -1.119 0 N-CA-C 109.781 -0.451 . . . . 0.0 109.781 179.236 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -108.14 135.26 49.78 Favored 'General case' 0 C--N 1.294 -1.823 0 CA-C-N 115.868 -0.606 . . . . 0.0 110.286 179.003 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 47.0 m-85 -98.16 139.68 33.6 Favored 'General case' 0 C--N 1.298 -1.654 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.66 178.561 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 18.8 ptmt -94.44 12.4 27.32 Favored 'General case' 0 C--N 1.309 -1.188 0 CA-C-O 122.006 0.908 . . . . 0.0 109.702 -179.955 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 41.5 m -75.75 171.02 15.08 Favored 'General case' 0 C--N 1.308 -1.219 0 CA-C-N 114.185 -1.371 . . . . 0.0 109.734 176.097 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . 0.428 ' HA ' ' HA ' ' A' ' 8' ' ' PRO . 24.1 ttmm -108.15 118.24 53.0 Favored Pre-proline 0 C--N 1.304 -1.373 0 N-CA-C 109.673 -0.492 . . . . 0.0 109.673 177.581 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . 0.428 ' HA ' ' HA ' ' A' ' 7' ' ' LYS . 93.7 Cg_endo -83.49 159.54 73.03 Favored 'Cis proline' 0 C--O 1.243 0.771 0 C-N-CA 124.327 -1.114 . . . . 0.0 111.218 -2.469 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 28.8 Cg_endo -67.41 104.43 0.91 Allowed 'Trans proline' 0 N--CA 1.451 -1.012 0 C-N-CA 121.818 1.679 . . . . 0.0 111.56 178.905 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 7.6 tp -100.72 138.61 24.41 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.284 0 N-CA-C 108.185 -1.042 . . . . 0.0 108.185 176.891 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -128.65 150.39 50.25 Favored 'General case' 0 N--CA 1.43 -1.433 0 N-CA-C 109.311 -0.626 . . . . 0.0 109.311 -177.797 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 90.3 m-85 -107.94 132.05 21.31 Favored Pre-proline 0 C--N 1.288 -2.075 0 N-CA-C 107.414 -1.328 . . . . 0.0 107.414 174.548 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 21.1 Cg_endo -61.34 -5.68 5.66 Favored 'Trans proline' 0 N--CA 1.485 0.988 0 C-N-CA 123.73 2.953 . . . . 0.0 114.501 -175.758 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 8.7 m-20 . . . . . 0 C--N 1.309 -1.169 0 CA-C-N 116.109 -0.496 . . . . 0.0 109.749 175.087 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 101' ' ' WMH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.438 -1.199 0 N-CA-C 111.698 -0.561 . . . . 0.0 111.698 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . 0.451 ' HB2' ' HB2' ' A' ' 12' ' ' PHE . 95.7 mtt180 -132.53 93.58 3.26 Favored 'General case' 0 C--N 1.317 -0.837 0 CA-C-O 120.92 0.39 . . . . 0.0 110.828 -179.109 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -107.89 137.2 46.3 Favored 'General case' 0 C--N 1.294 -1.834 0 CA-C-N 115.417 -0.811 . . . . 0.0 110.412 177.056 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 53.6 m-85 -115.47 126.2 54.02 Favored 'General case' 0 C--N 1.295 -1.778 0 N-CA-C 107.65 -1.241 . . . . 0.0 107.65 178.944 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -83.66 70.4 10.31 Favored 'General case' 0 C--N 1.309 -1.191 0 CA-C-O 122.751 1.263 . . . . 0.0 111.221 -177.362 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 53.7 m -148.33 158.08 43.88 Favored 'General case' 0 C--N 1.301 -1.505 0 CA-C-N 114.634 -1.166 . . . . 0.0 108.295 179.422 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . 0.425 ' HA ' ' C ' ' A' ' 8' ' ' PRO . 7.8 ptpp? -112.95 133.62 21.95 Favored Pre-proline 0 C--N 1.31 -1.123 0 N-CA-C 110.05 -0.352 . . . . 0.0 110.05 179.474 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . 0.425 ' C ' ' HA ' ' A' ' 7' ' ' LYS . 12.8 Cg_exo -69.05 138.11 45.56 Favored 'Cis proline' 0 C--N 1.356 0.969 0 C-N-CA 124.334 -1.111 . . . . 0.0 111.814 1.42 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 35.3 Cg_endo -66.01 121.47 8.8 Favored 'Trans proline' 0 C--O 1.24 0.613 0 C-N-CA 122.655 2.236 . . . . 0.0 112.537 -177.163 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 48.6 mm -110.24 121.74 63.59 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.618 0 N-CA-C 107.808 -1.182 . . . . 0.0 107.808 178.564 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -134.29 120.54 20.07 Favored 'General case' 0 CA--C 1.491 -1.327 0 N-CA-C 109.609 -0.515 . . . . 0.0 109.609 179.765 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . 0.451 ' HB2' ' HB2' ' A' ' 2' ' ' ARG . 99.9 m-85 -90.47 128.25 49.65 Favored Pre-proline 0 C--N 1.288 -2.07 0 N-CA-C 107.411 -1.329 . . . . 0.0 107.411 175.082 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 12.5 Cg_endo -53.8 -20.43 17.37 Favored 'Trans proline' 0 N--CA 1.484 0.927 0 C-N-CA 124.307 3.338 . . . . 0.0 114.593 -172.627 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 17.5 m-20 . . . . . 0 C--N 1.316 -0.866 0 C-N-CA 123.303 0.641 . . . . 0.0 111.73 -179.091 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 101' ' ' WMH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 stop_ save_